*HEADER    LIPID BINDING PROTEIN                   07-MAR-13   2M5R              
*TITLE     SOLUTION STRUCTURE OF HOLO-ACYL CARRIER PROTEIN OF LEISHMANIA MAJOR   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ACYL CARRIER PROTEIN;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: LEISHMANIA MAJOR;                               
*SOURCE   3 ORGANISM_TAXID: 5664;                                                
*SOURCE   4 GENE: ACP, LMJF_27_0290;                                             
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET 28 A(+)                               
*KEYWDS    LIPID BINDING PROTEIN                                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.KUMAR, A.SUROLIA, M.SUNDD                                           
*REVDAT   1   17-SEP-14 2M5R    0                                                


##
assign (resid 2 and name HB#)(resid 3 and name HN) 3.4 1.6 1.0
assign (resid 2 and name HN)(resid 2 and name HA) 2.8 1.0 0.0
assign (resid 2 and name HN)(resid 2 and name HB#) 3.2 1.6 1.0
assign (resid 3 and name HA)(resid 2 and name HB#) 3.4 1.6 1.0
assign (resid 3 and name HA)(resid 3 and name HB1) 2.8 1.0 0.0
assign (resid 3 and name HA)(resid 3 and name HN) 2.8 1.0 0.0
assign (resid 3 and name HN)(resid 2 and name HA) 3.4 1.6 0.0
assign (resid 3 and name HN)(resid 3 and name HA) 2.8 1.0 0.0
assign (resid 3 and name HN)(resid 3 and name HB1) 4.0 2.2 1.0
assign (resid 3 and name HN)(resid 3 and name HB2) 4.0 2.2 1.0
assign (resid 3 and name HN)(resid 4 and name HN) 3.4 1.6 0.0
assign (resid 4 and name HA)(resid 4 and name HB) 2.8 1.0 0.0
assign (resid 4 and name HA)(resid 4 and name HG#) 4.0 2.2 2.0
assign (resid 4 and name HA)(resid 51 and name HE#) 4.0 2.2 3.0
assign (resid 4 and name HA)(resid 6 and name HN) 4.0 2.2 1.0
assign (resid 4 and name HA)(resid 7 and name HN) 4.0 2.2 1.0
assign (resid 4 and name HA)(resid 8 and name HB) 4.0 2.2 1.0
assign (resid 4 and name HA)(resid 8 and name HG11) 4.0 2.2 1.0
assign (resid 4 and name HA)(resid 8 and name HN) 4.0 2.2 1.0
assign (resid 4 and name HB)(resid 4 and name HA) 2.8 1.0 0.0
assign (resid 4 and name HB)(resid 70 and name HG#) 5.0 3.2 3.0
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assign (resid 4 and name HG#)(resid 74 and name HN) 4.0 2.2 3.0
assign (resid 4 and name HG11)(resid 4 and name HG21) 4.0 2.2 1.0
assign (resid 4 and name HG11)(resid 8 and name HB) 4.0 2.2 1.0
assign (resid 4 and name HG#)(resid 4 and name HA) 4.0 2.2 2.0
assign (resid 4 and name HG#)(resid 51 and name HB1) 4.0 2.2 3.0
assign (resid 4 and name HG#)(resid 51 and name HB2) 4.0 2.2 3.0
assign (resid 4 and name HG#)(resid 51 and name HD#) 4.0 2.2 4.0
assign (resid 4 and name HG#)(resid 51 and name HE#) 4.0 2.2 4.0
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assign (resid 4 and name HG#)(resid 8 and name HG#) 4.0 2.2 3.0
assign (resid 4 and name HN)(resid 2 and name HA) 4.0 2.2 1.0
assign (resid 4 and name HN)(resid 1 and name HA) 4.0 2.2 1.0
assign (resid 4 and name HN)(resid 3 and name HA) 3.4 1.6 0.0
assign (resid 4 and name HN)(resid 3 and name HB#) 3.4 1.6 1.0
assign (resid 4 and name HN)(resid 3 and name HN) 4.0 2.2 1.0
assign (resid 4 and name HN)(resid 4 and name HA) 2.8 1.0 0.0
assign (resid 4 and name HN)(resid 4 and name HB) 4.0 2.2 1.0
assign (resid 4 and name HN)(resid 4 and name HG#) 4.0 2.2 1.0
assign (resid 4 and name HN)(resid 51 and name HE#) 4.0 2.2 3.0
assign (resid 4 and name HN)(resid 5 and name HD11) 4.0 2.2 1.0
assign (resid 4 and name HN)(resid 5 and name HN) 4.0 2.2 1.0
assign (resid 4 and name HN)(resid 74 and name HB1) 4.0 2.2 3.0
assign (resid 5 and name HA)(resid 5 and name HB1) 2.8 1.0 0.0
assign (resid 5 and name HA)(resid 5 and name HB2) 2.8 1.0 0.0
assign (resid 5 and name HA)(resid 5 and name HD11) 4.0 2.2 1.0
assign (resid 5 and name HA)(resid 6 and name HN) 3.4 1.6 0.0
assign (resid 5 and name HA)(resid 8 and name HB) 4.0 2.2 1.0
assign (resid 5 and name HA)(resid 8 and name HN) 4.0 2.2 1.0
assign (resid 5 and name HB1)(resid 5 and name HA) 4.0 2.2 1.0
assign (resid 5 and name HB1)(resid 5 and name HD11) 4.0 2.2 1.0
assign (resid 5 and name HB1)(resid 5 and name HN) 4.0 2.2 1.0
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assign (resid 5 and name HB2)(resid 5 and name HN) 4.0 2.2 1.0
assign (resid 5 and name HB#)(resid 6 and name HN) 3.4 1.6 1.0
assign (resid 5 and name HB#)(resid 70 and name HG#) 5.0 3.2 2.0
assign (resid 5 and name HD11)(resid 5 and name HA) 4.0 2.2 1.0
assign (resid 5 and name HD11)(resid 5 and name HB#) 4.0 2.2 2.0
assign (resid 5 and name HD11)(resid 5 and name HN) 4.0 2.2 1.0
assign (resid 5 and name HD11)(resid 6 and name HN) 4.0 2.2 1.0
assign (resid 5 and name HN)(resid 2 and name HA) 4.0 2.2 1.0
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assign (resid 5 and name HN)(resid 4 and name HN) 4.0 2.2 1.0
assign (resid 5 and name HN)(resid 5 and name HA) 2.8 1.0 0.0
assign (resid 5 and name HN)(resid 5 and name HB1) 4.0 2.2 1.0
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assign (resid 5 and name HN)(resid 5 and name HD11) 4.0 2.2 1.0
assign (resid 5 and name HN)(resid 6 and name HN) 4.0 2.2 1.0
assign (resid 5 and name HN)(resid 9 and name HB#) 4.0 2.2 2.0
assign (resid 5 and name HN)(resid 9 and name HN) 4.0 2.2 1.0
assign (resid 6 and name HA)(resid 2 and name HB#) 4.0 2.2 2.0
assign (resid 6 and name HA)(resid 5 and name HB1) 4.0 2.2 2.0
assign (resid 6 and name HA)(resid 5 and name HB2) 4.0 2.2 1.0
assign (resid 6 and name HA)(resid 6 and name HG1) 4.0 2.2 1.0
assign (resid 6 and name HA)(resid 6 and name HN) 2.8 1.0 0.0
assign (resid 6 and name HA)(resid 7 and name HN) 3.4 1.6 0.0
assign (resid 6 and name HA)(resid 8 and name HN) 4.0 2.2 1.0
assign (resid 6 and name HG1)(resid 6 and name HA) 4.0 2.2 1.0
assign (resid 6 and name HG1)(resid 6 and name HB) 3.4 1.6 0.0
assign (resid 6 and name HG1)(resid 7 and name HA) 4.0 2.2 1.0
assign (resid 6 and name HG1)(resid 7 and name HN) 4.0 2.2 1.0
assign (resid 6 and name HN)(resid 2 and name HA) 4.0 2.2 1.0
assign (resid 6 and name HN)(resid 5 and name HA) 4.0 2.2 1.0
assign (resid 6 and name HN)(resid 5 and name HB#) 4.0 2.2 2.0
assign (resid 6 and name HN)(resid 5 and name HD11) 4.0 2.2 1.0
assign (resid 6 and name HN)(resid 6 and name HA) 2.8 1.0 0.0
assign (resid 6 and name HN)(resid 6 and name HB) 4.0 2.2 1.0
assign (resid 6 and name HN)(resid 6 and name HG1) 4.0 2.2 2.0
assign (resid 6 and name HN)(resid 7 and name HN) 4.0 2.2 1.0
assign (resid 6 and name HN)(resid 9 and name HN) 4.0 2.2 1.0
assign (resid 7 and name HA)(resid 10 and name HN) 4.0 2.2 1.0
assign (resid 7 and name HA)(resid 6 and name HG1) 4.0 2.2 1.0
assign (resid 7 and name HA)(resid 7 and name HB1) 4.0 2.2 1.0
assign (resid 7 and name HA)(resid 7 and name HD2) 4.0 2.2 1.0
assign (resid 7 and name HA)(resid 7 and name HN) 2.8 1.0 0.0
assign (resid 7 and name HD#)(resid 46 and name HB1) 4.0 2.2 3.0
assign (resid 7 and name HN)(resid 3 and name HA) 4.0 2.2 1.0
assign (resid 7 and name HN)(resid 7 and name HA) 2.8 1.0 0.0
assign (resid 7 and name HN)(resid 7 and name HB1) 4.0 2.2 1.0
assign (resid 7 and name HN)(resid 7 and name HB2) 4.0 2.2 1.0
assign (resid 7 and name HN)(resid 8 and name HA) 4.0 2.2 1.0
assign (resid 7 and name HN)(resid 8 and name HN) 3.4 1.6 0.0
assign (resid 8 and name HA)(resid 10 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HA)(resid 11 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HA)(resid 12 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HA)(resid 51 and name HE#) 4.0 2.2 3.0
assign (resid 8 and name HA)(resid 7 and name HA) 4.0 2.2 1.0
assign (resid 8 and name HA)(resid 8 and name HB) 4.0 2.2 1.0
assign (resid 8 and name HA)(resid 8 and name HG11) 4.0 2.2 1.0
assign (resid 8 and name HA)(resid 8 and name HG21) 3.4 1.6 0.0
assign (resid 8 and name HA)(resid 8 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HB)(resid 4 and name HG#) 4.0 2.2 2.0
assign (resid 8 and name HB)(resid 5 and name HA) 4.0 2.2 1.0
assign (resid 8 and name HB)(resid 8 and name HG11) 4.0 2.2 1.0
assign (resid 8 and name HB)(resid 8 and name HG21) 4.0 2.2 1.0
assign (resid 8 and name HB)(resid 8 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HG11)(resid 4 and name HA) 4.0 2.2 1.0
assign (resid 8 and name HG11)(resid 8 and name HB) 3.4 1.6 0.0
assign (resid 8 and name HG11)(resid 8 and name HG21) 4.0 2.2 1.0
assign (resid 8 and name HG11)(resid 8 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HG11)(resid 8 and name HA) 4.0 2.2 1.0
assign (resid 8 and name HG21)(resid 8 and name HG11) 4.0 2.2 1.0
assign (resid 8 and name HG21)(resid 8 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HG21)(resid 8 and name HA) 4.0 2.2 1.0
assign (resid 8 and name HG#)(resid 11 and name HB ) 4.0 2.2 2.0
assign (resid 8 and name HG#)(resid 11 and name HN) 4.0 2.2 2.0
assign (resid 8 and name HG#)(resid 12 and name HN) 4.0 2.2 2.0
assign (resid 8 and name HG#)(resid 4 and name HG#) 5.0 3.2 2.0
assign (resid 8 and name HG#)(resid 66 and name HG21) 4.0 2.2 5.0
assign (resid 8 and name HG#)(resid 73 and name HD11) 4.0 2.2 3.0
assign (resid 8 and name HG#)(resid 9 and name HA) 4.0 2.2 2.0
assign (resid 8 and name HN)(resid 10 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HN)(resid 4 and name HA) 4.0 2.2 1.0
assign (resid 8 and name HN)(resid 51 and name HD#) 5.0 3.2 3.0
assign (resid 8 and name HN)(resid 51 and name HE#) 4.0 2.2 3.0
assign (resid 8 and name HN)(resid 5 and name HA) 4.0 2.2 1.0
assign (resid 8 and name HN)(resid 5 and name HB#) 4.0 2.2 2.0
assign (resid 8 and name HN)(resid 6 and name HA) 4.0 2.2 1.0
assign (resid 8 and name HN)(resid 6 and name HN) 4.0 2.2 1.0
assign (resid 8 and name HN)(resid 8 and name HA) 2.8 1.0 0.0
assign (resid 8 and name HN)(resid 8 and name HB) 4.0 2.2 1.0
assign (resid 8 and name HN)(resid 8 and name HG11) 4.0 2.2 1.0
assign (resid 8 and name HN)(resid 8 and name HG21) 4.0 2.2 1.0
assign (resid 9 and name HA)(resid 11 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HA)(resid 8 and name HG#) 4.0 2.2 2.0
assign (resid 9 and name HA)(resid 9 and name HB1) 4.0 2.2 1.0
assign (resid 9 and name HA)(resid 9 and name HB2) 4.0 2.2 1.0
assign (resid 9 and name HA)(resid 9 and name HD11) 4.0 2.2 1.0
assign (resid 9 and name HA)(resid 9 and name HG) 4.0 2.2 1.0
assign (resid 9 and name HA)(resid 9 and name HN) 2.8 1.0 0.0
assign (resid 9 and name HB1)(resid 9 and name HA) 4.0 2.2 1.0
assign (resid 9 and name HB1)(resid 9 and name HG) 2.8 1.0 0.0
assign (resid 9 and name HB#)(resid 10 and name HB#) 5.0 3.2 2.0
assign (resid 9 and name HB#)(resid 13 and name HG2) 4.0 2.2 2.0
assign (resid 9 and name HD11)(resid 23 and name HG11) 4.0 2.2 3.0
assign (resid 9 and name HB#)(resid 5 and name HN) 4.0 2.2 2.0
assign (resid 9 and name HB#)(resid 9 and name HD11) 4.0 2.2 2.0
assign (resid 9 and name HB#)(resid 9 and name HD21) 4.0 2.2 2.0
assign (resid 9 and name HD11)(resid 10 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HD11)(resid 13 and name HA) 4.0 2.2 2.0
assign (resid 9 and name HD11)(resid 13 and name HD2) 4.0 2.2 1.0
assign (resid 9 and name HD11)(resid 9 and name HA) 4.0 2.2 1.0
assign (resid 9 and name HD11)(resid 9 and name HB1) 4.0 2.2 1.0
assign (resid 9 and name HD11)(resid 9 and name HB2) 4.0 2.2 1.0
assign (resid 9 and name HD11)(resid 9 and name HG) 3.4 1.6 0.0
assign (resid 9 and name HD11)(resid 9 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HD21)(resid 9 and name HB1) 3.4 1.6 0.0
assign (resid 9 and name HD21)(resid 9 and name HG) 3.4 1.6 0.0
assign (resid 9 and name HD21)(resid 9 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HG)(resid 10 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HN)(resid 10 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HN)(resid 11 and name HN) 4.0 2.2 1.0
assign (resid 9 and name HN)(resid 5 and name HA) 4.0 2.2 1.0
assign (resid 9 and name HN)(resid 9 and name HB#) 4.0 2.2 2.0
assign (resid 9 and name HN)(resid 9 and name HG) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 10 and name HB1) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 10 and name HG#) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 10 and name HN) 2.8 1.0 0.0
assign (resid 10 and name HA)(resid 11 and name HN) 3.4 1.6 0.0
assign (resid 10 and name HA)(resid 12 and name HN) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 13 and name HB1) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 13 and name HB2) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 13 and name HG1) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 13 and name HG2) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 13 and name HN) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 10 and name HA)(resid 9 and name HD11) 4.0 2.2 1.0
assign (resid 10 and name HB1)(resid 10 and name HG#) 3.4 1.6 1.0
assign (resid 10 and name HB#)(resid 11 and name HA) 4.0 2.2 2.0
assign (resid 10 and name HB#)(resid 11 and name HN) 4.0 2.2 2.0
assign (resid 10 and name HB#)(resid 14 and name HN) 4.0 2.2 2.0
assign (resid 10 and name HB#)(resid 9 and name HB#) 5.0 3.2 2.0
assign (resid 10 and name HG1)(resid 10 and name HB#) 3.4 1.6 1.0
assign (resid 10 and name HG1)(resid 11 and name HG#) 4.0 2.2 2.0
assign (resid 10 and name HG1)(resid 9 and name HN) 4.0 2.2 1.0
assign (resid 10 and name HG2)(resid 11 and name HG#) 4.0 2.2 2.0
assign (resid 10 and name HG2)(resid 9 and name HN) 4.0 2.2 1.0
assign (resid 10 and name HG#)(resid 10 and name HA) 4.0 2.2 2.0
assign (resid 10 and name HG#)(resid 10 and name HN) 4.0 2.2 2.0
assign (resid 10 and name HG#)(resid 14 and name HD21) 4.0 2.2 2.0
assign (resid 10 and name HG#)(resid 14 and name HD22) 4.0 2.2 2.0
assign (resid 10 and name HG#)(resid 14 and name HN) 4.0 2.2 2.0
assign (resid 10 and name HG#)(resid 6 and name HG1) 4.0 2.2 2.0
assign (resid 10 and name HG#)(resid 6 and name HG21) 4.0 2.2 2.0
assign (resid 10 and name HN)(resid 10 and name HA) 2.8 1.0 0.0
assign (resid 10 and name HN)(resid 10 and name HB#) 4.0 2.2 2.0
assign (resid 10 and name HN)(resid 10 and name HG#) 4.0 2.2 2.0
assign (resid 10 and name HN)(resid 11 and name HG#) 4.0 2.2 2.0
assign (resid 10 and name HN)(resid 11 and name HN) 4.0 2.2 1.0
assign (resid 10 and name HN)(resid 13 and name HB#) 4.0 2.2 2.0
assign (resid 10 and name HN)(resid 6 and name HA) 4.0 2.2 1.0
assign (resid 10 and name HN)(resid 7 and name HA) 4.0 2.2 1.0
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assign (resid 10 and name HN)(resid 9 and name HD11) 4.0 2.2 1.0
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assign (resid 11 and name HA)(resid 10 and name HB#) 4.0 2.2 1.0
assign (resid 11 and name HA)(resid 11 and name HB) 2.8 1.0 0.0
assign (resid 11 and name HA)(resid 11 and name HG11) 4.0 2.2 1.0
assign (resid 11 and name HA)(resid 11 and name HG21) 4.0 2.2 1.0
assign (resid 11 and name HA)(resid 11 and name HN) 2.8 1.0 0.0
assign (resid 11 and name HA)(resid 12 and name HN) 3.4 1.6 0.0
assign (resid 11 and name HA)(resid 13 and name HN) 4.0 2.2 1.0
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assign (resid 11 and name HA)(resid 14 and name HD22) 4.0 2.2 1.0
assign (resid 11 and name HA)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 11 and name HB)(resid 11 and name HA) 2.8 1.0 0.0
assign (resid 11 and name HB)(resid 11 and name HG11) 3.4 1.6 0.0
assign (resid 11 and name HB)(resid 11 and name HG21) 3.4 1.6 0.0
assign (resid 11 and name HB)(resid 11 and name HN) 4.0 2.2 1.0
assign (resid 11 and name HB)(resid 12 and name HN) 4.0 2.2 1.0
assign (resid 11 and name HB)(resid 7 and name HD2) 4.0 2.2 1.0
assign (resid 11 and name HG11)(resid 10 and name HG#) 4.0 2.2 2.0
assign (resid 11 and name HG11)(resid 11 and name HA) 4.0 2.2 1.0
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assign (resid 11 and name HG11)(resid 11 and name HN) 4.0 2.2 1.0
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assign (resid 11 and name HG21)(resid 43 and name HG#) 4.0 2.2 3.0
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assign (resid 11 and name HG21)(resid 10 and name HG#) 4.0 2.2 2.0
assign (resid 11 and name HG21)(resid 11 and name HA) 4.0 2.2 1.0
assign (resid 11 and name HG21)(resid 11 and name HB) 3.4 1.6 0.0
assign (resid 11 and name HG21)(resid 11 and name HN) 4.0 2.2 1.0
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assign (resid 11 and name HG#)(resid 10 and name HN) 4.0 2.2 2.0
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assign (resid 11 and name HG#)(resid 8 and name HN) 4.0 2.2 2.0
assign (resid 11 and name HN)(resid 10 and name HA) 4.0 2.2 1.0
assign (resid 11 and name HN)(resid 10 and name HN) 4.0 2.2 1.0
assign (resid 11 and name HN)(resid 11 and name HA) 2.8 1.0 0.0
assign (resid 11 and name HN)(resid 11 and name HB) 4.0 2.2 1.0
assign (resid 11 and name HN)(resid 11 and name HG11) 4.0 2.2 1.0
assign (resid 11 and name HN)(resid 11 and name HG21) 4.0 2.2 1.0
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assign (resid 12 and name HN)(resid 11 and name HG#) 4.0 2.2 2.0
assign (resid 12 and name HN)(resid 11 and name HN) 4.0 2.2 1.0
assign (resid 12 and name HN)(resid 12 and name HB) 4.0 2.2 1.0
assign (resid 12 and name HN)(resid 12 and name HG11) 4.0 2.2 1.0
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assign (resid 12 and name HN)(resid 13 and name HN) 4.0 2.2 1.0
assign (resid 12 and name HN)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 12 and name HN)(resid 8 and name HA) 4.0 2.2 1.0
assign (resid 12 and name HN)(resid 9 and name HA) 4.0 2.2 1.0
assign (resid 13 and name HB1)(resid 13 and name HA) 4.0 2.2 1.0
assign (resid 13 and name HB1)(resid 13 and name HG#) 3.4 1.6 0.0
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assign (resid 13 and name HB#)(resid 13 and name HD2) 3.4 1.6 1.0
assign (resid 13 and name HB#)(resid 13 and name HN) 4.0 2.2 2.0
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assign (resid 13 and name HD2)(resid 13 and name HG1) 3.4 1.6 0.0
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assign (resid 13 and name HD2)(resid 13 and name HN) 4.0 2.2 1.0
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assign (resid 13 and name HG1)(resid 13 and name HB#) 2.8 1.0 0.0
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assign (resid 13 and name HG1)(resid 13 and name HN) 4.0 2.2 1.0
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assign (resid 13 and name HG2)(resid 13 and name HG1) 3.4 1.6 0.0
assign (resid 13 and name HG2)(resid 13 and name HN) 4.0 2.2 1.0
assign (resid 13 and name HG#)(resid 13 and name HB1) 2.8 1.0 1.0
assign (resid 13 and name HG#)(resid 13 and name HD2) 3.4 1.6 1.0
assign (resid 13 and name HG#)(resid 20 and name HB1) 4.0 2.2 3.0
assign (resid 13 and name HG#)(resid 23 and name HG#) 5.0 3.2 3.0
assign (resid 13 and name HN)(resid 11 and name HN) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 12 and name HA) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 12 and name HG#) 4.0 2.2 2.0
assign (resid 13 and name HN)(resid 12 and name HN) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 13 and name HA) 2.8 1.0 0.0
assign (resid 13 and name HN)(resid 13 and name HB1) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 13 and name HB2) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 13 and name HD2) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 13 and name HE2) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 13 and name HG#) 4.0 2.2 2.0
assign (resid 13 and name HN)(resid 14 and name HD21) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 13 and name HN)(resid 9 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HA)(resid 13 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HA)(resid 13 and name HB#) 4.0 2.2 2.0
assign (resid 14 and name HA)(resid 14 and name HB1) 4.0 2.2 1.0
assign (resid 14 and name HA)(resid 14 and name HB2) 4.0 2.2 1.0
assign (resid 14 and name HA)(resid 14 and name HD22) 4.0 2.2 1.0
assign (resid 14 and name HA)(resid 14 and name HN) 2.8 1.0 0.0
assign (resid 14 and name HA)(resid 15 and name HN) 3.4 1.6 0.0
assign (resid 14 and name HB1)(resid 14 and name HA) 2.8 1.0 0.0
assign (resid 14 and name HB1)(resid 14 and name HD21) 3.4 1.6 0.0
assign (resid 14 and name HB1)(resid 14 and name HD22) 4.0 2.2 1.0
assign (resid 14 and name HB1)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 14 and name HB1)(resid 15 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HB2)(resid 14 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HB2)(resid 14 and name HD21) 5.0 3.2 0.0
assign (resid 14 and name HB2)(resid 14 and name HD22) 5.0 3.2 0.0
assign (resid 14 and name HB2)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 14 and name HB2)(resid 15 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HB#)(resid 11 and name HA) 4.0 2.2 2.0
assign (resid 14 and name HD21)(resid 10 and name HG#) 4.0 2.2 2.0
assign (resid 14 and name HD21)(resid 14 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HD21)(resid 14 and name HB1) 4.0 2.2 1.0
assign (resid 14 and name HD21)(resid 14 and name HB2) 3.4 1.6 0.0
assign (resid 14 and name HD21)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 14 and name HD22)(resid 10 and name HB#) 4.0 2.2 2.0
assign (resid 14 and name HD22)(resid 14 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HD22)(resid 14 and name HB1) 4.0 2.2 1.0
assign (resid 14 and name HD22)(resid 14 and name HB2) 5.0 3.2 0.0
assign (resid 14 and name HD22)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 14 and name HD22)(resid 10 and name HG#) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 10 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 10 and name HB#) 4.0 2.2 2.0
assign (resid 14 and name HN)(resid 10 and name HG#) 4.0 2.2 2.0
assign (resid 14 and name HN)(resid 11 and name HG#) 5.0 3.2 2.0
assign (resid 14 and name HN)(resid 13 and name HA) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 13 and name HB#) 4.0 2.2 2.0
assign (resid 14 and name HN)(resid 13 and name HD2) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 13 and name HN) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 14 and name HA) 2.8 1.0 0.0
assign (resid 14 and name HN)(resid 14 and name HB1) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 14 and name HB2) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 14 and name HD21) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 14 and name HD22) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 15 and name HB2) 4.0 2.2 1.0
assign (resid 14 and name HN)(resid 15 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HA)(resid 14 and name HB1) 4.0 2.2 1.0
assign (resid 15 and name HA)(resid 14 and name HB2) 4.0 2.2 1.0
assign (resid 15 and name HA)(resid 15 and name HB1) 4.0 2.2 1.0
assign (resid 15 and name HA)(resid 15 and name HD#) 4.0 2.2 2.0
assign (resid 15 and name HA)(resid 15 and name HE#) 4.0 2.2 2.0
assign (resid 15 and name HA)(resid 15 and name HN) 2.8 1.0 0.0
assign (resid 15 and name HA)(resid 16 and name HB1) 4.0 2.2 1.0
assign (resid 15 and name HA)(resid 16 and name HG#) 4.0 2.2 3.0
assign (resid 15 and name HA)(resid 16 and name HN) 3.4 1.6 0.0
assign (resid 15 and name HB1)(resid 12 and name HA ) 4.0 2.2 1.0
assign (resid 15 and name HB1)(resid 15 and name HA) 4.0 2.2 1.0
assign (resid 15 and name HB1)(resid 15 and name HD1) 4.0 2.2 1.0
assign (resid 15 and name HB1)(resid 15 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HB1)(resid 16 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HB2)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HB2)(resid 15 and name HA) 4.0 2.2 1.0
assign (resid 15 and name HB2)(resid 15 and name HD1) 3.4 1.6 0.0
assign (resid 15 and name HB2)(resid 15 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HB2)(resid 16 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HD#)(resid 11 and name HG#) 4.0 2.2 3.0
assign (resid 15 and name HD#)(resid 14 and name HN) 4.0 2.2 2.0
assign (resid 15 and name HD#)(resid 15 and name HA) 3.4 1.6 1.0
assign (resid 15 and name HD#)(resid 15 and name HB#) 3.4 1.6 2.0
assign (resid 15 and name HD#)(resid 15 and name HN) 4.0 2.2 2.0
assign (resid 15 and name HD#)(resid 16 and name HN) 4.0 2.2 2.0
assign (resid 15 and name HD#)(resid 43 and name HG#) 5.0 3.2 2.0
assign (resid 15 and name HE#)(resid 15 and name HA) 4.0 2.2 2.0
assign (resid 15 and name HE#)(resid 15 and name HB1) 4.0 2.2 2.0
assign (resid 15 and name HE#)(resid 42 and name HB#) 5.0 3.2 4.0
assign (resid 15 and name HE#)(resid 43 and name HG#) 5.0 3.2 3.0
assign (resid 15 and name HN)(resid 11 and name HA) 4.0 2.2 1.0
assign (resid 15 and name HN)(resid 11 and name HG#) 4.0 2.2 2.0
assign (resid 15 and name HN)(resid 14 and name HA) 4.0 2.2 1.0
assign (resid 15 and name HN)(resid 14 and name HB1) 4.0 2.2 1.0
assign (resid 15 and name HN)(resid 14 and name HB2) 4.0 2.2 1.0
assign (resid 15 and name HN)(resid 14 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HN)(resid 15 and name HA) 2.8 1.0 0.0
assign (resid 15 and name HN)(resid 15 and name HB1) 4.0 2.2 1.0
assign (resid 15 and name HN)(resid 15 and name HB2) 4.0 2.2 1.0
assign (resid 15 and name HN)(resid 15 and name HD#) 4.0 2.2 2.0
assign (resid 15 and name HN)(resid 16 and name HN) 4.0 2.2 1.0
assign (resid 15 and name HN)(resid 43 and name HG11) 5.0 3.2 3.0
assign (resid 16 and name HA)(resid 16 and name HB1) 4.0 2.2 1.0
assign (resid 16 and name HA)(resid 16 and name HG1) 4.0 2.2 1.0
assign (resid 16 and name HA)(resid 16 and name HG2) 4.0 2.2 1.0
assign (resid 16 and name HA)(resid 16 and name HN) 2.8 1.0 0.0
assign (resid 16 and name HA)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HB1)(resid 15 and name HA) 4.0 2.2 1.0
assign (resid 16 and name HB1)(resid 16 and name HG#) 3.4 1.6 1.0
assign (resid 16 and name HB1)(resid 16 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HB1)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HB2)(resid 16 and name HG#) 3.4 1.6 1.0
assign (resid 16 and name HB2)(resid 16 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HB2)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HG1)(resid 16 and name HB1) 2.8 1.0 0.0
assign (resid 16 and name HG1)(resid 16 and name HB2) 2.8 1.0 0.0
assign (resid 16 and name HG1)(resid 16 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HG1)(resid 17 and name HD2) 4.0 2.2 1.0
assign (resid 16 and name HG1)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HG2)(resid 16 and name HB1) 2.8 1.0 0.0
assign (resid 16 and name HG2)(resid 16 and name HB2) 2.8 1.0 0.0
assign (resid 16 and name HG2)(resid 16 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HG2)(resid 17 and name HD2) 4.0 2.2 1.0
assign (resid 16 and name HG2)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HG#)(resid 16 and name HA) 4.0 2.2 2.0
assign (resid 16 and name HN)(resid 15 and name HA) 4.0 2.2 2.0
assign (resid 16 and name HN)(resid 15 and name HB#) 4.0 2.2 2.0
assign (resid 16 and name HN)(resid 15 and name HD#) 4.0 2.2 2.0
assign (resid 16 and name HN)(resid 15 and name HN) 4.0 2.2 1.0
assign (resid 16 and name HN)(resid 16 and name HA) 2.8 1.0 0.0
assign (resid 16 and name HN)(resid 16 and name HB1) 4.0 2.2 1.0
assign (resid 16 and name HN)(resid 16 and name HB2) 4.0 2.2 1.0
assign (resid 16 and name HN)(resid 16 and name HG#) 4.0 2.2 2.0
assign (resid 16 and name HN)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HA)(resid 17 and name HB1) 4.0 2.2 1.0
assign (resid 17 and name HA)(resid 17 and name HB2) 4.0 2.2 1.0
assign (resid 17 and name HA)(resid 17 and name HD#) 4.0 2.2 2.0
assign (resid 17 and name HA)(resid 17 and name HG#) 4.0 2.2 2.0
assign (resid 17 and name HA)(resid 17 and name HN) 2.8 1.0 0.0
assign (resid 17 and name HA)(resid 18 and name HN) 3.4 1.6 0.0
assign (resid 17 and name HB1)(resid 17 and name HA) 2.8 1.0 0.0
assign (resid 17 and name HB1)(resid 17 and name HD2) 4.0 2.2 1.0
assign (resid 17 and name HB1)(resid 17 and name HE2) 4.0 2.2 1.0
assign (resid 17 and name HB1)(resid 17 and name HG#) 3.4 1.6 1.0
assign (resid 17 and name HB1)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HB1)(resid 18 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HB2)(resid 17 and name HA) 4.0 2.2 1.0
assign (resid 17 and name HB2)(resid 17 and name HD2) 3.4 1.6 0.0
assign (resid 17 and name HB2)(resid 17 and name HE2) 3.4 1.6 0.0
assign (resid 17 and name HB2)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HB2)(resid 18 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HB#)(resid 18 and name HG#) 5.0 3.2 2.0
assign (resid 17 and name HD1)(resid 17 and name HA) 4.0 2.2 1.0
assign (resid 17 and name HD1)(resid 17 and name HB1) 4.0 2.2 1.0
assign (resid 17 and name HD1)(resid 17 and name HB2) 4.0 2.2 1.0
assign (resid 17 and name HD1)(resid 17 and name HE1) 3.4 1.6 0.0
assign (resid 17 and name HD1)(resid 17 and name HG#) 3.4 1.6 1.0
assign (resid 17 and name HD1)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HG1)(resid 17 and name HD2) 3.4 1.6 0.0
assign (resid 17 and name HG2)(resid 17 and name HD2) 3.4 1.6 0.0
assign (resid 17 and name HG#)(resid 17 and name HA) 4.0 2.2 2.0
assign (resid 17 and name HG#)(resid 17 and name HB1) 2.8 1.0 1.0
assign (resid 17 and name HG#)(resid 17 and name HB2) 2.8 1.0 1.0
assign (resid 17 and name HG#)(resid 17 and name HN) 4.0 2.2 2.0
assign (resid 17 and name HN)(resid 16 and name HA) 4.0 2.2 1.0
assign (resid 17 and name HN)(resid 16 and name HG#) 4.0 2.2 2.0
assign (resid 17 and name HN)(resid 16 and name HN) 4.0 2.2 1.0
assign (resid 17 and name HN)(resid 17 and name HA) 2.8 1.0 0.0
assign (resid 17 and name HN)(resid 15 and name HA) 4.0 2.2 2.0
assign (resid 17 and name HN)(resid 17 and name HB1) 4.0 2.2 1.0
assign (resid 17 and name HN)(resid 17 and name HB2) 4.0 2.2 1.0
assign (resid 17 and name HN)(resid 17 and name HG1) 4.0 2.2 1.0
assign (resid 17 and name HN)(resid 17 and name HG2) 4.0 2.2 1.0
assign (resid 17 and name HN)(resid 18 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HB)(resid 17 and name HB#) 4.0 2.2 2.0
assign (resid 18 and name HB)(resid 18 and name HA) 2.8 1.0 0.0
assign (resid 18 and name HB)(resid 18 and name HG11) 4.0 2.2 1.0
assign (resid 18 and name HB)(resid 18 and name HG21) 4.0 2.2 1.0
assign (resid 18 and name HB)(resid 18 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HB)(resid 19 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HG11)(resid 18 and name HA) 4.0 2.2 1.0
assign (resid 18 and name HG11)(resid 18 and name HB) 2.8 1.0 0.0
assign (resid 18 and name HG11)(resid 18 and name HG21) 4.0 2.2 1.0
assign (resid 18 and name HG11)(resid 18 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HG11)(resid 19 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HG11)(resid 33 and name HD11) 4.0 2.2 3.0
assign (resid 18 and name HG21)(resid 18 and name HA) 4.0 2.2 1.0
assign (resid 18 and name HG21)(resid 18 and name HB) 2.8 1.0 0.0
assign (resid 18 and name HG21)(resid 18 and name HG11) 4.0 2.2 1.0
assign (resid 18 and name HG21)(resid 18 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HG21)(resid 19 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HG#)(resid 17 and name HB#) 5.0 3.2 2.0
assign (resid 18 and name HN)(resid 15 and name HB#) 4.0 2.2 2.0
assign (resid 18 and name HN)(resid 17 and name HA) 4.0 2.2 1.0
assign (resid 18 and name HN)(resid 17 and name HB1) 4.0 2.2 1.0
assign (resid 18 and name HN)(resid 17 and name HB2) 4.0 2.2 1.0
assign (resid 18 and name HN)(resid 17 and name HD#) 4.0 2.2 2.0
assign (resid 18 and name HN)(resid 17 and name HN) 4.0 2.2 1.0
assign (resid 18 and name HN)(resid 18 and name HA) 2.8 1.0 0.0
assign (resid 18 and name HN)(resid 18 and name HB) 4.0 2.2 1.0
assign (resid 18 and name HN)(resid 18 and name HG11) 4.0 2.2 1.0
assign (resid 18 and name HN)(resid 18 and name HG21) 4.0 2.2 1.0
assign (resid 18 and name HN)(resid 19 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HA)(resid 19 and name HB1) 4.0 2.2 1.0
assign (resid 19 and name HA)(resid 19 and name HB2) 4.0 2.2 1.0
assign (resid 19 and name HA)(resid 19 and name HN) 2.8 1.0 0.0
assign (resid 19 and name HA)(resid 20 and name HN) 3.4 1.6 0.0
assign (resid 19 and name HA)(resid 21 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HA)(resid 22 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HB1)(resid 19 and name HA) 4.0 2.2 1.0
assign (resid 19 and name HB1)(resid 19 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HB1)(resid 20 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HB2)(resid 19 and name HA) 4.0 2.2 1.0
assign (resid 19 and name HB2)(resid 19 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HB2)(resid 20 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HB#)(resid 21 and name HN) 4.0 2.2 2.0
assign (resid 19 and name HB#)(resid 22 and name HG#) 5.0 3.2 2.0
assign (resid 19 and name HN)(resid 18 and name HA) 4.0 2.2 1.0
assign (resid 19 and name HN)(resid 18 and name HB) 4.0 2.2 1.0
assign (resid 19 and name HN)(resid 18 and name HG11) 4.0 2.2 1.0
assign (resid 19 and name HN)(resid 18 and name HG21) 4.0 2.2 1.0
assign (resid 19 and name HN)(resid 18 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HN)(resid 19 and name HA) 2.8 1.0 0.0
assign (resid 19 and name HN)(resid 19 and name HB1) 4.0 2.2 1.0
assign (resid 19 and name HN)(resid 19 and name HB2) 4.0 2.2 1.0
assign (resid 19 and name HN)(resid 20 and name HN) 4.0 2.2 1.0
assign (resid 19 and name HN)(resid 22 and name HB#) 4.0 2.2 2.0
assign (resid 19 and name HN)(resid 22 and name HD2) 4.0 2.2 1.0
assign (resid 20 and name HA)(resid 20 and name HB1) 4.0 2.2 1.0
assign (resid 20 and name HA)(resid 20 and name HN) 2.8 1.0 0.0
assign (resid 20 and name HA)(resid 21 and name HN) 3.4 1.6 0.0
assign (resid 20 and name HA)(resid 22 and name HD2) 4.0 2.2 1.0
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assign (resid 20 and name HB1)(resid 13 and name HE#) 4.0 2.2 3.0
assign (resid 20 and name HB1)(resid 20 and name HA) 4.0 2.2 1.0
assign (resid 20 and name HB1)(resid 20 and name HN) 4.0 2.2 1.0
assign (resid 20 and name HB1)(resid 21 and name HN) 4.0 2.2 1.0
assign (resid 20 and name HB1)(resid 22 and name HN) 4.0 2.2 1.0
assign (resid 20 and name HN)(resid 19 and name HA) 4.0 2.2 1.0
assign (resid 20 and name HN)(resid 19 and name HB1) 4.0 2.2 1.0
assign (resid 20 and name HN)(resid 19 and name HB2) 4.0 2.2 1.0
assign (resid 20 and name HN)(resid 19 and name HN) 4.0 2.2 1.0
assign (resid 20 and name HN)(resid 20 and name HA) 2.8 1.0 0.0
assign (resid 20 and name HN)(resid 20 and name HB1) 4.0 2.2 1.0
assign (resid 20 and name HN)(resid 21 and name HN) 4.0 2.2 1.0
assign (resid 20 and name HN)(resid 22 and name HN) 4.0 2.2 1.0
assign (resid 21 and name HA)(resid 21 and name HB1) 4.0 2.2 1.0
assign (resid 21 and name HA)(resid 21 and name HN) 2.8 1.6 0.0
assign (resid 21 and name HA)(resid 22 and name HN) 3.4 1.6 0.0
assign (resid 21 and name HA)(resid 23 and name HG#) 4.0 2.2 2.0
assign (resid 21 and name HA)(resid 23 and name HN) 4.0 2.2 1.0
assign (resid 21 and name HB1)(resid 21 and name HA) 4.0 2.2 1.0
assign (resid 21 and name HB#)(resid 21 and name HN) 4.0 2.2 2.0
assign (resid 21 and name HN)(resid 19 and name HA) 4.0 2.2 1.0
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assign (resid 21 and name HN)(resid 19 and name HB2) 4.0 2.2 1.0
assign (resid 21 and name HN)(resid 20 and name HB1) 4.0 2.2 1.0
assign (resid 21 and name HN)(resid 20 and name HN) 3.4 1.6 0.0
assign (resid 21 and name HN)(resid 21 and name HA) 2.8 1.0 0.0
assign (resid 21 and name HN)(resid 21 and name HB#) 4.0 2.2 2.0
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assign (resid 21 and name HN)(resid 22 and name HN) 3.4 1.6 0.0
assign (resid 21 and name HN)(resid 23 and name HN) 4.0 2.2 1.0
assign (resid 22 and name HA)(resid 22 and name HB1) 4.0 2.2 1.0
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assign (resid 22 and name HA)(resid 22 and name HG1) 4.0 2.2 1.0
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assign (resid 22 and name HA)(resid 23 and name HN) 3.4 1.6 0.0
assign (resid 22 and name HB1)(resid 22 and name HG#) 3.4 1.6 1.0
assign (resid 22 and name HB1)(resid 23 and name HN) 4.0 2.2 1.0
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assign (resid 22 and name HB#)(resid 22 and name HE2) 3.4 1.6 1.0
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assign (resid 22 and name HE2)(resid 22 and name HG1) 4.0 2.2 1.0
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assign (resid 22 and name HG1)(resid 22 and name HG2) 2.8 1.6 0.0
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assign (resid 22 and name HG#)(resid 22 and name HB1) 2.8 1.0 1.0
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assign (resid 22 and name HG#)(resid 22 and name HE2) 2.8 1.0 1.0
assign (resid 22 and name HG#)(resid 23 and name HN) 4.0 2.2 2.0
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assign (resid 22 and name HN)(resid 21 and name HB#) 4.0 2.2 2.0
assign (resid 22 and name HN)(resid 21 and name HN) 4.0 2.2 1.0
assign (resid 22 and name HN)(resid 22 and name HA) 2.8 1.0 0.0
assign (resid 22 and name HN)(resid 22 and name HB#) 4.0 2.2 2.0
assign (resid 22 and name HN)(resid 22 and name HD1) 4.0 2.2 1.0
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assign (resid 22 and name HN)(resid 22 and name HG1) 4.0 2.2 1.0
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assign (resid 23 and name HA)(resid 22 and name HB#) 4.0 2.2 2.0
assign (resid 23 and name HA)(resid 23 and name HB) 4.0 2.2 1.0
assign (resid 23 and name HA)(resid 23 and name HG#) 4.0 2.2 2.0
assign (resid 23 and name HA)(resid 23 and name HN) 2.8 1.0 0.0
assign (resid 23 and name HA)(resid 24 and name HA) 4.0 2.2 1.0
assign (resid 23 and name HA)(resid 24 and name HB) 4.0 2.2 1.0
assign (resid 23 and name HA)(resid 24 and name HN) 3.4 1.6 0.0
assign (resid 23 and name HB)(resid 23 and name HG11) 3.4 1.6 0.0
assign (resid 23 and name HB)(resid 23 and name HN) 4.0 2.2 1.0
assign (resid 23 and name HG11)(resid 23 and name HN) 4.0 2.2 1.0
assign (resid 23 and name HG#)(resid 9 and name HD11) 4.0 2.2 3.0
assign (resid 23 and name HN)(resid 21 and name HN) 4.0 2.2 1.0
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assign (resid 23 and name HN)(resid 22 and name HA) 3.4 1.6 0.0
assign (resid 23 and name HN)(resid 22 and name HE#) 4.0 2.2 2.0
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assign (resid 71 and name HN)(resid 71 and name HG2) 4.0 2.2 1.0
assign (resid 71 and name HN)(resid 74 and name HB1) 4.0 2.2 1.0
assign (resid 72 and name HA)(resid 72 and name HB1) 4.0 2.2 1.0
assign (resid 72 and name HA)(resid 72 and name HB2) 4.0 2.2 1.0
assign (resid 72 and name HA)(resid 72 and name HN) 2.8 1.0 0.0
assign (resid 72 and name HA)(resid 76 and name HD21) 4.0 2.2 1.0
assign (resid 72 and name HA)(resid 76 and name HD22) 4.0 2.2 1.0
assign (resid 72 and name HA)(resid 76 and name HN) 4.0 2.2 1.0
assign (resid 72 and name HB1)(resid 72 and name HA) 4.0 2.2 1.0
assign (resid 72 and name HB1)(resid 72 and name HN) 4.0 2.2 1.0
assign (resid 72 and name HB1)(resid 73 and name HN) 4.0 2.2 1.0
assign (resid 72 and name HB2)(resid 72 and name HA) 4.0 2.2 1.0
assign (resid 72 and name HB2)(resid 72 and name HN) 4.0 2.2 1.0
assign (resid 72 and name HB2)(resid 73 and name HN) 4.0 2.2 1.0
assign (resid 72 and name HB#)(resid 71 and name HN) 4.0 2.2 2.0
assign (resid 72 and name HD1)(resid 55 and name HG21) 4.0 2.2 3.0
assign (resid 72 and name HD#)(resid 55 and name HG11) 5.0 3.2 2.0
assign (resid 72 and name HD#)(resid 63 and name HD#) 5.0 3.2 2.0
assign (resid 72 and name HD#)(resid 72 and name HA) 4.0 2.2 2.0
assign (resid 72 and name HD#)(resid 72 and name HB#) 3.4 1.6 2.0
assign (resid 72 and name HD#)(resid 72 and name HN) 4.0 2.2 2.0
assign (resid 72 and name HD#)(resid 73 and name HB#) 5.0 3.2 2.0
assign (resid 72 and name HD#)(resid 73 and name HG11) 4.0 2.2 2.0
assign (resid 72 and name HD#)(resid 73 and name HN) 4.0 2.2 2.0
assign (resid 72 and name HE#)(resid 55 and name HG11) 4.0 2.2 2.0
assign (resid 72 and name HE#)(resid 63 and name HD#) 5.0 3.2 2.0
assign (resid 72 and name HE#)(resid 72 and name HB#) 5.0 3.2 2.0
assign (resid 72 and name HE#)(resid 72 and name HN) 4.0 2.2 2.0
assign (resid 72 and name HE#)(resid 73 and name HG11) 4.0 2.2 1.0
assign (resid 72 and name HE#)(resid 73 and name HG21) 4.0 2.2 1.0
assign (resid 72 and name HE#)(resid 73 and name HN) 4.0 2.2 2.0
assign (resid 72 and name HN)(resid 68 and name HA) 4.0 2.2 1.0
assign (resid 72 and name HN)(resid 70 and name HN) 4.0 2.2 1.0
assign (resid 72 and name HN)(resid 71 and name HA) 4.0 2.2 1.0
assign (resid 72 and name HN)(resid 71 and name HB#) 4.0 2.2 2.0
assign (resid 72 and name HN)(resid 71 and name HG#) 4.0 2.2 2.0
assign (resid 72 and name HN)(resid 71 and name HN) 4.0 2.2 1.0
assign (resid 72 and name HN)(resid 72 and name HA) 2.8 1.0 0.0
assign (resid 72 and name HN)(resid 72 and name HB1) 4.0 2.2 1.0
assign (resid 72 and name HN)(resid 72 and name HB2) 4.0 2.2 1.0
assign (resid 72 and name HN)(resid 73 and name HG#) 4.0 2.2 2.0
assign (resid 72 and name HN)(resid 74 and name HN) 4.0 2.2 1.0
assign (resid 73 and name HA)(resid 4 and name HG1) 4.0 2.2 4.0
assign (resid 73 and name HA)(resid 4 and name HG2) 4.0 2.2 4.0
assign (resid 73 and name HA)(resid 73 and name HB) 4.0 2.2 1.0
assign (resid 73 and name HA)(resid 73 and name HD11) 4.0 2.2 1.0
assign (resid 73 and name HA)(resid 73 and name HN) 2.8 1.0 0.0
assign (resid 73 and name HA)(resid 74 and name HN) 3.4 1.6 0.0
assign (resid 73 and name HA)(resid 76 and name HD21) 4.0 2.2 1.0
assign (resid 73 and name HB)(resid 4 and name HG#) 4.0 2.2 3.0
assign (resid 73 and name HB)(resid 73 and name HA) 2.8 1.0 0.0
assign (resid 73 and name HB)(resid 73 and name HG11) 2.8 1.0 0.0
assign (resid 73 and name HB)(resid 73 and name HN) 4.0 2.2 1.0
assign (resid 73 and name HB)(resid 74 and name HN) 4.0 2.2 1.0
assign (resid 73 and name HD11)(resid 51 and name HD#) 4.0 2.2 3.0
assign (resid 73 and name HD11)(resid 73 and name HN) 4.0 2.2 1.0
assign (resid 73 and name HD21)(resid 51 and name HE#) 4.0 2.2 2.0
assign (resid 73 and name HN)(resid 69 and name HA) 6.0 3.2 0.0
assign (resid 73 and name HN)(resid 72 and name HA) 3.4 1.6 0.0
assign (resid 73 and name HN)(resid 72 and name HB1) 4.0 2.2 1.0
assign (resid 73 and name HN)(resid 72 and name HB2) 4.0 2.2 1.0
assign (resid 73 and name HN)(resid 72 and name HN) 4.0 2.2 1.0
assign (resid 73 and name HN)(resid 73 and name HA) 2.8 1.0 0.0
assign (resid 73 and name HN)(resid 73 and name HB) 4.0 2.2 1.0
assign (resid 73 and name HN)(resid 73 and name HD11) 4.0 2.2 1.0
assign (resid 73 and name HN)(resid 74 and name HB1) 4.0 2.2 1.0
assign (resid 73 and name HN)(resid 74 and name HN) 4.0 2.2 1.0
assign (resid 73 and name HN)(resid 76 and name HD21) 4.0 2.2 1.0
assign (resid 73 and name HN)(resid 76 and name HD#) 4.0 2.2 2.0
assign (resid 73 and name HN)(resid 8 and name HD1) 4.0 2.2 3.0
assign (resid 74 and name HA)(resid 74 and name HB1) 4.0 2.2 1.0
assign (resid 74 and name HA)(resid 74 and name HN) 2.8 1.0 0.0
assign (resid 74 and name HA)(resid 75 and name HN) 3.4 1.6 0.0
assign (resid 74 and name HB1)(resid 4 and name HG#) 4.0 2.2 3.0
assign (resid 74 and name HB1)(resid 74 and name HA) 4.0 2.2 1.0
assign (resid 74 and name HB1)(resid 74 and name HN) 4.0 2.2 1.0
assign (resid 74 and name HB1)(resid 75 and name HN) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 4 and name HG#) 4.0 2.2 3.0
assign (resid 74 and name HN)(resid 70 and name HA) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 71 and name HA) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 71 and name HN) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 72 and name HB#) 4.0 2.2 2.0
assign (resid 74 and name HN)(resid 72 and name HN) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 73 and name HA) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 73 and name HN) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 74 and name HA) 2.8 1.0 0.0
assign (resid 74 and name HN)(resid 74 and name HB1) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 75 and name HB#) 4.0 2.2 2.0
assign (resid 74 and name HN)(resid 75 and name HE21) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 75 and name HN) 4.0 2.2 1.0
assign (resid 75 and name HA)(resid 74 and name HA) 4.0 2.2 1.0
assign (resid 75 and name HA)(resid 75 and name HB1) 4.0 2.2 1.0
assign (resid 75 and name HA)(resid 75 and name HN) 2.8 1.0 0.0
assign (resid 75 and name HA)(resid 76 and name HN) 3.4 1.6 0.0
assign (resid 75 and name HA)(resid 78 and name HG#) 4.0 2.2 2.0
assign (resid 75 and name HB1)(resid 75 and name HG#) 2.8 1.0 0.0
assign (resid 75 and name HB#)(resid 75 and name HN) 4.0 2.2 2.0
assign (resid 75 and name HE21)(resid 74 and name HB1) 4.0 2.2 1.0
assign (resid 75 and name HE21)(resid 75 and name HB#) 4.0 2.2 2.0
assign (resid 75 and name HE21)(resid 75 and name HG#) 2.8 1.0 1.0
assign (resid 75 and name HE22)(resid 75 and name HB#) 4.0 2.2 2.0
assign (resid 75 and name HE22)(resid 75 and name HG#) 2.8 1.0 1.0
assign (resid 75 and name HG1)(resid 75 and name HE21) 3.4 1.6 0.0
assign (resid 75 and name HG2)(resid 75 and name HE21) 3.4 1.6 0.0
assign (resid 75 and name HG#)(resid 75 and name HA) 4.0 2.2 2.0
assign (resid 75 and name HG#)(resid 75 and name HN) 4.0 2.2 2.0
assign (resid 75 and name HN)(resid 71 and name HA) 4.0 2.2 1.0
assign (resid 75 and name HN)(resid 72 and name HN) 4.0 2.2 1.0
assign (resid 75 and name HN)(resid 74 and name HA) 4.0 2.2 1.0
assign (resid 75 and name HN)(resid 74 and name HB1) 4.0 2.2 1.0
assign (resid 75 and name HN)(resid 74 and name HN) 4.0 2.2 1.0
assign (resid 75 and name HN)(resid 75 and name HA) 2.8 1.0 0.0
assign (resid 75 and name HN)(resid 75 and name HB#) 2.8 1.0 1.0
assign (resid 75 and name HN)(resid 75 and name HG#) 4.0 2.2 2.0
assign (resid 75 and name HN)(resid 76 and name HN) 4.0 2.2 1.0
assign (resid 76 and name HB1)(resid 76 and name HA) 4.0 2.2 1.0
assign (resid 76 and name HB1)(resid 76 and name HD21) 3.4 1.6 0.0
assign (resid 76 and name HB1)(resid 76 and name HN) 4.0 2.2 1.0
assign (resid 76 and name HB2)(resid 76 and name HA) 4.0 2.2 1.0
assign (resid 76 and name HB2)(resid 76 and name HD21) 3.4 1.6 0.0
assign (resid 76 and name HB2)(resid 76 and name HN) 4.0 2.2 1.0
assign (resid 76 and name HB#)(resid 73 and name HA) 4.0 2.2 2.0
assign (resid 76 and name HB#)(resid 76 and name HD22) 4.0 2.2 1.0
assign (resid 76 and name HD21)(resid 76 and name HA) 4.0 2.2 1.0
assign (resid 76 and name HD21)(resid 76 and name HB1) 3.4 1.6 0.0
assign (resid 76 and name HD21)(resid 76 and name HB2) 3.4 1.6 0.0
assign (resid 76 and name HD21)(resid 76 and name HN) 4.0 2.2 1.0
assign (resid 76 and name HD22)(resid 76 and name HA) 4.0 2.2 1.0
assign (resid 76 and name HD22)(resid 76 and name HB1) 4.0 2.2 1.0
assign (resid 76 and name HD22)(resid 76 and name HB2) 4.0 2.2 1.0
assign (resid 76 and name HN)(resid 72 and name HA) 4.0 2.2 1.0
assign (resid 74 and name HN)(resid 4 and name HG#) 4.0 2.2 3.0
assign (resid 76 and name HN)(resid 75 and name HA) 4.0 2.2 1.0
assign (resid 76 and name HN)(resid 75 and name HN) 4.0 2.2 1.0
assign (resid 76 and name HN)(resid 76 and name HA) 2.8 1.0 0.0
assign (resid 76 and name HN)(resid 76 and name HB1) 5.0 3.2 0.0
assign (resid 76 and name HN)(resid 76 and name HB2) 5.0 3.2 0.0
assign (resid 76 and name HN)(resid 76 and name HD21) 4.0 2.2 1.0
assign (resid 78 and name HA)(resid 78 and name HG1) 4.0 2.2 1.0
assign (resid 78 and name HA)(resid 78 and name HG2) 4.0 2.2 1.0
assign (resid 78 and name HA)(resid 79 and name HN) 3.4 1.6 0.0
assign (resid 78 and name HN)(resid 74 and name HA) 4.0 2.2 1.0
assign (resid 78 and name HN)(resid 77 and name HA) 4.0 2.2 1.0
assign (resid 78 and name HN)(resid 77 and name HB1) 4.0 2.2 1.0
assign (resid 78 and name HN)(resid 77 and name HB2) 4.0 2.2 1.0
assign (resid 78 and name HN)(resid 78 and name HA) 2.8 1.0 0.0
assign (resid 78 and name HN)(resid 78 and name HB#) 4.0 2.2 2.0
assign (resid 78 and name HN)(resid 78 and name HG#) 4.0 2.2 2.0
assign (resid 78 and name HN)(resid 79 and name HB1) 4.0 2.2 1.0
assign (resid 78 and name HN)(resid 79 and name HN) 4.0 2.2 1.0
assign (resid 79 and name HA)(resid 79 and name HN) 2.8 1.0 0.0
assign (resid 79 and name HA)(resid 80 and name HG#) 4.0 2.2 2.0
assign (resid 79 and name HA)(resid 80 and name HN) 3.4 1.6 0.0
assign (resid 79 and name HN)(resid 78 and name HN) 4.0 2.2 1.0
assign (resid 79 and name HN)(resid 79 and name HA) 2.8 1.0 0.0
assign (resid 79 and name HN)(resid 75 and name HA) 4.0 2.2 1.0
assign (resid 79 and name HN)(resid 79 and name HB1) 4.0 2.2 1.0
assign (resid 79 and name HN)(resid 80 and name HN) 4.0 2.2 1.0
assign (resid 80 and name HA)(resid 80 and name HB1) 4.0 2.2 1.0
assign (resid 80 and name HA)(resid 80 and name HD2) 4.0 2.2 1.0
assign (resid 80 and name HA)(resid 80 and name HN) 2.8 1.0 0.0
assign (resid 80 and name HB1)(resid 80 and name HA) 2.8 1.0 0.0
assign (resid 80 and name HB1)(resid 80 and name HG#) 2.8 1.0 0.0
assign (resid 80 and name HB#)(resid 80 and name HB#) 3.4 1.6 2.0
assign (resid 80 and name HB#)(resid 80 and name HD2) 3.4 1.6 1.0
assign (resid 80 and name HB#)(resid 80 and name HN) 4.0 2.2 2.0
assign (resid 80 and name HN)(resid 80 and name HA) 2.8 1.0 0.0
assign (resid 80 and name HN)(resid 80 and name HB#) 4.0 2.2 2.0
assign (resid 80 and name HN)(resid 80 and name HD2) 4.0 2.2 1.0
assign (resid 80 and name HN)(resid 80 and name HG#) 4.0 2.2 1.0
assign (resid 80 and name HN)(resid 76 and name HA) 4.0 2.2 1.0
##
 !! N2 PHI
 assign (resid 2 and name c) (resid 2 and name ca)
        (resid 2 and name n) (resid 1 and name c)   1.0 -66 6 2
 
 !! N2 PSI
 assign (resid 2 and name n) (resid 2 and name ca)
        (resid 2 and name c) (resid 3 and name n)   1.0 -39 7 2
 
 
 !! D3 PHI
 assign (resid 3 and name c) (resid 3 and name ca)
        (resid 3 and name n) (resid 2 and name c)   1.0 -69 17 2
 
 !! D3 PSI
 assign (resid 3 and name n) (resid 3 and name ca)
        (resid 3 and name c) (resid 4 and name n)   1.0 -39.5 13 2
 
 
 !! V4 PHI
 assign (resid 4 and name c) (resid 4 and name ca)
        (resid 4 and name n) (resid 3 and name c)   1.0 -66 5 2
 
 !! V4 PSI
 assign (resid 4 and name n) (resid 4 and name ca)
        (resid 4 and name c) (resid 5 and name n)   1.0 -41 6 2
 
 
 !! L5 PHI
 assign (resid 5 and name c) (resid 5 and name ca)
        (resid 5 and name n) (resid 4 and name c)   1.0 -61 6 2
 
 !! L5 PSI
 assign (resid 5 and name n) (resid 5 and name ca)
        (resid 5 and name c) (resid 6 and name n)   1.0 -40 5 2
 
 !! T6 PHI
 assign (resid 6 and name c) (resid 6 and name ca)
        (resid 5 and name n) (resid 5 and name c)   1.0 -65 8 2
 
 !! T6 PSI
 assign (resid 6 and name n) (resid 6 and name ca)
        (resid 6 and name c) (resid 7 and name n)   1.0 -53 4 2
 
  !! R7 PHI
 assign (resid 7 and name c) (resid 7 and name ca)
        (resid 7 and name n) (resid 6 and name c)   1.0 -71 6 2
 
 !! R7 PSI
 assign (resid 7 and name n) (resid 7 and name ca)
        (resid 7 and name c) (resid 8 and name n)   1.0 -45 6 2

 !! V8 PHI
 assign (resid 8 and name c) (resid 8 and name ca)
        (resid 8 and name n) (resid 7 and name c)   1.0 -63 3 2
 
 !! V8 PSI
 assign (resid 8 and name n) (resid 8 and name ca)
        (resid 8 and name c) (resid 9 and name n)   1.0 -44 6 2

 !! L9 PHI
 assign (resid 9 and name c) (resid 9 and name ca)
        (resid 9 and name n) (resid 8 and name c)   1.0 -61 6 2
 
 !! L9 PSI
 assign (resid 9 and name n) (resid 9 and name ca)
        (resid 9 and name c) (resid 10 and name n)   1.0 -41 4 2

 !! E10 PHI
 assign (resid 10 and name c) (resid 10 and name ca)
        (resid 10 and name n) (resid 9 and name c)   1.0 -62 3 2
 
 !! E10 PSI
 assign (resid 10 and name n) (resid 10 and name ca)
        (resid 10 and name c) (resid 11 and name n)   1.0 -38 4 2

 !! V11 PHI
 assign (resid 11 and name c) (resid 11 and name ca)
        (resid 11 and name n) (resid 10 and name c)   1.0 -63 4 2
 
 !! V11 PSI
 assign (resid 11 and name n) (resid 11 and name ca)
        (resid 11 and name c) (resid 12 and name n)   1.0 -48 7 2

 !! V12 PHI
 assign (resid 12 and name c) (resid 12 and name ca)
        (resid 12 and name n) (resid 11 and name c)   1.0 -62 8 2
 
 !! V12 PSI
 assign (resid 12 and name n) (resid 12 and name ca)
        (resid 12 and name c) (resid 13 and name n)   1.0 -47 5 2

 !! K13 PHI
 assign (resid 13 and name c) (resid 13 and name ca)
        (resid 13 and name n) (resid 12 and name c)   1.0 -65 11 2
 
 !! K13 PSI
 assign (resid 13 and name n) (resid 13 and name ca)
        (resid 13 and name c) (resid 14 and name n)   1.0 -34 15 2

 !! N14 PHI
 assign (resid 14 and name c) (resid 14 and name ca)
        (resid 14 and name n) (resid 13 and name c)   1.0 -92 8 2
 
 !! N14 PSI
 assign (resid 14 and name n) (resid 14 and name ca)
        (resid 14 and name c) (resid 15 and name n)   1.0 0.54 3 2

 !! F15 PHI
 assign (resid 15 and name c) (resid 15 and name ca)
        (resid 15 and name n) (resid 14 and name c)   1.0 -87 26 2
 
 !! F15 PSI
 assign (resid 15 and name n) (resid 15 and name ca)
        (resid 15 and name c) (resid 16 and name n)   1.0 113 15 2

 !! K17 PHI
 assign (resid 17 and name c) (resid 17 and name ca)
        (resid 17 and name n) (resid 16 and name c)   1.0 -75 18 2
 
 !! K17 PSI
 assign (resid 17 and name n) (resid 17 and name ca)
        (resid 17 and name c) (resid 18 and name n)   1.0 -41 8 2

 !! V18 PHI
 assign (resid 18 and name c) (resid 18 and name ca)
        (resid 18 and name n) (resid 17 and name c)   1.0 -168 16 2
 
 !! V18 PSI
 assign (resid 18 and name n) (resid 18 and name ca)
        (resid 18 and name c) (resid 19 and name n)   1.0 164 21 2

 !! D19 PHI
 assign (resid 19 and name c) (resid 19 and name ca)
        (resid 19 and name n) (resid 18 and name c)   1.0 -81 15 2
 
 !! D19 PSI
 assign (resid 19 and name n) (resid 19 and name ca)
        (resid 19 and name c) (resid 20 and name n)   1.0 123 24 2

 !! A20 PHI
 assign (resid 20 and name c) (resid 20 and name ca)
        (resid 20 and name n) (resid 19 and name c)   1.0 -61 5 2
 
 !! A20 PSI
 assign (resid 20 and name n) (resid 20 and name ca)
        (resid 20 and name c) (resid 21 and name n)   1.0 -26 12 2

 !! S21 PHI
 assign (resid 21 and name c) (resid 21 and name ca)
        (resid 21 and name n) (resid 20 and name c)   1.0 -75 8 2
 
 !! S21 PSI
 assign (resid 21 and name n) (resid 21 and name ca)
        (resid 21 and name c) (resid 22 and name n)   1.0 -16 11 2

 !! K22 PHI
 assign (resid 22 and name c) (resid 22 and name ca)
        (resid 22 and name n) (resid 21 and name c)   1.0 -97 21 2
 
 !! K22 PSI
 assign (resid 22 and name n) (resid 22 and name ca)
        (resid 22 and name c) (resid 23 and name n)   1.0 1.0 17 2

 !! V23 PHI
 assign (resid 23 and name c) (resid 23 and name ca)
        (resid 23 and name n) (resid 22 and name c)   1.0 -74 18 2
 
 !! V23 PSI
 assign (resid 23 and name n) (resid 23 and name ca)
        (resid 23 and name c) (resid 24 and name n)   1.0 133 8 2

 !! T24 PHI
 assign (resid 24 and name c) (resid 24 and name ca)
        (resid 24 and name n) (resid 23 and name c)   1.0 -96 18 2
 
 !! T24 PSI
 assign (resid 24 and name n) (resid 24 and name ca)
        (resid 24 and name c) (resid 25 and name n)   1.0 135 34 2

 !! P25 PHI
 assign (resid 25 and name c) (resid 25 and name ca)
        (resid 25 and name n) (resid 24 and name c)   1.0 -62 6 2
 
 !! P25 PSI
 assign (resid 25 and name n) (resid 25 and name ca)
        (resid 25 and name c) (resid 26 and name n)   1.0 -26 9 2

 !! E26 PHI
 assign (resid 26 and name c) (resid 26 and name ca)
        (resid 26 and name n) (resid 25 and name c)   1.0 -88 16 2
 
 !! E26 PSI
 assign (resid 26 and name n) (resid 26 and name ca)
        (resid 26 and name c) (resid 27 and name n)   1.0 2.0 17 2

 !! S27 PHI
 assign (resid 27 and name c) (resid 27 and name ca)
        (resid 27 and name n) (resid 26 and name c)   1.0 -101 41 2
 
 !! S27 PSI
 assign (resid 27 and name n) (resid 27 and name ca)
        (resid 27 and name c) (resid 28 and name n)   1.0 140 8 2

 !! H28 PHI
 assign (resid 28 and name c) (resid 28 and name ca)
        (resid 28 and name n) (resid 27 and name c)   1.0 -104 24 2
 
 !! H28 PSI
 assign (resid 28 and name n) (resid 28 and name ca)
        (resid 28 and name c) (resid 29 and name n)   1.0 136 13 2

 !! F29 PHI
 assign (resid 29 and name c) (resid 29 and name ca)
        (resid 29 and name n) (resid 28 and name c)   1.0 -90 22 2
 
 !! V30 PSI
 assign (resid 30 and name n) (resid 30 and name ca)
        (resid 30 and name c) (resid 31 and name n)   1.0 -39 7 2

 !! K31 PHI
 assign (resid 31 and name c) (resid 31 and name ca)
        (resid 31 and name n) (resid 30 and name c)   1.0 -62 21 2
 
 !! K31 PSI
 assign (resid 31 and name n) (resid 31 and name ca)
        (resid 31 and name c) (resid 32 and name n)   1.0 -35 15 2

 !! D32 PHI
 assign (resid 32 and name c) (resid 32 and name ca)
        (resid 32 and name n) (resid 31 and name c)   1.0 -99 12 2
 
 !! D32 PSI
 assign (resid 32 and name n) (resid 32 and name ca)
        (resid 32 and name c) (resid 33 and name n)   1.0 5.5 5 2

 !! L35 PHI
 assign (resid 35 and name c) (resid 35 and name ca)
        (resid 35 and name n) (resid 34 and name c)   1.0 -78 12 2
 
 !! L35 PSI
 assign (resid 35 and name n) (resid 35 and name ca)
        (resid 35 and name c) (resid 36 and name n)   1.0 141 15 2

 !! S37 PHI
 assign (resid 37 and name c) (resid 37 and name ca)
        (resid 37 and name n) (resid 36 and name c)   1.0 -59 5 2
 
 !! S37 PSI
 assign (resid 37 and name n) (resid 37 and name ca)
        (resid 37 and name c) (resid 38 and name n)   1.0 -48 14 2

 !! L38 PHI
 assign (resid 38 and name c) (resid 38 and name ca)
        (resid 38 and name n) (resid 37 and name c)   1.0 -63 14 2
 
 !! L38 PSI
 assign (resid 38 and name n) (resid 38 and name ca)
        (resid 38 and name c) (resid 39 and name n)   1.0 -25 19 2

 !! D39 PHI
 assign (resid 39 and name c) (resid 39 and name ca)
        (resid 39 and name n) (resid 38 and name c)   1.0 -87 21 2
 
 !! D39 PSI
 assign (resid 39 and name n) (resid 39 and name ca)
        (resid 39 and name c) (resid 40 and name n)   1.0 -108 10 2

 !! V40 PHI
 assign (resid 40 and name c) (resid 40 and name ca)
        (resid 40 and name n) (resid 39 and name c)   1.0 -20 5 2
 
 !! V40 PSI
 assign (resid 40 and name n) (resid 40 and name ca)
        (resid 40 and name c) (resid 41 and name n)   1.0 -37 6 2

 !! V43 PHI
 assign (resid 43 and name c) (resid 43 and name ca)
        (resid 43 and name n) (resid 42 and name c)   1.0 -63 5 2
 
 !! V43 PSI
 assign (resid 43 and name n) (resid 43 and name ca)
        (resid 43 and name c) (resid 44 and name n)   1.0 -47 9 2

 !! V44 PHI
 assign (resid 44 and name c) (resid 44 and name ca)
        (resid 44 and name n) (resid 43 and name c)   1.0 -62 4 2
 
 !! V44 PSI
 assign (resid 44 and name n) (resid 44 and name ca)
        (resid 44 and name c) (resid 42 and name n)   1.0 -41 4 2

 !! F45 PHI
 assign (resid 45 and name c) (resid 45 and name ca)
        (resid 45 and name n) (resid 44 and name c)   1.0 -80 18 2
 
 !! F45 PSI
 assign (resid 45 and name n) (resid 45 and name ca)
        (resid 45 and name c) (resid 46 and name n)   1.0 -20 18 2

 !! A46 PHI
 assign (resid 46 and name c) (resid 46 and name ca)
        (resid 46 and name n) (resid 45 and name c)   1.0 -95 32 2
 
 !! I47 PSI
 assign (resid 47 and name n) (resid 47 and name ca)
        (resid 47 and name c) (resid 48 and name n)   1.0 -41 11 2

 !! E48 PHI
 assign (resid 48 and name c) (resid 48 and name ca)
        (resid 48 and name n) (resid 47 and name c)   1.0 -61 5 2
 
 !! E48 PSI
 assign (resid 48 and name n) (resid 48 and name ca)
        (resid 48 and name c) (resid 49 and name n)   1.0 -42 6 2

 !! Q49 PHI
 assign (resid 49 and name c) (resid 49 and name ca)
        (resid 49 and name n) (resid 48 and name c)   1.0 -70 16 2
 
 !! E50 PSI
 assign (resid 50 and name n) (resid 50 and name ca)
        (resid 50 and name c) (resid 51 and name n)   1.0 45 9 2

 !! I52 PHI
 assign (resid 52 and name c) (resid 52 and name ca)
        (resid 52 and name n) (resid 51 and name c)   1.0 58 7 2
 
 !! I52 PSI
 assign (resid 52 and name n) (resid 52 and name ca)
        (resid 52 and name c) (resid 53 and name n)   1.0 39 13 2

 !! L53 PHI
 assign (resid 53 and name c) (resid 52 and name ca)
        (resid 53 and name n) (resid 52 and name c)   1.0 -106 24 2
 
 !! L53 PSI
 assign (resid 53 and name n) (resid 53 and name ca)
        (resid 53 and name c) (resid 54 and name n)   1.0 151 16 2

 !! D54 PHI
 assign (resid 54 and name c) (resid 54 and name ca)
        (resid 54 and name n) (resid 53 and name c)   1.0 -104 24 2
 
 !! D54 PSI
 assign (resid 54 and name n) (resid 54 and name ca)
        (resid 54 and name c) (resid 55 and name n)   1.0 159 16 2

 !! D59 PHI
 assign (resid 59 and name c) (resid 59 and name ca)
        (resid 59 and name n) (resid 58 and name c)   1.0 -81 21 2
 
 !! D59 PSI
 assign (resid 59 and name n) (resid 59 and name ca)
        (resid 59 and name c) (resid 60 and name n)   1.0 -28 17 2

 !! A60 PHI
 assign (resid 60 and name c) (resid 60 and name ca)
        (resid 60 and name n) (resid 59 and name c)   1.0 -67 21 2
 
 !! A60 PSI
 assign (resid 60 and name n) (resid 60 and name ca)
        (resid 60 and name c) (resid 61 and name n)   1.0 -32 17 2

 !! E61 PHI
 assign (resid 61 and name c) (resid 61 and name ca)
        (resid 61 and name n) (resid 60 and name c)   1.0 -73 21 2
 
 !! E61 PSI
 assign (resid 61 and name n) (resid 61 and name ca)
        (resid 61 and name c) (resid 62 and name n)   1.0 -19 17 2

 !! k62 PHI
 assign (resid 62 and name c) (resid 62 and name ca)
        (resid 62 and name n) (resid 61 and name c)   1.0 -94 21 2
 
 !! K62 PSI
 assign (resid 62 and name n) (resid 62 and name ca)
        (resid 62 and name c) (resid 63 and name n)   1.0 -3 17 2

 !! I63 PHI
 assign (resid 63 and name c) (resid 63 and name ca)
        (resid 63 and name n) (resid 62 and name c)   1.0 -128 21 2
 
 !! I63 PSI
 assign (resid 63 and name n) (resid 63 and name ca)
        (resid 63 and name c) (resid 64 and name n)   1.0 139 17 2

 !! Q64 PHI
 assign (resid 64 and name c) (resid 64 and name ca)
        (resid 64 and name n) (resid 63 and name c)   1.0 -97 21 2
 
 !! Q64 PSI
 assign (resid 64 and name n) (resid 64 and name ca)
        (resid 64 and name c) (resid 65 and name n)   1.0 -25 17 2

 !! A66 PHI
 assign (resid 66 and name c) (resid 66 and name ca)
        (resid 66 and name n) (resid 65 and name c)   1.0 -65 10 2
 
 !! A66 PSI
 assign (resid 66 and name n) (resid 66 and name ca)
        (resid 66 and name c) (resid 67 and name n)   1.0 -32 15 2

 !! I70 PHI
 assign (resid 70 and name c) (resid 70 and name ca)
        (resid 70 and name n) (resid 69 and name c)   1.0 -70 4 2
 
 !! I70 PSI
 assign (resid 70 and name n) (resid 70 and name ca)
        (resid 70 and name c) (resid 71 and name n)   1.0 -31 15 2

 !! Q72 PHI
 assign (resid 72 and name c) (resid 72 and name ca)
        (resid 72 and name n) (resid 71 and name c)   1.0 -65 4 2
 
 !! Q72 PSI
 assign (resid 72 and name n) (resid 72 and name ca)
        (resid 72 and name c) (resid 73 and name n)   1.0 -44 5 2

 !! N73 PHI
 assign (resid 73 and name c) (resid 73 and name ca)
        (resid 73 and name n) (resid 72 and name c)   1.0 -62 6 2
 
 !! N73 PSI
 assign (resid 73 and name n) (resid 73 and name ca)
        (resid 73 and name c) (resid 74 and name n)   1.0 -40 11 2

 !! M74 PHI
 assign (resid 74 and name c) (resid 74 and name ca)
        (resid 74 and name n) (resid 73 and name c)   1.0 -60 5 2
 
 !! M74 PSI
 assign (resid 74 and name n) (resid 74 and name ca)
        (resid 74 and name c) (resid 75 and name n)   1.0 -44 5 2

 !! A75 PHI
 assign (resid 75 and name c) (resid 75 and name ca)
        (resid 75 and name n) (resid 74 and name c)   1.0 -121 41 2
 
!! P77 PHI
 assign (resid 77 and name c) (resid 77 and name ca)
        (resid 77 and name n) (resid 76 and name c)   1.0 -66 41 2
 
 !! P77 PSI
 assign (resid 77 and name n) (resid 77 and name ca)
        (resid 77 and name c) (resid 78 and name n)   1.0 -16 19 2

!! M78 PHI
 assign (resid 78 and name c) (resid 78 and name ca)
        (resid 78 and name n) (resid 77 and name c)   1.0 -90 41 2
 
 !! M78 PSI
 assign (resid 78 and name n) (resid 78 and name ca)
        (resid 78 and name c) (resid 79 and name n)   1.0 0 19 2

##

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1HT      MET   1  -6.889  -7.716  11.667
    2    H2   MET   1           2HT      MET   1  -7.245  -7.554   9.995
    3    H3   MET   1           3HT      MET   1  -6.735  -6.189  10.901
    4    HA   MET   1           HA       MET   1  -4.943  -8.412  10.997
    5    HB2  MET   1           2HB      MET   1  -6.039  -7.447   8.470
    6    HB3  MET   1           1HB      MET   1  -4.291  -7.272   8.552
    7    HG2  MET   1           2HG      MET   1  -5.840  -9.816   8.976
    8    HG3  MET   1           1HG      MET   1  -4.913  -9.384   7.540
    9    HE1  MET   1           2HE      MET   1  -1.496  -9.627   8.122
   10    HE2  MET   1           3HE      MET   1  -2.912  -9.666   7.071
   11    HE3  MET   1           1HE      MET   1  -2.242 -11.170   7.704
   12    H    ASN   2           H        ASN   2  -3.725  -7.352  12.474
   13    HA   ASN   2           HA       ASN   2  -3.218  -4.559  12.375
   14    HB2  ASN   2           2HB      ASN   2  -1.265  -5.526  14.017
   15    HB3  ASN   2           1HB      ASN   2  -2.901  -5.127  14.534
   16   HD21  ASN   2          1HD2      ASN   2  -4.495  -6.901  14.403
   17   HD22  ASN   2          2HD2      ASN   2  -3.961  -8.500  14.784
   18    H    ASP   3           H        ASP   3  -1.574  -7.384  11.198
   19    HA   ASP   3           HA       ASP   3   0.984  -6.450  10.814
   20    HB2  ASP   3           2HB      ASP   3  -0.605  -8.257   8.989
   21    HB3  ASP   3           1HB      ASP   3   1.144  -8.066   8.944
   22    H    VAL   4           H        VAL   4  -1.853  -5.874   8.839
   23    HA   VAL   4           HA       VAL   4  -0.473  -4.584   6.716
   24    HB   VAL   4           HB       VAL   4  -2.765  -3.709   6.106
   25   HG11  VAL   4          1HG1      VAL   4  -1.792  -5.786   5.195
   26   HG12  VAL   4          2HG1      VAL   4  -3.549  -5.860   5.331
   27   HG13  VAL   4          3HG1      VAL   4  -2.537  -6.688   6.515
   28   HG21  VAL   4          3HG2      VAL   4  -4.682  -4.500   7.268
   29   HG22  VAL   4          1HG2      VAL   4  -3.607  -3.786   8.471
   30   HG23  VAL   4          2HG2      VAL   4  -3.705  -5.540   8.303
   31    H    LEU   5           H        LEU   5  -2.298  -3.362   9.509
   32    HA   LEU   5           HA       LEU   5  -1.990  -0.635   8.874
   33    HB2  LEU   5           2HB      LEU   5  -3.161  -2.197  10.960
   34    HB3  LEU   5           1HB      LEU   5  -2.248  -0.878  11.663
   35    HG   LEU   5           HG       LEU   5  -3.663   0.375   9.659
   36   HD11  LEU   5          1HD1      LEU   5  -4.898  -2.027   9.798
   37   HD12  LEU   5          2HD1      LEU   5  -5.697  -0.523   9.338
   38   HD13  LEU   5          3HD1      LEU   5  -5.815  -1.112  10.995
   39   HD21  LEU   5          3HD2      LEU   5  -4.854   0.135  12.379
   40   HD22  LEU   5          1HD2      LEU   5  -4.608   1.565  11.376
   41   HD23  LEU   5          2HD2      LEU   5  -3.241   0.826  12.210
   42    H    THR   6           H        THR   6  -0.055  -2.867  10.718
   43    HA   THR   6           HA       THR   6   1.601  -1.017  12.010
   44    HB   THR   6           HB       THR   6   1.786  -3.106  12.940
   45    HG1  THR   6           1HG      THR   6   3.922  -2.212  11.974
   46   HG21  THR   6          3HG2      THR   6   2.545  -4.885  10.881
   47   HG22  THR   6          1HG2      THR   6   1.092  -4.031  10.362
   48   HG23  THR   6          2HG2      THR   6   1.097  -4.915  11.888
   49    H    ARG   7           H        ARG   7   2.293  -2.950   9.124
   50    HA   ARG   7           HA       ARG   7   4.667  -1.483   8.537
   51    HB2  ARG   7           2HB      ARG   7   4.370  -3.894   7.990
   52    HB3  ARG   7           1HB      ARG   7   3.176  -3.435   6.783
   53    HG2  ARG   7           2HG      ARG   7   5.595  -1.951   6.377
   54    HG3  ARG   7           1HG      ARG   7   5.943  -3.680   6.452
   55    HD2  ARG   7           2HD      ARG   7   5.157  -2.401   4.213
   56    HD3  ARG   7           1HD      ARG   7   4.864  -4.111   4.522
   57    HE   ARG   7           HE       ARG   7   2.904  -1.946   4.727
   58   HH11  ARG   7          1HH1      ARG   7   3.670  -5.339   4.878
   59   HH12  ARG   7          2HH1      ARG   7   2.016  -5.848   4.808
   60   HH21  ARG   7          1HH2      ARG   7   0.722  -2.604   4.637
   61   HH22  ARG   7          2HH2      ARG   7   0.339  -4.293   4.672
   62    H    VAL   8           H        VAL   8   1.396  -1.624   7.243
   63    HA   VAL   8           HA       VAL   8   1.824   0.102   5.064
   64    HB   VAL   8           HB       VAL   8  -0.198  -1.469   5.612
   65   HG11  VAL   8          1HG1      VAL   8  -0.817  -0.269   7.676
   66   HG12  VAL   8          2HG1      VAL   8  -2.133  -0.325   6.504
   67   HG13  VAL   8          3HG1      VAL   8  -1.198   1.156   6.710
   68   HG21  VAL   8          3HG2      VAL   8  -1.104   1.072   4.382
   69   HG22  VAL   8          1HG2      VAL   8  -1.253  -0.587   3.802
   70   HG23  VAL   8          2HG2      VAL   8   0.285   0.264   3.656
   71    H    LEU   9           H        LEU   9   0.459   0.697   8.292
   72    HA   LEU   9           HA       LEU   9   0.058   3.464   7.945
   73    HB2  LEU   9           2HB      LEU   9  -0.564   3.509  10.156
   74    HB3  LEU   9           1HB      LEU   9  -0.798   1.814   9.782
   75    HG   LEU   9           HG       LEU   9   1.579   1.476  10.712
   76   HD11  LEU   9          1HD1      LEU   9   1.387   4.278  10.940
   77   HD12  LEU   9          2HD1      LEU   9   2.695   3.227  11.484
   78   HD13  LEU   9          3HD1      LEU   9   1.369   3.623  12.578
   79   HD21  LEU   9          3HD2      LEU   9   0.662   1.565  13.087
   80   HD22  LEU   9          1HD2      LEU   9  -0.220   0.578  11.921
   81   HD23  LEU   9          2HD2      LEU   9  -0.829   2.173  12.365
   82    H    GLU  10           H        GLU  10   2.747   1.631   9.355
   83    HA   GLU  10           HA       GLU  10   4.280   3.867  10.121
   84    HB2  GLU  10           2HB      GLU  10   6.071   2.334  10.482
   85    HB3  GLU  10           1HB      GLU  10   4.587   1.507  10.937
   86    HG2  GLU  10           2HG      GLU  10   5.068  -0.139   9.547
   87    HG3  GLU  10           1HG      GLU  10   5.064   0.990   8.192
   88    H    VAL  11           H        VAL  11   3.991   2.055   7.175
   89    HA   VAL  11           HA       VAL  11   6.250   2.920   5.821
   90    HB   VAL  11           HB       VAL  11   3.677   1.782   5.055
   91   HG11  VAL  11          1HG1      VAL  11   3.929   3.757   3.548
   92   HG12  VAL  11          2HG1      VAL  11   3.879   2.202   2.718
   93   HG13  VAL  11          3HG1      VAL  11   5.419   3.029   2.949
   94   HG21  VAL  11          3HG2      VAL  11   6.046   0.940   3.615
   95   HG22  VAL  11          1HG2      VAL  11   4.938   0.001   4.616
   96   HG23  VAL  11          2HG2      VAL  11   6.262   0.890   5.366
   97    H    VAL  12           H        VAL  12   2.972   4.214   5.630
   98    HA   VAL  12           HA       VAL  12   3.691   6.451   4.033
   99    HB   VAL  12           HB       VAL  12   1.486   7.042   4.056
  100   HG11  VAL  12          1HG1      VAL  12   0.815   4.391   5.192
  101   HG12  VAL  12          2HG1      VAL  12   1.904   4.422   3.805
  102   HG13  VAL  12          3HG1      VAL  12   0.300   5.144   3.682
  103   HG21  VAL  12          3HG2      VAL  12   1.572   7.586   6.514
  104   HG22  VAL  12          1HG2      VAL  12   1.078   5.921   6.821
  105   HG23  VAL  12          2HG2      VAL  12   0.016   7.005   5.921
  106    H    LYS  13           H        LYS  13   3.024   6.059   7.498
  107    HA   LYS  13           HA       LYS  13   3.229   8.702   8.293
  108    HB2  LYS  13           2HB      LYS  13   3.803   6.099   9.662
  109    HB3  LYS  13           1HB      LYS  13   4.167   7.613  10.479
  110    HG2  LYS  13           2HG      LYS  13   1.865   6.424  10.820
  111    HG3  LYS  13           1HG      LYS  13   1.965   8.188  10.707
  112    HD2  LYS  13           2HD      LYS  13   1.478   7.963   8.257
  113    HD3  LYS  13           1HD      LYS  13   1.168   6.249   8.539
  114    HE2  LYS  13           2HE      LYS  13  -0.332   7.548  10.478
  115    HE3  LYS  13           1HE      LYS  13  -0.525   8.546   9.038
  116    HZ1  LYS  13           3HZ      LYS  13  -1.612   5.970   9.615
  117    HZ2  LYS  13           1HZ      LYS  13  -0.797   5.984   8.132
  118    HZ3  LYS  13           2HZ      LYS  13  -2.054   7.080   8.417
  119    H    ASN  14           H        ASN  14   5.812   6.293   7.933
  120    HA   ASN  14           HA       ASN  14   7.817   8.266   8.560
  121    HB2  ASN  14           2HB      ASN  14   8.251   5.413   7.683
  122    HB3  ASN  14           1HB      ASN  14   9.401   6.464   8.504
  123   HD21  ASN  14          1HD2      ASN  14   7.339   3.965   8.925
  124   HD22  ASN  14          2HD2      ASN  14   7.035   4.113  10.619
  125    H    PHE  15           H        PHE  15   6.105   7.511   5.850
  126    HA   PHE  15           HA       PHE  15   8.271   7.705   3.968
  127    HB2  PHE  15           2HB      PHE  15   5.552   6.811   3.892
  128    HB3  PHE  15           1HB      PHE  15   5.798   8.021   2.639
  129    HD1  PHE  15           2HD      PHE  15   7.627   5.082   4.045
  130    HD2  PHE  15           1HD      PHE  15   6.394   7.233   0.589
  131    HE1  PHE  15           2HE      PHE  15   8.694   3.387   2.615
  132    HE2  PHE  15           1HE      PHE  15   7.459   5.545  -0.849
  133    HZ   PHE  15           HZ       PHE  15   8.612   3.617   0.164
  134    H    GLU  16           H        GLU  16   6.642   9.881   5.814
  135    HA   GLU  16           HA       GLU  16   6.876  12.184   5.812
  136    HB2  GLU  16           2HB      GLU  16   7.993  13.320   4.141
  137    HB3  GLU  16           1HB      GLU  16   8.670  11.712   3.959
  138    HG2  GLU  16           2HG      GLU  16   6.463  11.653   2.339
  139    HG3  GLU  16           1HG      GLU  16   7.078  13.285   2.132
  140    H    LYS  17           H        LYS  17   4.546  10.517   5.190
  141    HA   LYS  17           HA       LYS  17   3.016  12.155   3.366
  142    HB2  LYS  17           2HB      LYS  17   1.715   9.915   4.791
  143    HB3  LYS  17           1HB      LYS  17   1.593  10.396   3.109
  144    HG2  LYS  17           2HG      LYS  17   4.175   9.271   4.032
  145    HG3  LYS  17           1HG      LYS  17   2.807   8.172   3.853
  146    HD2  LYS  17           2HD      LYS  17   3.236  10.070   1.649
  147    HD3  LYS  17           1HD      LYS  17   4.478   8.831   1.846
  148    HE2  LYS  17           2HE      LYS  17   1.680   7.912   2.005
  149    HE3  LYS  17           1HE      LYS  17   2.222   8.469   0.423
  150    HZ1  LYS  17           3HZ      LYS  17   3.444   6.649   0.143
  151    HZ2  LYS  17           1HZ      LYS  17   2.624   5.988   1.467
  152    HZ3  LYS  17           2HZ      LYS  17   4.121   6.743   1.690
  153    H    VAL  18           H        VAL  18   2.917  11.100   6.747
  154    HA   VAL  18           HA       VAL  18   2.052  13.520   7.788
  155    HB   VAL  18           HB       VAL  18  -0.353  12.687   8.398
  156   HG11  VAL  18          1HG1      VAL  18   0.692  14.480   6.551
  157   HG12  VAL  18          2HG1      VAL  18  -0.972  14.413   7.135
  158   HG13  VAL  18          3HG1      VAL  18  -0.523  13.574   5.650
  159   HG21  VAL  18          3HG2      VAL  18  -1.415  11.237   6.938
  160   HG22  VAL  18          1HG2      VAL  18   0.180  10.503   7.099
  161   HG23  VAL  18          2HG2      VAL  18  -0.207  11.464   5.672
  162    H    ASP  19           H        ASP  19   1.988  13.482  10.009
  163    HA   ASP  19           HA       ASP  19   3.121  11.245  11.302
  164    HB2  ASP  19           2HB      ASP  19   2.602  13.959  11.932
  165    HB3  ASP  19           1HB      ASP  19   1.864  12.985  13.198
  166    H    ALA  20           H        ALA  20   2.230   9.573  12.366
  167    HA   ALA  20           HA       ALA  20  -0.458   8.887  11.984
  168    HB1  ALA  20           1HB      ALA  20   0.818   7.617  14.289
  169    HB2  ALA  20           2HB      ALA  20   1.774   7.557  12.808
  170    HB3  ALA  20           3HB      ALA  20   0.139   6.900  12.828
  171    H    SER  21           H        SER  21   1.090  10.761  14.430
  172    HA   SER  21           HA       SER  21  -0.863  10.508  16.455
  173    HB2  SER  21           2HB      SER  21   0.800  12.984  16.130
  174    HB3  SER  21           1HB      SER  21   0.317  12.156  17.611
  175    HG   SER  21           HG       SER  21   2.597  11.930  16.475
  176    H    LYS  22           H        LYS  22  -0.714  12.321  13.541
  177    HA   LYS  22           HA       LYS  22  -2.876  14.085  14.358
  178    HB2  LYS  22           2HB      LYS  22  -2.421  15.372  12.423
  179    HB3  LYS  22           1HB      LYS  22  -0.854  14.921  13.081
  180    HG2  LYS  22           2HG      LYS  22  -1.469  12.879  11.307
  181    HG3  LYS  22           1HG      LYS  22  -2.006  14.352  10.496
  182    HD2  LYS  22           2HD      LYS  22   0.743  13.669  11.507
  183    HD3  LYS  22           1HD      LYS  22   0.247  14.061   9.859
  184    HE2  LYS  22           2HE      LYS  22  -0.524  16.281  11.300
  185    HE3  LYS  22           1HE      LYS  22   1.001  15.819  12.056
  186    HZ1  LYS  22           3HZ      LYS  22   0.736  17.279   9.782
  187    HZ2  LYS  22           1HZ      LYS  22   1.103  15.736   9.191
  188    HZ3  LYS  22           2HZ      LYS  22   2.147  16.493  10.287
  189    H    VAL  23           H        VAL  23  -2.383  11.145  12.739
  190    HA   VAL  23           HA       VAL  23  -4.584  11.273  10.936
  191    HB   VAL  23           HB       VAL  23  -4.237   8.928  10.553
  192   HG11  VAL  23          1HG1      VAL  23  -1.462   9.947  11.017
  193   HG12  VAL  23          2HG1      VAL  23  -2.507  10.706   9.818
  194   HG13  VAL  23          3HG1      VAL  23  -2.093   8.998   9.672
  195   HG21  VAL  23          3HG2      VAL  23  -3.727   7.569  12.233
  196   HG22  VAL  23          1HG2      VAL  23  -3.359   8.946  13.273
  197   HG23  VAL  23          2HG2      VAL  23  -2.099   8.245  12.258
  198    H    THR  24           H        THR  24  -6.676  11.034  11.366
  199    HA   THR  24           HA       THR  24  -7.449   9.824  13.901
  200    HB   THR  24           HB       THR  24  -7.937  12.325  13.422
  201    HG1  THR  24           1HG      THR  24 -10.340  11.312  14.129
  202   HG21  THR  24          3HG2      THR  24 -10.144  12.695  12.386
  203   HG22  THR  24          1HG2      THR  24 -10.126  11.024  11.824
  204   HG23  THR  24          2HG2      THR  24  -8.913  12.164  11.240
  205    HA   PRO  25           HA       PRO  25  -9.817   6.640  12.024
  206    HB2  PRO  25           2HB      PRO  25 -12.256   7.665  13.382
  207    HB3  PRO  25           1HB      PRO  25 -11.526   6.057  13.442
  208    HG2  PRO  25           2HG      PRO  25 -11.306   7.733  15.503
  209    HG3  PRO  25           1HG      PRO  25  -9.956   6.685  15.029
  210    HD2  PRO  25           2HD      PRO  25 -10.348   9.608  14.551
  211    HD3  PRO  25           1HD      PRO  25  -8.860   8.716  14.932
  212    H    GLU  26           H        GLU  26 -11.354   9.823  12.034
  213    HA   GLU  26           HA       GLU  26 -12.701   9.171   9.527
  214    HB2  GLU  26           2HB      GLU  26 -13.954  11.332   9.985
  215    HB3  GLU  26           1HB      GLU  26 -14.272   9.998  11.085
  216    HG2  GLU  26           2HG      GLU  26 -12.742  10.979  12.717
  217    HG3  GLU  26           1HG      GLU  26 -12.431  12.319  11.617
  218    H    SER  27           H        SER  27  -9.824  10.225  10.313
  219    HA   SER  27           HA       SER  27  -9.494  12.729   9.099
  220    HB2  SER  27           2HB      SER  27  -7.547  12.309  10.160
  221    HB3  SER  27           1HB      SER  27  -7.756  10.562  10.036
  222    HG   SER  27           HG       SER  27  -6.392  12.307   8.387
  223    H    HIS  28           H        HIS  28  -9.329  13.377   7.041
  224    HA   HIS  28           HA       HIS  28  -9.753  11.429   4.960
  225    HB2  HIS  28           2HB      HIS  28 -10.638  14.031   5.354
  226    HB3  HIS  28           1HB      HIS  28  -9.473  14.152   4.041
  227    HD1  HIS  28           1HD      HIS  28 -12.850  12.864   4.860
  228    HD2  HIS  28           2HD      HIS  28 -10.183  12.757   1.679
  229    HE1  HIS  28           1HE      HIS  28 -14.184  12.040   2.895
  230    HE2  HIS  28           2HE      HIS  28 -12.524  11.888   1.005
  231    H    PHE  29           H        PHE  29  -8.442  11.212   3.117
  232    HA   PHE  29           HA       PHE  29  -5.659  11.471   3.647
  233    HB2  PHE  29           2HB      PHE  29  -7.090   9.736   2.165
  234    HB3  PHE  29           1HB      PHE  29  -6.537  10.820   0.894
  235    HD1  PHE  29           2HD      PHE  29  -4.522  10.262   3.888
  236    HD2  PHE  29           1HD      PHE  29  -5.200   9.086  -0.147
  237    HE1  PHE  29           2HE      PHE  29  -2.352   9.106   3.865
  238    HE2  PHE  29           1HE      PHE  29  -3.027   7.927  -0.175
  239    HZ   PHE  29           HZ       PHE  29  -1.603   7.937   1.833
  240    H    VAL  30           H        VAL  30  -5.434  11.935   0.544
  241    HA   VAL  30           HA       VAL  30  -4.159  14.180   0.274
  242    HB   VAL  30           HB       VAL  30  -6.512  13.931  -1.561
  243   HG11  VAL  30          1HG1      VAL  30  -4.663  14.422  -3.236
  244   HG12  VAL  30          2HG1      VAL  30  -3.642  14.779  -1.842
  245   HG13  VAL  30          3HG1      VAL  30  -5.102  15.725  -2.132
  246   HG21  VAL  30          3HG2      VAL  30  -4.196  12.040  -1.286
  247   HG22  VAL  30          1HG2      VAL  30  -5.044  12.250  -2.818
  248   HG23  VAL  30          2HG2      VAL  30  -5.918  11.673  -1.398
  249    H    LYS  31           H        LYS  31  -7.605  14.128   0.821
  250    HA   LYS  31           HA       LYS  31  -8.020  16.915   0.612
  251    HB2  LYS  31           2HB      LYS  31  -9.606  14.686   1.860
  252    HB3  LYS  31           1HB      LYS  31 -10.146  16.358   1.933
  253    HG2  LYS  31           2HG      LYS  31 -10.636  16.445  -0.286
  254    HG3  LYS  31           1HG      LYS  31  -9.413  15.252  -0.720
  255    HD2  LYS  31           2HD      LYS  31 -11.630  14.325  -1.040
  256    HD3  LYS  31           1HD      LYS  31 -10.810  13.489   0.279
  257    HE2  LYS  31           2HE      LYS  31 -12.103  14.568   1.913
  258    HE3  LYS  31           1HE      LYS  31 -12.651  15.805   0.783
  259    HZ1  LYS  31           3HZ      LYS  31 -13.352  13.095   0.056
  260    HZ2  LYS  31           1HZ      LYS  31 -14.292  14.503   0.028
  261    HZ3  LYS  31           2HZ      LYS  31 -14.083  13.653   1.475
  262    H    ASP  32           H        ASP  32  -7.683  14.791   3.445
  263    HA   ASP  32           HA       ASP  32  -7.552  17.074   5.196
  264    HB2  ASP  32           2HB      ASP  32  -8.397  14.435   5.505
  265    HB3  ASP  32           1HB      ASP  32  -6.924  14.548   6.462
  266    H    LEU  33           H        LEU  33  -5.405  15.652   3.224
  267    HA   LEU  33           HA       LEU  33  -3.152  16.706   3.399
  268    HB2  LEU  33           2HB      LEU  33  -3.455  15.494   6.135
  269    HB3  LEU  33           1HB      LEU  33  -1.878  15.856   5.460
  270    HG   LEU  33           HG       LEU  33  -3.883  18.050   5.481
  271   HD11  LEU  33          1HD1      LEU  33  -3.076  16.618   7.863
  272   HD12  LEU  33          2HD1      LEU  33  -4.274  17.897   7.664
  273   HD13  LEU  33          3HD1      LEU  33  -2.577  18.308   7.910
  274   HD21  LEU  33          3HD2      LEU  33  -1.164  18.487   6.456
  275   HD22  LEU  33          1HD2      LEU  33  -2.074  19.340   5.211
  276   HD23  LEU  33          2HD2      LEU  33  -1.238  17.838   4.819
  277    H    GLY  34           H        GLY  34  -4.100  14.728   1.880
  278    HA2  GLY  34           2HA      GLY  34  -3.076  12.146   2.422
  279    HA3  GLY  34           1HA      GLY  34  -3.571  12.742   0.848
  280    H    LEU  35           H        LEU  35  -1.559  11.091   0.740
  281    HA   LEU  35           HA       LEU  35   0.960  12.509   0.917
  282    HB2  LEU  35           2HB      LEU  35   2.006  10.423   0.467
  283    HB3  LEU  35           1HB      LEU  35   0.717  10.126   1.620
  284    HG   LEU  35           HG       LEU  35  -0.565   9.660  -0.743
  285   HD11  LEU  35          1HD1      LEU  35   0.820   9.169  -2.398
  286   HD12  LEU  35          2HD1      LEU  35   1.671   8.003  -1.386
  287   HD13  LEU  35          3HD1      LEU  35   2.169   9.694  -1.392
  288   HD21  LEU  35          3HD2      LEU  35  -0.889   7.654   0.189
  289   HD22  LEU  35          1HD2      LEU  35   0.073   8.273   1.531
  290   HD23  LEU  35          2HD2      LEU  35   0.838   7.309   0.267
  291    H    ASN  36           H        ASN  36   2.424  12.654  -0.897
  292    HA   ASN  36           HA       ASN  36   1.373  13.842  -3.145
  293    HB2  ASN  36           2HB      ASN  36   3.742  14.003  -2.449
  294    HB3  ASN  36           1HB      ASN  36   3.992  12.341  -2.966
  295   HD21  ASN  36          1HD2      ASN  36   1.971  14.619  -4.638
  296   HD22  ASN  36          2HD2      ASN  36   2.955  14.764  -6.049
  297    H    SER  37           H        SER  37   1.267  13.159  -5.373
  298    HA   SER  37           HA       SER  37  -0.147  10.787  -5.764
  299    HB2  SER  37           2HB      SER  37   0.479  13.040  -7.294
  300    HB3  SER  37           1HB      SER  37   1.149  11.679  -8.194
  301    H    LEU  38           H        LEU  38   3.143  11.590  -6.795
  302    HA   LEU  38           HA       LEU  38   3.764   8.989  -7.689
  303    HB2  LEU  38           2HB      LEU  38   5.883   9.766  -8.127
  304    HB3  LEU  38           1HB      LEU  38   4.956  11.242  -8.164
  305    HG   LEU  38           HG       LEU  38   7.130  10.459  -6.418
  306   HD11  LEU  38          1HD1      LEU  38   5.913  13.153  -6.935
  307   HD12  LEU  38          2HD1      LEU  38   7.067  12.374  -8.017
  308   HD13  LEU  38          3HD1      LEU  38   7.546  12.795  -6.372
  309   HD21  LEU  38          3HD2      LEU  38   5.796  10.301  -4.578
  310   HD22  LEU  38          1HD2      LEU  38   4.553  11.355  -5.255
  311   HD23  LEU  38          2HD2      LEU  38   6.044  12.046  -4.612
  312    H    ASP  39           H        ASP  39   3.508  10.324  -4.580
  313    HA   ASP  39           HA       ASP  39   5.276   8.432  -3.299
  314    HB2  ASP  39           2HB      ASP  39   5.141  10.557  -2.228
  315    HB3  ASP  39           1HB      ASP  39   3.381  10.534  -2.252
  316    H    VAL  40           H        VAL  40   1.910   8.818  -4.025
  317    HA   VAL  40           HA       VAL  40   0.951   6.756  -2.310
  318    HB   VAL  40           HB       VAL  40  -0.376   8.675  -3.512
  319   HG11  VAL  40          1HG1      VAL  40  -1.087   6.544  -5.428
  320   HG12  VAL  40          2HG1      VAL  40   0.344   7.514  -5.754
  321   HG13  VAL  40          3HG1      VAL  40  -1.232   8.290  -5.585
  322   HG21  VAL  40          3HG2      VAL  40  -1.945   7.677  -2.295
  323   HG22  VAL  40          1HG2      VAL  40  -1.076   6.143  -2.374
  324   HG23  VAL  40          2HG2      VAL  40  -2.230   6.571  -3.639
  325    H    VAL  41           H        VAL  41   1.948   6.943  -5.684
  326    HA   VAL  41           HA       VAL  41   1.180   4.351  -6.455
  327    HB   VAL  41           HB       VAL  41   2.487   4.637  -8.388
  328   HG11  VAL  41          1HG1      VAL  41   1.829   6.743  -9.215
  329   HG12  VAL  41          2HG1      VAL  41   1.904   7.483  -7.615
  330   HG13  VAL  41          3HG1      VAL  41   0.630   6.322  -7.991
  331   HG21  VAL  41          3HG2      VAL  41   4.095   6.727  -6.922
  332   HG22  VAL  41          1HG2      VAL  41   4.342   6.197  -8.585
  333   HG23  VAL  41          2HG2      VAL  41   4.620   5.076  -7.253
  334    H    GLU  42           H        GLU  42   4.325   5.621  -5.351
  335    HA   GLU  42           HA       GLU  42   5.715   3.200  -5.412
  336    HB2  GLU  42           2HB      GLU  42   7.417   4.429  -4.621
  337    HB3  GLU  42           1HB      GLU  42   6.318   5.797  -4.730
  338    HG2  GLU  42           2HG      GLU  42   7.308   5.821  -2.573
  339    HG3  GLU  42           1HG      GLU  42   5.621   5.344  -2.388
  340    H    VAL  43           H        VAL  43   3.820   4.692  -2.856
  341    HA   VAL  43           HA       VAL  43   4.316   2.785  -0.858
  342    HB   VAL  43           HB       VAL  43   3.331   4.624   0.078
  343   HG11  VAL  43          1HG1      VAL  43   2.141   6.156  -1.019
  344   HG12  VAL  43          2HG1      VAL  43   0.958   4.969  -1.568
  345   HG13  VAL  43          3HG1      VAL  43   2.464   5.185  -2.456
  346   HG21  VAL  43          3HG2      VAL  43   2.015   2.416   0.485
  347   HG22  VAL  43          1HG2      VAL  43   0.748   3.259  -0.395
  348   HG23  VAL  43          2HG2      VAL  43   1.390   3.951   1.090
  349    H    VAL  44           H        VAL  44   1.733   3.023  -3.249
  350    HA   VAL  44           HA       VAL  44   0.233   0.812  -2.433
  351    HB   VAL  44           HB       VAL  44  -0.872   0.879  -4.491
  352   HG11  VAL  44          1HG1      VAL  44  -0.250   3.284  -3.199
  353   HG12  VAL  44          2HG1      VAL  44  -1.635   2.947  -4.237
  354   HG13  VAL  44          3HG1      VAL  44  -0.160   3.625  -4.927
  355   HG21  VAL  44          3HG2      VAL  44   1.108   2.463  -5.995
  356   HG22  VAL  44          1HG2      VAL  44   0.065   1.145  -6.527
  357   HG23  VAL  44          2HG2      VAL  44   1.556   0.793  -5.654
  358    H    PHE  45           H        PHE  45   3.145   1.070  -4.340
  359    HA   PHE  45           HA       PHE  45   3.160  -1.627  -5.250
  360    HB2  PHE  45           2HB      PHE  45   5.430   0.359  -5.013
  361    HB3  PHE  45           1HB      PHE  45   5.494  -1.161  -5.897
  362    HD1  PHE  45           1HD      PHE  45   2.707  -1.017  -7.081
  363    HD2  PHE  45           2HD      PHE  45   5.840   1.848  -6.798
  364    HE1  PHE  45           1HE      PHE  45   1.850   0.112  -9.092
  365    HE2  PHE  45           2HE      PHE  45   4.990   2.983  -8.808
  366    HZ   PHE  45           HZ       PHE  45   2.992   2.116  -9.957
  367    H    ALA  46           H        ALA  46   4.058   0.003  -2.365
  368    HA   ALA  46           HA       ALA  46   5.846  -1.972  -1.363
  369    HB1  ALA  46           1HB      ALA  46   4.803   0.576  -0.488
  370    HB2  ALA  46           2HB      ALA  46   6.325  -0.216  -0.081
  371    HB3  ALA  46           3HB      ALA  46   4.863  -0.596   0.828
  372    H    ILE  47           H        ILE  47   2.627  -0.987  -0.298
  373    HA   ILE  47           HA       ILE  47   2.106  -3.127   1.393
  374    HB   ILE  47           HB       ILE  47  -0.385  -2.585   0.443
  375   HG12  ILE  47          2HG1      ILE  47   1.076  -0.880  -1.063
  376   HG13  ILE  47          1HG1      ILE  47  -0.581  -0.557  -0.564
  377   HG21  ILE  47          1HG2      ILE  47   0.905  -0.647   2.316
  378   HG22  ILE  47          2HG2      ILE  47   0.752  -2.346   2.765
  379   HG23  ILE  47          3HG2      ILE  47  -0.689  -1.397   2.399
  380   HD11  ILE  47          3HD1      ILE  47   0.284   0.710   1.362
  381   HD12  ILE  47          1HD1      ILE  47   0.782   1.385  -0.189
  382   HD13  ILE  47          2HD1      ILE  47   1.924   0.442   0.769
  383    H    GLU  48           H        GLU  48   1.455  -2.770  -2.074
  384    HA   GLU  48           HA       GLU  48   0.052  -5.129  -2.497
  385    HB2  GLU  48           2HB      GLU  48   0.359  -3.341  -4.190
  386    HB3  GLU  48           1HB      GLU  48   2.037  -3.832  -4.373
  387    HG2  GLU  48           2HG      GLU  48  -0.238  -5.726  -4.848
  388    HG3  GLU  48           1HG      GLU  48   0.377  -4.655  -6.108
  389    H    GLN  49           H        GLN  49   3.476  -4.529  -2.204
  390    HA   GLN  49           HA       GLN  49   4.452  -7.011  -3.059
  391    HB2  GLN  49           2HB      GLN  49   5.485  -4.891  -1.207
  392    HB3  GLN  49           1HB      GLN  49   6.338  -6.424  -1.334
  393    HG2  GLN  49           2HG      GLN  49   6.052  -4.238  -3.312
  394    HG3  GLN  49           1HG      GLN  49   7.455  -5.224  -2.904
  395   HE21  GLN  49          1HE2      GLN  49   5.802  -4.503  -5.425
  396   HE22  GLN  49          2HE2      GLN  49   5.658  -6.022  -6.235
  397    H    GLU  50           H        GLU  50   3.427  -5.891   0.147
  398    HA   GLU  50           HA       GLU  50   3.548  -8.646   1.081
  399    HB2  GLU  50           2HB      GLU  50   4.856  -7.080   2.417
  400    HB3  GLU  50           1HB      GLU  50   3.431  -6.079   2.660
  401    HG2  GLU  50           2HG      GLU  50   3.085  -7.204   4.534
  402    HG3  GLU  50           1HG      GLU  50   2.651  -8.590   3.532
  403    H    PHE  51           H        PHE  51   1.429  -7.711  -0.588
  404    HA   PHE  51           HA       PHE  51  -0.807  -8.191   1.200
  405    HB2  PHE  51           2HB      PHE  51  -0.354  -5.796  -0.404
  406    HB3  PHE  51           1HB      PHE  51  -1.921  -6.537  -0.701
  407    HD1  PHE  51           2HD      PHE  51  -3.395  -7.032   1.324
  408    HD2  PHE  51           1HD      PHE  51  -0.019  -4.443   1.454
  409    HE1  PHE  51           2HE      PHE  51  -4.282  -5.983   3.365
  410    HE2  PHE  51           1HE      PHE  51  -0.900  -3.389   3.495
  411    HZ   PHE  51           HZ       PHE  51  -3.035  -4.158   4.453
  412    H    ILE  52           H        ILE  52   0.840  -9.020  -1.583
  413    HA   ILE  52           HA       ILE  52   0.399 -10.325  -3.390
  414    HB   ILE  52           HB       ILE  52  -1.231 -12.198  -2.989
  415   HG12  ILE  52          2HG1      ILE  52  -1.902 -12.478  -0.565
  416   HG13  ILE  52          1HG1      ILE  52  -1.509 -10.782  -0.367
  417   HG21  ILE  52          1HG2      ILE  52   1.297 -11.985  -2.268
  418   HG22  ILE  52          2HG2      ILE  52   0.331 -13.399  -1.848
  419   HG23  ILE  52          3HG2      ILE  52   0.596 -12.125  -0.657
  420   HD11  ILE  52          3HD1      ILE  52  -3.619 -11.945  -2.155
  421   HD12  ILE  52          1HD1      ILE  52  -3.174 -10.239  -2.115
  422   HD13  ILE  52          2HD1      ILE  52  -3.866 -11.002  -0.684
  423    H    LEU  53           H        LEU  53  -0.876  -7.845  -3.490
  424    HA   LEU  53           HA       LEU  53  -2.736  -8.263  -5.549
  425    HB2  LEU  53           2HB      LEU  53  -3.979  -8.773  -3.250
  426    HB3  LEU  53           1HB      LEU  53  -4.150  -7.028  -3.241
  427    HG   LEU  53           HG       LEU  53  -4.903  -8.134  -5.810
  428   HD11  LEU  53          1HD1      LEU  53  -6.105  -9.905  -5.245
  429   HD12  LEU  53          2HD1      LEU  53  -7.082  -8.897  -4.176
  430   HD13  LEU  53          3HD1      LEU  53  -5.641  -9.703  -3.556
  431   HD21  LEU  53          3HD2      LEU  53  -6.802  -6.823  -3.933
  432   HD22  LEU  53          1HD2      LEU  53  -6.577  -6.585  -5.666
  433   HD23  LEU  53          2HD2      LEU  53  -5.426  -5.890  -4.525
  434    H    ASP  54           H        ASP  54  -2.878  -6.454  -6.760
  435    HA   ASP  54           HA       ASP  54  -1.393  -4.154  -5.929
  436    HB2  ASP  54           2HB      ASP  54  -3.013  -4.368  -8.455
  437    HB3  ASP  54           1HB      ASP  54  -1.569  -3.401  -8.161
  438    H    ILE  55           H        ILE  55  -2.149  -2.095  -5.542
  439    HA   ILE  55           HA       ILE  55  -5.047  -1.856  -5.188
  440    HB   ILE  55           HB       ILE  55  -2.849  -0.498  -3.634
  441   HG12  ILE  55          2HG1      ILE  55  -2.996  -2.198  -2.186
  442   HG13  ILE  55          1HG1      ILE  55  -4.738  -1.976  -2.054
  443   HG21  ILE  55          1HG2      ILE  55  -4.592   1.074  -3.774
  444   HG22  ILE  55          2HG2      ILE  55  -4.811   0.278  -2.216
  445   HG23  ILE  55          3HG2      ILE  55  -5.834  -0.163  -3.583
  446   HD11  ILE  55          3HD1      ILE  55  -3.204  -3.791  -3.863
  447   HD12  ILE  55          1HD1      ILE  55  -4.855  -3.309  -4.248
  448   HD13  ILE  55          2HD1      ILE  55  -4.516  -4.171  -2.747
  449    HA   PRO  56           HA       PRO  56  -3.109   1.925  -7.551
  450    HB2  PRO  56           2HB      PRO  56  -2.217   1.040  -9.942
  451    HB3  PRO  56           1HB      PRO  56  -1.173   1.128  -8.519
  452    HG2  PRO  56           2HG      PRO  56  -2.599  -1.237  -9.678
  453    HG3  PRO  56           1HG      PRO  56  -0.937  -1.121  -9.071
  454    HD2  PRO  56           2HD      PRO  56  -2.968  -2.172  -7.610
  455    HD3  PRO  56           1HD      PRO  56  -1.592  -1.325  -6.876
  456    H    ASP  57           H        ASP  57  -3.549   2.197 -10.280
  457    HA   ASP  57           HA       ASP  57  -5.211   2.589 -11.781
  458    HB2  ASP  57           2HB      ASP  57  -6.415   0.029 -10.714
  459    HB3  ASP  57           1HB      ASP  57  -6.739   0.775 -12.276
  460    H    HIS  58           H        HIS  58  -7.782   2.614 -11.942
  461    HA   HIS  58           HA       HIS  58  -8.764   4.599 -10.396
  462    HB2  HIS  58           2HB      HIS  58 -10.400   2.251 -11.381
  463    HB3  HIS  58           1HB      HIS  58 -11.021   3.844 -10.963
  464    HD1  HIS  58           1HD      HIS  58 -11.933   3.759 -13.497
  465    HD2  HIS  58           2HD      HIS  58  -7.817   4.075 -13.027
  466    HE1  HIS  58           1HE      HIS  58 -11.060   4.532 -15.725
  467    HE2  HIS  58           2HE      HIS  58  -8.559   4.636 -15.440
  468    H    ASP  59           H        ASP  59  -8.233   1.350  -9.405
  469    HA   ASP  59           HA       ASP  59 -10.040   1.160  -7.267
  470    HB2  ASP  59           2HB      ASP  59  -7.732  -0.312  -8.244
  471    HB3  ASP  59           1HB      ASP  59  -7.789  -0.284  -6.484
  472    H    ALA  60           H        ALA  60  -6.693   2.331  -7.392
  473    HA   ALA  60           HA       ALA  60  -6.686   3.010  -4.601
  474    HB1  ALA  60           1HB      ALA  60  -4.732   2.900  -6.762
  475    HB2  ALA  60           2HB      ALA  60  -4.528   2.614  -5.034
  476    HB3  ALA  60           3HB      ALA  60  -4.498   4.261  -5.666
  477    H    GLU  61           H        GLU  61  -7.467   4.559  -7.569
  478    HA   GLU  61           HA       GLU  61  -7.152   7.244  -6.648
  479    HB2  GLU  61           2HB      GLU  61  -8.992   6.626  -8.899
  480    HB3  GLU  61           1HB      GLU  61  -7.782   7.893  -8.754
  481    HG2  GLU  61           2HG      GLU  61  -7.354   4.998  -9.420
  482    HG3  GLU  61           1HG      GLU  61  -7.032   6.409 -10.428
  483    H    LYS  62           H        LYS  62  -9.784   4.927  -6.802
  484    HA   LYS  62           HA       LYS  62 -11.834   6.780  -6.120
  485    HB2  LYS  62           2HB      LYS  62 -13.287   4.929  -6.042
  486    HB3  LYS  62           1HB      LYS  62 -12.113   4.529  -7.287
  487    HG2  LYS  62           2HG      LYS  62 -11.011   2.984  -5.902
  488    HG3  LYS  62           1HG      LYS  62 -11.817   3.588  -4.453
  489    HD2  LYS  62           2HD      LYS  62 -12.743   1.665  -6.469
  490    HD3  LYS  62           1HD      LYS  62 -13.182   1.826  -4.768
  491    HE2  LYS  62           2HE      LYS  62 -15.141   2.289  -6.014
  492    HE3  LYS  62           1HE      LYS  62 -14.541   3.841  -5.429
  493    HZ1  LYS  62           3HZ      LYS  62 -13.512   3.094  -8.012
  494    HZ2  LYS  62           1HZ      LYS  62 -14.184   4.559  -7.498
  495    HZ3  LYS  62           2HZ      LYS  62 -15.192   3.293  -7.990
  496    H    ILE  63           H        ILE  63  -9.295   6.062  -4.358
  497    HA   ILE  63           HA       ILE  63 -10.740   5.741  -1.836
  498    HB   ILE  63           HB       ILE  63  -8.561   4.359  -2.711
  499   HG12  ILE  63          2HG1      ILE  63  -8.514   4.612   0.182
  500   HG13  ILE  63          1HG1      ILE  63 -10.163   4.502  -0.427
  501   HG21  ILE  63          1HG2      ILE  63  -7.577   6.613  -0.973
  502   HG22  ILE  63          2HG2      ILE  63  -7.053   6.208  -2.607
  503   HG23  ILE  63          3HG2      ILE  63  -6.674   5.127  -1.266
  504   HD11  ILE  63          3HD1      ILE  63  -7.998   2.494  -0.432
  505   HD12  ILE  63          1HD1      ILE  63  -9.091   2.507  -1.816
  506   HD13  ILE  63          2HD1      ILE  63  -9.733   2.299  -0.187
  507    H    GLN  64           H        GLN  64 -10.999   7.481  -0.602
  508    HA   GLN  64           HA       GLN  64  -9.134   9.700  -0.908
  509    HB2  GLN  64           2HB      GLN  64 -12.030   9.900  -0.095
  510    HB3  GLN  64           1HB      GLN  64 -10.932  11.236  -0.408
  511    HG2  GLN  64           2HG      GLN  64 -11.816  11.255  -2.447
  512    HG3  GLN  64           1HG      GLN  64 -10.813   9.836  -2.749
  513   HE21  GLN  64          1HE2      GLN  64 -11.812   7.729  -2.235
  514   HE22  GLN  64          2HE2      GLN  64 -13.498   7.531  -2.552
  515    H    SER  65           H        SER  65 -10.964   7.712   1.300
  516    HA   SER  65           HA       SER  65  -9.973   9.139   3.631
  517    HB2  SER  65           2HB      SER  65 -12.310   7.888   3.239
  518    HB3  SER  65           1HB      SER  65 -11.395   6.541   3.918
  519    HG   SER  65           HG       SER  65 -12.374   8.776   5.139
  520    H    ILE  66           H        ILE  66  -8.507   8.372   5.086
  521    HA   ILE  66           HA       ILE  66  -6.494   6.638   4.122
  522    HB   ILE  66           HB       ILE  66  -6.412   6.986   6.995
  523   HG12  ILE  66          2HG1      ILE  66  -7.833   8.913   6.601
  524   HG13  ILE  66          1HG1      ILE  66  -6.201   9.465   6.953
  525   HG21  ILE  66          1HG2      ILE  66  -4.556   6.563   5.275
  526   HG22  ILE  66          2HG2      ILE  66  -4.233   7.706   6.578
  527   HG23  ILE  66          3HG2      ILE  66  -4.638   8.298   4.968
  528   HD11  ILE  66          3HD1      ILE  66  -6.291   9.201   4.185
  529   HD12  ILE  66          1HD1      ILE  66  -6.320  10.695   5.122
  530   HD13  ILE  66          2HD1      ILE  66  -7.832   9.929   4.638
  531    HA   PRO  67           HA       PRO  67  -8.282   3.619   7.514
  532    HB2  PRO  67           2HB      PRO  67 -10.937   3.975   8.050
  533    HB3  PRO  67           1HB      PRO  67  -9.642   4.696   9.011
  534    HG2  PRO  67           2HG      PRO  67 -11.303   5.923   6.846
  535    HG3  PRO  67           1HG      PRO  67 -10.797   6.616   8.398
  536    HD2  PRO  67           2HD      PRO  67  -9.563   7.235   6.083
  537    HD3  PRO  67           1HD      PRO  67  -8.683   7.134   7.621
  538    H    ASP  68           H        ASP  68 -10.672   4.821   5.161
  539    HA   ASP  68           HA       ASP  68 -11.829   2.344   4.553
  540    HB2  ASP  68           2HB      ASP  68 -11.672   4.986   3.167
  541    HB3  ASP  68           1HB      ASP  68 -12.273   3.597   2.267
  542    H    ALA  69           H        ALA  69  -8.856   3.786   3.568
  543    HA   ALA  69           HA       ALA  69  -8.405   2.218   1.254
  544    HB1  ALA  69           1HB      ALA  69  -6.341   3.234   1.116
  545    HB2  ALA  69           2HB      ALA  69  -6.165   3.339   2.867
  546    HB3  ALA  69           3HB      ALA  69  -7.270   4.426   2.025
  547    H    VAL  70           H        VAL  70  -6.814   2.100   4.408
  548    HA   VAL  70           HA       VAL  70  -5.620  -0.421   3.987
  549    HB   VAL  70           HB       VAL  70  -5.983   1.369   6.331
  550   HG11  VAL  70          1HG1      VAL  70  -6.611  -0.654   7.388
  551   HG12  VAL  70          2HG1      VAL  70  -4.910  -0.399   7.780
  552   HG13  VAL  70          3HG1      VAL  70  -5.364  -1.568   6.539
  553   HG21  VAL  70          3HG2      VAL  70  -3.602   1.252   6.435
  554   HG22  VAL  70          1HG2      VAL  70  -4.049   1.464   4.742
  555   HG23  VAL  70          2HG2      VAL  70  -3.563  -0.125   5.335
  556    H    GLU  71           H        GLU  71  -8.801   0.472   4.768
  557    HA   GLU  71           HA       GLU  71  -9.560  -1.771   6.318
  558    HB2  GLU  71           2HB      GLU  71 -10.968   0.419   4.889
  559    HB3  GLU  71           1HB      GLU  71 -11.903  -1.022   5.265
  560    HG2  GLU  71           2HG      GLU  71 -11.078  -0.746   7.651
  561    HG3  GLU  71           1HG      GLU  71 -10.534   0.858   7.159
  562    H    TYR  72           H        TYR  72 -10.096  -0.984   2.879
  563    HA   TYR  72           HA       TYR  72 -11.274  -3.443   2.212
  564    HB2  TYR  72           2HB      TYR  72 -11.530  -2.502   0.192
  565    HB3  TYR  72           1HB      TYR  72 -10.802  -1.064   0.898
  566    HD1  TYR  72           1HD      TYR  72  -8.313  -0.730   0.658
  567    HD2  TYR  72           2HD      TYR  72 -10.439  -3.697  -1.523
  568    HE1  TYR  72           1HE      TYR  72  -6.453  -0.875  -0.940
  569    HE2  TYR  72           2HE      TYR  72  -8.584  -3.852  -3.131
  570    HH   TYR  72           HH       TYR  72  -6.649  -2.950  -3.804
  571    H    ILE  73           H        ILE  73  -7.951  -2.312   1.835
  572    HA   ILE  73           HA       ILE  73  -6.946  -4.687   0.713
  573    HB   ILE  73           HB       ILE  73  -4.712  -3.792   1.767
  574   HG12  ILE  73          2HG1      ILE  73  -6.704  -1.669   2.362
  575   HG13  ILE  73          1HG1      ILE  73  -5.242  -2.117   3.231
  576   HG21  ILE  73          1HG2      ILE  73  -5.291  -1.825  -0.175
  577   HG22  ILE  73          2HG2      ILE  73  -6.159  -3.291  -0.628
  578   HG23  ILE  73          3HG2      ILE  73  -4.414  -3.341  -0.377
  579   HD11  ILE  73          3HD1      ILE  73  -4.735  -0.027   2.408
  580   HD12  ILE  73          1HD1      ILE  73  -5.562  -0.314   0.878
  581   HD13  ILE  73          2HD1      ILE  73  -4.014  -1.095   1.203
  582    H    ALA  74           H        ALA  74  -7.141  -3.550   4.027
  583    HA   ALA  74           HA       ALA  74  -5.672  -5.524   5.303
  584    HB1  ALA  74           1HB      ALA  74  -7.884  -3.724   6.131
  585    HB2  ALA  74           2HB      ALA  74  -6.236  -3.849   6.749
  586    HB3  ALA  74           3HB      ALA  74  -7.444  -5.052   7.205
  587    H    GLN  75           H        GLN  75  -9.010  -5.553   4.245
  588    HA   GLN  75           HA       GLN  75  -9.563  -8.113   5.394
  589    HB2  GLN  75           2HB      GLN  75 -11.168  -6.596   3.337
  590    HB3  GLN  75           1HB      GLN  75 -11.736  -7.922   4.342
  591    HG2  GLN  75           2HG      GLN  75 -11.270  -5.077   5.032
  592    HG3  GLN  75           1HG      GLN  75 -12.591  -6.152   5.486
  593   HE21  GLN  75          1HE2      GLN  75 -10.966  -4.380   7.139
  594   HE22  GLN  75          2HE2      GLN  75 -10.247  -5.382   8.349
  595    H    ASN  76           H        ASN  76  -8.187  -6.952   2.498
  596    HA   ASN  76           HA       ASN  76  -8.879  -8.951   0.674
  597    HB2  ASN  76           2HB      ASN  76  -6.832  -6.873   0.884
  598    HB3  ASN  76           1HB      ASN  76  -6.285  -8.289  -0.003
  599   HD21  ASN  76          1HD2      ASN  76  -8.346  -5.558   0.013
  600   HD22  ASN  76          2HD2      ASN  76  -8.956  -5.724  -1.594
  601    HA   PRO  77           HA       PRO  77  -5.128 -11.514   2.084
  602    HB2  PRO  77           2HB      PRO  77  -3.418 -10.594   3.924
  603    HB3  PRO  77           1HB      PRO  77  -3.336 -10.052   2.242
  604    HG2  PRO  77           2HG      PRO  77  -4.499  -8.671   4.624
  605    HG3  PRO  77           1HG      PRO  77  -3.545  -7.995   3.292
  606    HD2  PRO  77           2HD      PRO  77  -6.302  -7.873   3.479
  607    HD3  PRO  77           1HD      PRO  77  -5.383  -7.727   1.967
  608    H    MET  78           H        MET  78  -6.772  -9.733   4.606
  609    HA   MET  78           HA       MET  78  -6.384 -11.606   6.693
  610    HB2  MET  78           2HB      MET  78  -7.052  -9.648   7.627
  611    HB3  MET  78           1HB      MET  78  -8.040  -9.204   6.241
  612    HG2  MET  78           2HG      MET  78  -9.878 -10.389   7.005
  613    HG3  MET  78           1HG      MET  78  -8.906 -11.394   8.080
  614    HE1  MET  78           3HE      MET  78  -9.186 -10.160  11.252
  615    HE2  MET  78           1HE      MET  78  -9.431 -11.434  10.057
  616    HE3  MET  78           2HE      MET  78 -10.792 -10.444  10.584
  617    H    ALA  79           H        ALA  79  -8.410 -11.578   3.944
  618    HA   ALA  79           HA       ALA  79  -9.279 -14.151   4.076
  619    HB1  ALA  79           1HB      ALA  79 -10.686 -12.523   6.011
  620    HB2  ALA  79           2HB      ALA  79 -10.677 -14.274   5.804
  621    HB3  ALA  79           3HB      ALA  79 -11.790 -13.280   4.864
  622    H    LYS  80           H        LYS  80  -8.691 -13.048   1.913
  623    HA   LYS  80           HA       LYS  80 -10.014 -11.360   0.380
  624    HB2  LYS  80           2HB      LYS  80  -9.263 -14.190  -0.335
  625    HB3  LYS  80           1HB      LYS  80  -9.875 -13.053  -1.528
  626    HG2  LYS  80           2HG      LYS  80  -7.653 -12.721  -1.819
  627    HG3  LYS  80           1HG      LYS  80  -7.940 -11.541  -0.538
  628    HD2  LYS  80           2HD      LYS  80  -6.229 -12.586   0.485
  629    HD3  LYS  80           1HD      LYS  80  -7.456 -13.778   0.916
  630    HE2  LYS  80           2HE      LYS  80  -6.410 -15.341  -0.265
  631    HE3  LYS  80           1HE      LYS  80  -6.475 -14.334  -1.712
  632    HZ1  LYS  80           3HZ      LYS  80  -4.202 -14.925  -1.112
  633    HZ2  LYS  80           1HZ      LYS  80  -4.387 -14.176   0.395
  634    HZ3  LYS  80           2HZ      LYS  80  -4.439 -13.253  -1.021
  635   H282  PNS 101          8H2       PNS 101  -0.178  14.840  -8.049
  636   H281  PNS 101          9H2       PNS 101  -0.633  15.715  -9.513
  637   H303  PNS 101          0H3       PNS 101   1.808  14.819  -7.606
  638   H302  PNS 101          1H3       PNS 101   2.291  16.192  -8.604
  639   H301  PNS 101          2H3       PNS 101   3.146  14.655  -8.745
  640   H313  PNS 101          3H3       PNS 101   0.722  12.612  -9.598
  641   H312  PNS 101          4H3       PNS 101   2.453  12.948  -9.614
  642   H311  PNS 101          5H3       PNS 101   1.505  13.143 -11.088
  643    H32  PNS 101           6H3      PNS 101   0.527  15.231 -11.432
  644    H33  PNS 101           7H3      PNS 101   0.502  16.998  -9.872
  645    H36  PNS 101           8H3      PNS 101   3.316  13.488 -11.409
  646   H372  PNS 101          9H3       PNS 101   5.320  15.205 -11.266
  647   H371  PNS 101          0H4       PNS 101   4.830  14.279  -9.847
  648   H382  PNS 101          1H4       PNS 101   3.178  16.621 -10.195
  649   H381  PNS 101          2H4       PNS 101   4.122  16.106  -8.798
  650    H41  PNS 101           3H4      PNS 101   4.430  17.639 -11.971
  651   H422  PNS 101          4H4       PNS 101   6.326  17.947 -13.180
  652   H421  PNS 101          5H4       PNS 101   7.013  18.672 -11.727
  653   H431  PNS 101          7H4       PNS 101   8.467  16.934 -11.959
  654   H432  PNS 101          6H4       PNS 101   7.210  16.095 -11.038
  655    H44  PNS 101           8H4      PNS 101   7.377  14.543 -12.980
  Start of MODEL    2
    1    H1   MET   1           1HT      MET   1  -5.506  -8.125   7.645
    2    H2   MET   1           2HT      MET   1  -5.783  -8.546   9.285
    3    H3   MET   1           3HT      MET   1  -4.359  -7.696   8.844
    4    HA   MET   1           HA       MET   1  -6.456  -6.213   7.901
    5    HB2  MET   1           2HB      MET   1  -8.060  -6.150   9.526
    6    HB3  MET   1           1HB      MET   1  -7.557  -7.822   9.726
    7    HG2  MET   1           2HG      MET   1  -6.219  -7.278  11.612
    8    HG3  MET   1           1HG      MET   1  -6.418  -5.550  11.328
    9    HE1  MET   1           2HE      MET   1  -8.625  -8.099  14.078
   10    HE2  MET   1           3HE      MET   1  -7.202  -8.445  13.096
   11    HE3  MET   1           1HE      MET   1  -8.810  -8.839  12.487
   12    H    ASN   2           H        ASN   2  -4.701  -6.675  10.976
   13    HA   ASN   2           HA       ASN   2  -4.061  -3.916  11.214
   14    HB2  ASN   2           2HB      ASN   2  -2.815  -6.272  12.637
   15    HB3  ASN   2           1HB      ASN   2  -2.682  -4.581  13.116
   16   HD21  ASN   2          1HD2      ASN   2  -4.483  -7.434  13.350
   17   HD22  ASN   2          2HD2      ASN   2  -5.824  -6.804  14.238
   18    H    ASP   3           H        ASP   3  -2.481  -6.687   9.842
   19    HA   ASP   3           HA       ASP   3   0.142  -5.869   9.717
   20    HB2  ASP   3           2HB      ASP   3  -1.517  -7.791   8.344
   21    HB3  ASP   3           1HB      ASP   3  -0.355  -7.072   7.233
   22    H    VAL   4           H        VAL   4  -2.542  -4.890   7.695
   23    HA   VAL   4           HA       VAL   4  -0.985  -3.476   5.783
   24    HB   VAL   4           HB       VAL   4  -3.246  -2.311   5.324
   25   HG11  VAL   4          1HG1      VAL   4  -2.376  -3.991   3.865
   26   HG12  VAL   4          2HG1      VAL   4  -4.080  -4.344   4.152
   27   HG13  VAL   4          3HG1      VAL   4  -2.835  -5.275   4.985
   28   HG21  VAL   4          3HG2      VAL   4  -5.203  -3.450   6.169
   29   HG22  VAL   4          1HG2      VAL   4  -4.225  -2.865   7.516
   30   HG23  VAL   4          2HG2      VAL   4  -4.190  -4.574   7.076
   31    H    LEU   5           H        LEU   5  -2.892  -2.411   8.595
   32    HA   LEU   5           HA       LEU   5  -2.325   0.325   8.257
   33    HB2  LEU   5           2HB      LEU   5  -3.469  -1.354  10.384
   34    HB3  LEU   5           1HB      LEU   5  -2.879   0.223  10.862
   35    HG   LEU   5           HG       LEU   5  -4.382   0.868   8.688
   36   HD11  LEU   5          1HD1      LEU   5  -5.409  -1.680   9.810
   37   HD12  LEU   5          2HD1      LEU   5  -5.463  -1.065   8.158
   38   HD13  LEU   5          3HD1      LEU   5  -6.579  -0.435   9.370
   39   HD21  LEU   5          3HD2      LEU   5  -5.575   0.590  11.431
   40   HD22  LEU   5          1HD2      LEU   5  -5.892   1.827  10.214
   41   HD23  LEU   5          2HD2      LEU   5  -4.343   1.794  11.056
   42    H    THR   6           H        THR   6  -0.764  -2.179  10.138
   43    HA   THR   6           HA       THR   6   0.965  -0.568  11.616
   44    HB   THR   6           HB       THR   6   0.797  -2.742  12.397
   45    HG1  THR   6           1HG      THR   6   3.099  -1.915  11.867
   46   HG21  THR   6          3HG2      THR   6   1.804  -4.336  10.238
   47   HG22  THR   6          1HG2      THR   6   0.369  -3.441   9.736
   48   HG23  THR   6          2HG2      THR   6   0.301  -4.495  11.149
   49    H    ARG   7           H        ARG   7   1.718  -2.429   8.696
   50    HA   ARG   7           HA       ARG   7   4.255  -1.169   8.379
   51    HB2  ARG   7           2HB      ARG   7   3.904  -3.494   7.700
   52    HB3  ARG   7           1HB      ARG   7   2.722  -2.973   6.507
   53    HG2  ARG   7           2HG      ARG   7   5.424  -1.776   6.341
   54    HG3  ARG   7           1HG      ARG   7   5.257  -3.476   5.895
   55    HD2  ARG   7           2HD      ARG   7   3.110  -2.030   4.721
   56    HD3  ARG   7           1HD      ARG   7   4.609  -1.168   4.371
   57    HE   ARG   7           HE       ARG   7   3.944  -3.903   3.552
   58   HH11  ARG   7          1HH1      ARG   7   6.099  -1.169   3.472
   59   HH12  ARG   7          2HH1      ARG   7   7.014  -1.765   2.127
   60   HH21  ARG   7          1HH2      ARG   7   5.142  -4.697   1.782
   61   HH22  ARG   7          2HH2      ARG   7   6.469  -3.771   1.166
   62    H    VAL   8           H        VAL   8   1.181  -1.079   6.643
   63    HA   VAL   8           HA       VAL   8   1.967   0.726   4.659
   64    HB   VAL   8           HB       VAL   8  -0.830   0.405   5.747
   65   HG11  VAL   8          1HG1      VAL   8  -1.209   0.797   3.169
   66   HG12  VAL   8          2HG1      VAL   8   0.347   1.617   3.301
   67   HG13  VAL   8          3HG1      VAL   8  -1.018   2.150   4.284
   68   HG21  VAL   8          3HG2      VAL   8   0.696  -1.651   4.856
   69   HG22  VAL   8          1HG2      VAL   8  -0.045  -1.104   3.352
   70   HG23  VAL   8          2HG2      VAL   8  -1.060  -1.578   4.714
   71    H    LEU   9           H        LEU   9   0.238   1.305   7.714
   72    HA   LEU   9           HA       LEU   9   0.058   4.105   7.407
   73    HB2  LEU   9           2HB      LEU   9  -0.988   4.091   9.416
   74    HB3  LEU   9           1HB      LEU   9  -1.085   2.375   9.085
   75    HG   LEU   9           HG       LEU   9   1.133   2.210  10.404
   76   HD11  LEU   9          1HD1      LEU   9   1.000   4.916  10.394
   77   HD12  LEU   9          2HD1      LEU   9   1.891   3.965  11.582
   78   HD13  LEU   9          3HD1      LEU   9   0.270   4.547  11.957
   79   HD21  LEU   9          3HD2      LEU   9  -0.192   2.297  12.584
   80   HD22  LEU   9          1HD2      LEU   9  -0.774   1.211  11.322
   81   HD23  LEU   9          2HD2      LEU   9  -1.570   2.763  11.585
   82    H    GLU  10           H        GLU  10   2.402   2.033   9.065
   83    HA   GLU  10           HA       GLU  10   3.935   4.106  10.196
   84    HB2  GLU  10           2HB      GLU  10   5.541   2.450  10.718
   85    HB3  GLU  10           1HB      GLU  10   3.981   1.644  10.809
   86    HG2  GLU  10           2HG      GLU  10   4.659   0.134   9.351
   87    HG3  GLU  10           1HG      GLU  10   4.949   1.395   8.152
   88    H    VAL  11           H        VAL  11   3.974   2.528   7.104
   89    HA   VAL  11           HA       VAL  11   6.460   3.457   6.198
   90    HB   VAL  11           HB       VAL  11   4.119   2.207   4.987
   91   HG11  VAL  11          1HG1      VAL  11   4.704   2.654   2.731
   92   HG12  VAL  11          2HG1      VAL  11   6.156   3.527   3.219
   93   HG13  VAL  11          3HG1      VAL  11   4.563   4.209   3.549
   94   HG21  VAL  11          3HG2      VAL  11   6.298   1.115   3.828
   95   HG22  VAL  11          1HG2      VAL  11   5.614   0.579   5.363
   96   HG23  VAL  11          2HG2      VAL  11   6.980   1.695   5.348
   97    H    VAL  12           H        VAL  12   3.203   4.588   5.445
   98    HA   VAL  12           HA       VAL  12   3.957   6.810   3.915
   99    HB   VAL  12           HB       VAL  12   1.758   7.248   3.736
  100   HG11  VAL  12          1HG1      VAL  12   2.125   4.638   3.993
  101   HG12  VAL  12          2HG1      VAL  12   0.521   5.332   3.761
  102   HG13  VAL  12          3HG1      VAL  12   1.057   4.874   5.377
  103   HG21  VAL  12          3HG2      VAL  12   1.594   6.928   6.725
  104   HG22  VAL  12          1HG2      VAL  12   0.192   7.260   5.707
  105   HG23  VAL  12          2HG2      VAL  12   1.518   8.420   5.787
  106    H    LYS  13           H        LYS  13   3.213   6.536   7.375
  107    HA   LYS  13           HA       LYS  13   3.417   9.246   8.025
  108    HB2  LYS  13           2HB      LYS  13   3.523   8.562  10.286
  109    HB3  LYS  13           1HB      LYS  13   2.539   7.354   9.471
  110    HG2  LYS  13           2HG      LYS  13   4.220   5.745   9.558
  111    HG3  LYS  13           1HG      LYS  13   5.481   6.948   9.866
  112    HD2  LYS  13           2HD      LYS  13   3.289   6.105  11.763
  113    HD3  LYS  13           1HD      LYS  13   5.004   5.713  11.896
  114    HE2  LYS  13           2HE      LYS  13   3.863   8.503  11.951
  115    HE3  LYS  13           1HE      LYS  13   4.301   7.568  13.381
  116    HZ1  LYS  13           3HZ      LYS  13   6.222   8.215  11.218
  117    HZ2  LYS  13           1HZ      LYS  13   6.566   7.591  12.754
  118    HZ3  LYS  13           2HZ      LYS  13   6.016   9.182  12.589
  119    H    ASN  14           H        ASN  14   5.893   6.715   7.914
  120    HA   ASN  14           HA       ASN  14   7.952   8.524   8.767
  121    HB2  ASN  14           2HB      ASN  14   8.088   5.673   7.782
  122    HB3  ASN  14           1HB      ASN  14   9.465   6.583   8.395
  123   HD21  ASN  14          1HD2      ASN  14   7.289   4.324   9.199
  124   HD22  ASN  14          2HD2      ASN  14   7.214   4.560  10.910
  125    H    PHE  15           H        PHE  15   6.372   8.106   5.926
  126    HA   PHE  15           HA       PHE  15   8.632   8.352   4.164
  127    HB2  PHE  15           2HB      PHE  15   5.792   7.780   3.887
  128    HB3  PHE  15           1HB      PHE  15   6.363   8.923   2.674
  129    HD1  PHE  15           2HD      PHE  15   8.142   6.060   4.240
  130    HD2  PHE  15           1HD      PHE  15   6.443   7.708   0.703
  131    HE1  PHE  15           2HE      PHE  15   9.073   4.197   2.929
  132    HE2  PHE  15           1HE      PHE  15   7.370   5.848  -0.614
  133    HZ   PHE  15           HZ       PHE  15   8.687   4.090   0.500
  134    H    GLU  16           H        GLU  16   6.703  10.405   6.016
  135    HA   GLU  16           HA       GLU  16   7.125  12.682   6.335
  136    HB2  GLU  16           2HB      GLU  16   8.493  13.903   4.952
  137    HB3  GLU  16           1HB      GLU  16   9.060  12.281   4.584
  138    HG2  GLU  16           2HG      GLU  16   8.605  12.607   2.455
  139    HG3  GLU  16           1HG      GLU  16   6.906  12.847   2.853
  140    H    LYS  17           H        LYS  17   5.057  11.006   4.543
  141    HA   LYS  17           HA       LYS  17   3.703  13.066   3.116
  142    HB2  LYS  17           2HB      LYS  17   3.042  10.216   3.787
  143    HB3  LYS  17           1HB      LYS  17   1.873  11.262   2.995
  144    HG2  LYS  17           2HG      LYS  17   2.775  10.606   1.078
  145    HG3  LYS  17           1HG      LYS  17   4.165  11.606   1.499
  146    HD2  LYS  17           2HD      LYS  17   5.403   9.756   1.465
  147    HD3  LYS  17           1HD      LYS  17   4.530   9.223   2.903
  148    HE2  LYS  17           2HE      LYS  17   2.752   8.483   1.076
  149    HE3  LYS  17           1HE      LYS  17   4.194   8.424   0.063
  150    HZ1  LYS  17           3HZ      LYS  17   4.985   7.151   2.310
  151    HZ2  LYS  17           1HZ      LYS  17   4.437   6.386   0.904
  152    HZ3  LYS  17           2HZ      LYS  17   3.370   6.665   2.185
  153    H    VAL  18           H        VAL  18   3.409  11.613   6.293
  154    HA   VAL  18           HA       VAL  18   1.908  13.792   7.295
  155    HB   VAL  18           HB       VAL  18   0.103  11.674   7.837
  156   HG11  VAL  18          1HG1      VAL  18  -0.767  13.796   7.973
  157   HG12  VAL  18          2HG1      VAL  18  -1.393  13.275   6.409
  158   HG13  VAL  18          3HG1      VAL  18   0.018  14.330   6.487
  159   HG21  VAL  18          3HG2      VAL  18  -0.456  10.703   5.869
  160   HG22  VAL  18          1HG2      VAL  18   1.236  11.029   5.494
  161   HG23  VAL  18          2HG2      VAL  18  -0.021  12.125   4.920
  162    H    ASP  19           H        ASP  19   1.859  13.823   9.513
  163    HA   ASP  19           HA       ASP  19   3.582  11.985  10.851
  164    HB2  ASP  19           2HB      ASP  19   3.035  14.584  11.261
  165    HB3  ASP  19           1HB      ASP  19   1.933  13.873  12.436
  166    H    ALA  20           H        ALA  20   3.041  10.200  11.944
  167    HA   ALA  20           HA       ALA  20   0.494   9.087  11.860
  168    HB1  ALA  20           1HB      ALA  20   2.839   8.489  13.644
  169    HB2  ALA  20           2HB      ALA  20   2.352   7.649  12.172
  170    HB3  ALA  20           3HB      ALA  20   1.364   7.522  13.628
  171    H    SER  21           H        SER  21   1.983  11.148  14.242
  172    HA   SER  21           HA       SER  21   0.087  10.756  16.300
  173    HB2  SER  21           2HB      SER  21   2.028  13.003  15.750
  174    HB3  SER  21           1HB      SER  21   1.017  12.932  17.193
  175    HG   SER  21           HG       SER  21   3.012  11.089  16.385
  176    H    LYS  22           H        LYS  22   0.083  12.640  13.422
  177    HA   LYS  22           HA       LYS  22  -2.144  14.274  14.316
  178    HB2  LYS  22           2HB      LYS  22  -1.000  15.741  13.053
  179    HB3  LYS  22           1HB      LYS  22  -0.109  14.468  12.233
  180    HG2  LYS  22           2HG      LYS  22  -2.882  14.584  11.387
  181    HG3  LYS  22           1HG      LYS  22  -2.028  16.105  11.125
  182    HD2  LYS  22           2HD      LYS  22  -0.954  13.427  10.259
  183    HD3  LYS  22           1HD      LYS  22  -1.925  14.468   9.217
  184    HE2  LYS  22           2HE      LYS  22   0.772  15.060  10.418
  185    HE3  LYS  22           1HE      LYS  22   0.370  14.877   8.712
  186    HZ1  LYS  22           3HZ      LYS  22  -0.562  17.058  10.499
  187    HZ2  LYS  22           1HZ      LYS  22  -1.001  16.875   8.874
  188    HZ3  LYS  22           2HZ      LYS  22   0.608  17.196   9.285
  189    H    VAL  23           H        VAL  23  -1.573  11.367  12.661
  190    HA   VAL  23           HA       VAL  23  -3.879  11.420  10.972
  191    HB   VAL  23           HB       VAL  23  -2.662   8.832  11.791
  192   HG11  VAL  23          1HG1      VAL  23  -4.507   9.223  10.045
  193   HG12  VAL  23          2HG1      VAL  23  -3.158   8.173   9.609
  194   HG13  VAL  23          3HG1      VAL  23  -3.209   9.834   9.019
  195   HG21  VAL  23          3HG2      VAL  23  -1.254  10.853  10.049
  196   HG22  VAL  23          1HG2      VAL  23  -0.769   9.171  10.265
  197   HG23  VAL  23          2HG2      VAL  23  -0.719  10.284  11.630
  198    H    THR  24           H        THR  24  -5.914  11.017  11.522
  199    HA   THR  24           HA       THR  24  -6.438   9.643  14.036
  200    HB   THR  24           HB       THR  24  -7.318  12.166  13.137
  201    HG1  THR  24           1HG      THR  24  -7.884  12.315  15.181
  202   HG21  THR  24          3HG2      THR  24  -9.703  10.422  13.611
  203   HG22  THR  24          1HG2      THR  24  -9.133  10.803  11.987
  204   HG23  THR  24          2HG2      THR  24  -9.645  12.098  13.067
  205    HA   PRO  25           HA       PRO  25  -8.787   6.460  12.127
  206    HB2  PRO  25           2HB      PRO  25 -11.269   6.637  13.327
  207    HB3  PRO  25           1HB      PRO  25  -9.860   5.848  14.042
  208    HG2  PRO  25           2HG      PRO  25 -10.949   8.589  14.527
  209    HG3  PRO  25           1HG      PRO  25 -10.279   7.427  15.686
  210    HD2  PRO  25           2HD      PRO  25  -8.849   9.525  14.817
  211    HD3  PRO  25           1HD      PRO  25  -8.087   7.952  15.136
  212    H    GLU  26           H        GLU  26 -10.495   9.546  12.350
  213    HA   GLU  26           HA       GLU  26 -11.909   8.928   9.871
  214    HB2  GLU  26           2HB      GLU  26 -13.669   9.837  10.896
  215    HB3  GLU  26           1HB      GLU  26 -12.672  10.270  12.277
  216    HG2  GLU  26           2HG      GLU  26 -12.014  12.341  11.109
  217    HG3  GLU  26           1HG      GLU  26 -13.111  11.915   9.797
  218    H    SER  27           H        SER  27  -9.057  10.027  10.493
  219    HA   SER  27           HA       SER  27  -8.949  12.623   9.389
  220    HB2  SER  27           2HB      SER  27  -6.993  10.533  10.147
  221    HB3  SER  27           1HB      SER  27  -6.448  11.712   8.952
  222    HG   SER  27           HG       SER  27  -7.754  12.921  10.986
  223    H    HIS  28           H        HIS  28  -8.717  13.334   7.340
  224    HA   HIS  28           HA       HIS  28  -9.254  11.497   5.213
  225    HB2  HIS  28           2HB      HIS  28  -9.349  14.379   5.611
  226    HB3  HIS  28           1HB      HIS  28  -8.675  13.947   4.044
  227    HD1  HIS  28           1HD      HIS  28 -10.957  11.345   4.805
  228    HD2  HIS  28           2HD      HIS  28 -11.362  15.263   3.483
  229    HE1  HIS  28           1HE      HIS  28 -13.248  11.474   3.777
  230    HE2  HIS  28           2HE      HIS  28 -13.503  13.876   3.060
  231    H    PHE  29           H        PHE  29  -7.920  11.017   3.454
  232    HA   PHE  29           HA       PHE  29  -5.161  10.825   4.044
  233    HB2  PHE  29           2HB      PHE  29  -6.766   9.407   2.451
  234    HB3  PHE  29           1HB      PHE  29  -6.081  10.486   1.238
  235    HD1  PHE  29           2HD      PHE  29  -3.506  10.496   3.319
  236    HD2  PHE  29           1HD      PHE  29  -5.624   7.671   0.942
  237    HE1  PHE  29           2HE      PHE  29  -1.492   9.085   3.208
  238    HE2  PHE  29           1HE      PHE  29  -3.613   6.255   0.828
  239    HZ   PHE  29           HZ       PHE  29  -1.546   6.962   1.962
  240    H    VAL  30           H        VAL  30  -4.582  11.355   1.061
  241    HA   VAL  30           HA       VAL  30  -3.037  13.512   1.133
  242    HB   VAL  30           HB       VAL  30  -3.012  13.549  -1.135
  243   HG11  VAL  30          1HG1      VAL  30  -3.054  11.165  -0.407
  244   HG12  VAL  30          2HG1      VAL  30  -3.595  11.419  -2.065
  245   HG13  VAL  30          3HG1      VAL  30  -4.775  11.129  -0.787
  246   HG21  VAL  30          3HG2      VAL  30  -6.009  13.211  -1.197
  247   HG22  VAL  30          1HG2      VAL  30  -4.963  13.558  -2.573
  248   HG23  VAL  30          2HG2      VAL  30  -5.157  14.751  -1.289
  249    H    LYS  31           H        LYS  31  -6.504  13.600   1.029
  250    HA   LYS  31           HA       LYS  31  -6.844  16.334   0.471
  251    HB2  LYS  31           2HB      LYS  31  -9.082  15.908   1.760
  252    HB3  LYS  31           1HB      LYS  31  -8.798  15.137   0.206
  253    HG2  LYS  31           2HG      LYS  31  -7.824  13.535   2.417
  254    HG3  LYS  31           1HG      LYS  31  -9.548  13.888   2.543
  255    HD2  LYS  31           2HD      LYS  31  -8.603  11.817   1.154
  256    HD3  LYS  31           1HD      LYS  31 -10.071  12.679   0.694
  257    HE2  LYS  31           2HE      LYS  31  -7.575  13.822  -0.353
  258    HE3  LYS  31           1HE      LYS  31  -7.972  12.216  -0.963
  259    HZ1  LYS  31           3HZ      LYS  31  -9.531  13.076  -2.258
  260    HZ2  LYS  31           1HZ      LYS  31  -9.005  14.623  -1.820
  261    HZ3  LYS  31           2HZ      LYS  31 -10.265  13.884  -0.966
  262    H    ASP  32           H        ASP  32  -6.767  14.590   3.568
  263    HA   ASP  32           HA       ASP  32  -6.800  17.063   5.039
  264    HB2  ASP  32           2HB      ASP  32  -7.372  14.299   5.608
  265    HB3  ASP  32           1HB      ASP  32  -6.246  14.942   6.799
  266    H    LEU  33           H        LEU  33  -4.510  15.825   3.296
  267    HA   LEU  33           HA       LEU  33  -2.290  16.701   3.418
  268    HB2  LEU  33           2HB      LEU  33  -2.958  17.420   5.867
  269    HB3  LEU  33           1HB      LEU  33  -2.088  15.959   6.277
  270    HG   LEU  33           HG       LEU  33  -0.669  17.957   6.433
  271   HD11  LEU  33          1HD1      LEU  33   0.489  15.940   6.026
  272   HD12  LEU  33          2HD1      LEU  33   1.162  17.125   4.906
  273   HD13  LEU  33          3HD1      LEU  33   0.012  15.921   4.328
  274   HD21  LEU  33          3HD2      LEU  33  -1.943  19.017   4.420
  275   HD22  LEU  33          1HD2      LEU  33  -0.712  18.200   3.458
  276   HD23  LEU  33          2HD2      LEU  33  -0.237  19.383   4.678
  277    H    GLY  34           H        GLY  34  -3.320  14.249   2.647
  278    HA2  GLY  34           2HA      GLY  34  -1.667  12.195   3.893
  279    HA3  GLY  34           1HA      GLY  34  -2.892  11.939   2.662
  280    H    LEU  35           H        LEU  35  -1.025  10.513   1.940
  281    HA   LEU  35           HA       LEU  35   1.260  11.725   0.775
  282    HB2  LEU  35           2HB      LEU  35   1.867   9.593   0.060
  283    HB3  LEU  35           1HB      LEU  35   0.978   9.309   1.542
  284    HG   LEU  35           HG       LEU  35   0.341   8.517  -1.229
  285   HD11  LEU  35          1HD1      LEU  35   0.853   6.728   0.117
  286   HD12  LEU  35          2HD1      LEU  35  -0.906   6.755   0.234
  287   HD13  LEU  35          3HD1      LEU  35   0.075   7.430   1.534
  288   HD21  LEU  35          3HD2      LEU  35  -1.544  10.044   0.341
  289   HD22  LEU  35          1HD2      LEU  35  -2.134   8.412   0.030
  290   HD23  LEU  35          2HD2      LEU  35  -1.674   9.455  -1.315
  291    H    ASN  36           H        ASN  36   1.753  12.096  -1.391
  292    HA   ASN  36           HA       ASN  36  -0.458  12.920  -2.991
  293    HB2  ASN  36           2HB      ASN  36   1.959  13.945  -2.765
  294    HB3  ASN  36           1HB      ASN  36   2.337  12.809  -4.053
  295   HD21  ASN  36          1HD2      ASN  36  -0.770  13.452  -4.629
  296   HD22  ASN  36          2HD2      ASN  36  -0.615  14.811  -5.676
  297    H    SER  37           H        SER  37   0.268  12.383  -5.580
  298    HA   SER  37           HA       SER  37  -0.699   9.768  -5.964
  299    HB2  SER  37           2HB      SER  37   0.730  10.832  -8.263
  300    HB3  SER  37           1HB      SER  37  -0.984  10.456  -8.084
  301    H    LEU  38           H        LEU  38   2.455  11.124  -6.786
  302    HA   LEU  38           HA       LEU  38   3.734   8.792  -7.506
  303    HB2  LEU  38           2HB      LEU  38   5.699   9.987  -7.482
  304    HB3  LEU  38           1HB      LEU  38   4.505  11.265  -7.606
  305    HG   LEU  38           HG       LEU  38   6.258  11.872  -6.038
  306   HD11  LEU  38          1HD1      LEU  38   3.449  11.633  -5.304
  307   HD12  LEU  38          2HD1      LEU  38   4.543  13.012  -5.186
  308   HD13  LEU  38          3HD1      LEU  38   4.527  11.787  -3.918
  309   HD21  LEU  38          3HD2      LEU  38   6.195   9.195  -5.310
  310   HD22  LEU  38          1HD2      LEU  38   5.563  10.050  -3.903
  311   HD23  LEU  38          2HD2      LEU  38   7.146  10.473  -4.555
  312    H    ASP  39           H        ASP  39   3.284  10.148  -4.307
  313    HA   ASP  39           HA       ASP  39   4.946   8.265  -2.971
  314    HB2  ASP  39           2HB      ASP  39   2.981   9.248  -1.175
  315    HB3  ASP  39           1HB      ASP  39   4.673   9.722  -1.301
  316    H    VAL  40           H        VAL  40   1.431   8.666  -2.864
  317    HA   VAL  40           HA       VAL  40   0.694   6.388  -1.586
  318    HB   VAL  40           HB       VAL  40  -0.753   8.264  -2.749
  319   HG11  VAL  40          1HG1      VAL  40  -0.066   6.769  -4.971
  320   HG12  VAL  40          2HG1      VAL  40  -1.363   7.961  -4.872
  321   HG13  VAL  40          3HG1      VAL  40  -1.713   6.253  -4.607
  322   HG21  VAL  40          3HG2      VAL  40  -2.212   7.193  -1.457
  323   HG22  VAL  40          1HG2      VAL  40  -1.299   5.689  -1.594
  324   HG23  VAL  40          2HG2      VAL  40  -2.524   6.092  -2.799
  325    H    VAL  41           H        VAL  41   1.877   6.675  -4.859
  326    HA   VAL  41           HA       VAL  41   1.155   4.096  -5.756
  327    HB   VAL  41           HB       VAL  41   3.464   5.797  -6.702
  328   HG11  VAL  41          1HG1      VAL  41   2.721   3.184  -7.378
  329   HG12  VAL  41          2HG1      VAL  41   3.869   4.225  -8.218
  330   HG13  VAL  41          3HG1      VAL  41   2.177   4.200  -8.713
  331   HG21  VAL  41          3HG2      VAL  41   1.219   5.879  -8.450
  332   HG22  VAL  41          1HG2      VAL  41   1.994   7.206  -7.584
  333   HG23  VAL  41          2HG2      VAL  41   0.682   6.304  -6.825
  334    H    GLU  42           H        GLU  42   4.224   5.398  -4.500
  335    HA   GLU  42           HA       GLU  42   5.675   3.015  -4.585
  336    HB2  GLU  42           2HB      GLU  42   5.907   5.506  -2.934
  337    HB3  GLU  42           1HB      GLU  42   6.972   4.140  -2.632
  338    HG2  GLU  42           2HG      GLU  42   7.333   4.321  -5.247
  339    HG3  GLU  42           1HG      GLU  42   6.863   5.992  -4.940
  340    H    VAL  43           H        VAL  43   3.701   4.398  -2.028
  341    HA   VAL  43           HA       VAL  43   4.175   2.440  -0.074
  342    HB   VAL  43           HB       VAL  43   3.131   4.261   0.858
  343   HG11  VAL  43          1HG1      VAL  43   2.154   5.778  -0.429
  344   HG12  VAL  43          2HG1      VAL  43   0.760   4.718  -0.624
  345   HG13  VAL  43          3HG1      VAL  43   2.106   4.623  -1.759
  346   HG21  VAL  43          3HG2      VAL  43   1.868   2.013   1.215
  347   HG22  VAL  43          1HG2      VAL  43   0.600   2.827   0.306
  348   HG23  VAL  43          2HG2      VAL  43   1.180   3.524   1.814
  349    H    VAL  44           H        VAL  44   1.520   2.799  -2.371
  350    HA   VAL  44           HA       VAL  44   0.120   0.478  -1.712
  351    HB   VAL  44           HB       VAL  44  -0.878   0.610  -3.958
  352   HG11  VAL  44          1HG1      VAL  44  -0.955   2.565  -1.937
  353   HG12  VAL  44          2HG1      VAL  44  -2.198   2.188  -3.129
  354   HG13  VAL  44          3HG1      VAL  44  -0.989   3.424  -3.476
  355   HG21  VAL  44          3HG2      VAL  44  -0.178   2.326  -5.536
  356   HG22  VAL  44          1HG2      VAL  44   1.153   1.219  -5.194
  357   HG23  VAL  44          2HG2      VAL  44   1.120   2.815  -4.447
  358    H    PHE  45           H        PHE  45   3.014   0.964  -3.554
  359    HA   PHE  45           HA       PHE  45   2.987  -1.624  -4.790
  360    HB2  PHE  45           2HB      PHE  45   5.061   0.552  -4.570
  361    HB3  PHE  45           1HB      PHE  45   5.416  -1.003  -5.316
  362    HD1  PHE  45           1HD      PHE  45   2.527  -1.257  -6.483
  363    HD2  PHE  45           2HD      PHE  45   5.502   1.784  -6.594
  364    HE1  PHE  45           1HE      PHE  45   1.610  -0.443  -8.617
  365    HE2  PHE  45           2HE      PHE  45   4.590   2.604  -8.727
  366    HZ   PHE  45           HZ       PHE  45   2.641   1.490  -9.741
  367    H    ALA  46           H        ALA  46   3.963  -0.277  -1.796
  368    HA   ALA  46           HA       ALA  46   5.944  -2.152  -1.068
  369    HB1  ALA  46           1HB      ALA  46   4.566  -1.181   1.234
  370    HB2  ALA  46           2HB      ALA  46   4.772   0.134   0.078
  371    HB3  ALA  46           3HB      ALA  46   6.177  -0.766   0.649
  372    H    ILE  47           H        ILE  47   2.536  -1.882  -0.206
  373    HA   ILE  47           HA       ILE  47   2.394  -4.317   1.208
  374    HB   ILE  47           HB       ILE  47  -0.167  -3.981   0.394
  375   HG12  ILE  47          2HG1      ILE  47   0.977  -1.868  -0.845
  376   HG13  ILE  47          1HG1      ILE  47  -0.688  -1.873  -0.275
  377   HG21  ILE  47          1HG2      ILE  47   1.240  -2.454   2.581
  378   HG22  ILE  47          2HG2      ILE  47   0.603  -4.095   2.696
  379   HG23  ILE  47          3HG2      ILE  47  -0.499  -2.735   2.480
  380   HD11  ILE  47          3HD1      ILE  47  -0.258  -0.428   1.411
  381   HD12  ILE  47          1HD1      ILE  47   1.022   0.069   0.305
  382   HD13  ILE  47          2HD1      ILE  47   1.389  -1.016   1.646
  383    H    GLU  48           H        GLU  48   1.976  -3.475  -2.168
  384    HA   GLU  48           HA       GLU  48   0.706  -5.755  -3.108
  385    HB2  GLU  48           2HB      GLU  48   1.933  -3.501  -4.236
  386    HB3  GLU  48           1HB      GLU  48   2.750  -4.882  -4.955
  387    HG2  GLU  48           2HG      GLU  48   0.219  -5.695  -5.221
  388    HG3  GLU  48           1HG      GLU  48  -0.034  -3.950  -5.254
  389    H    GLN  49           H        GLN  49   4.058  -5.198  -2.317
  390    HA   GLN  49           HA       GLN  49   4.941  -7.728  -3.339
  391    HB2  GLN  49           2HB      GLN  49   7.072  -7.089  -2.055
  392    HB3  GLN  49           1HB      GLN  49   6.603  -6.081  -3.417
  393    HG2  GLN  49           2HG      GLN  49   5.629  -4.453  -1.886
  394    HG3  GLN  49           1HG      GLN  49   6.083  -5.467  -0.517
  395   HE21  GLN  49          1HE2      GLN  49   7.329  -3.554  -3.185
  396   HE22  GLN  49          2HE2      GLN  49   8.873  -3.232  -2.480
  397    H    GLU  50           H        GLU  50   3.910  -6.435  -0.258
  398    HA   GLU  50           HA       GLU  50   4.518  -8.982   1.012
  399    HB2  GLU  50           2HB      GLU  50   4.723  -7.912   3.042
  400    HB3  GLU  50           1HB      GLU  50   5.292  -6.666   1.940
  401    HG2  GLU  50           2HG      GLU  50   3.664  -5.279   2.522
  402    HG3  GLU  50           1HG      GLU  50   2.431  -6.524   2.329
  403    H    PHE  51           H        PHE  51   2.273  -8.710  -0.728
  404    HA   PHE  51           HA       PHE  51   0.240  -9.677   1.041
  405    HB2  PHE  51           2HB      PHE  51   0.034  -7.009  -0.223
  406    HB3  PHE  51           1HB      PHE  51  -1.414  -8.008  -0.242
  407    HD1  PHE  51           2HD      PHE  51  -1.343  -9.387   2.289
  408    HD2  PHE  51           1HD      PHE  51  -0.266  -5.374   1.372
  409    HE1  PHE  51           2HE      PHE  51  -1.831  -8.731   4.609
  410    HE2  PHE  51           1HE      PHE  51  -0.750  -4.709   3.690
  411    HZ   PHE  51           HZ       PHE  51  -1.534  -6.390   5.313
  412    H    ILE  52           H        ILE  52   1.526  -9.310  -2.149
  413    HA   ILE  52           HA       ILE  52   1.195 -10.491  -4.060
  414    HB   ILE  52           HB       ILE  52  -0.794 -12.376  -3.050
  415   HG12  ILE  52          2HG1      ILE  52   1.551 -13.262  -1.778
  416   HG13  ILE  52          1HG1      ILE  52   1.338 -11.585  -1.291
  417   HG21  ILE  52          1HG2      ILE  52   0.917 -13.996  -3.856
  418   HG22  ILE  52          2HG2      ILE  52   1.959 -12.626  -4.241
  419   HG23  ILE  52          3HG2      ILE  52   0.413 -12.818  -5.068
  420   HD11  ILE  52          3HD1      ILE  52  -0.237 -13.959  -0.613
  421   HD12  ILE  52          1HD1      ILE  52  -1.171 -12.507  -0.970
  422   HD13  ILE  52          2HD1      ILE  52   0.050 -12.480   0.303
  423    H    LEU  53           H        LEU  53  -0.416  -8.243  -3.528
  424    HA   LEU  53           HA       LEU  53  -2.520  -8.704  -5.409
  425    HB2  LEU  53           2HB      LEU  53  -3.590  -9.369  -3.288
  426    HB3  LEU  53           1HB      LEU  53  -3.219  -7.792  -2.619
  427    HG   LEU  53           HG       LEU  53  -4.603  -7.044  -4.812
  428   HD11  LEU  53          1HD1      LEU  53  -4.978  -9.492  -5.326
  429   HD12  LEU  53          2HD1      LEU  53  -6.419  -8.479  -5.259
  430   HD13  LEU  53          3HD1      LEU  53  -6.019  -9.534  -3.903
  431   HD21  LEU  53          3HD2      LEU  53  -5.344  -7.599  -1.991
  432   HD22  LEU  53          1HD2      LEU  53  -6.636  -7.207  -3.126
  433   HD23  LEU  53          2HD2      LEU  53  -5.309  -6.073  -2.876
  434    H    ASP  54           H        ASP  54  -3.119  -6.840  -6.475
  435    HA   ASP  54           HA       ASP  54  -1.384  -4.595  -6.117
  436    HB2  ASP  54           2HB      ASP  54  -1.846  -5.185  -8.371
  437    HB3  ASP  54           1HB      ASP  54  -3.583  -5.208  -8.082
  438    H    ILE  55           H        ILE  55  -1.909  -2.538  -5.477
  439    HA   ILE  55           HA       ILE  55  -4.515  -2.234  -4.183
  440    HB   ILE  55           HB       ILE  55  -1.846  -1.036  -3.486
  441   HG12  ILE  55          2HG1      ILE  55  -1.893  -3.025  -2.352
  442   HG13  ILE  55          1HG1      ILE  55  -2.779  -2.035  -1.195
  443   HG21  ILE  55          1HG2      ILE  55  -3.815   0.589  -3.399
  444   HG22  ILE  55          2HG2      ILE  55  -2.844   0.408  -1.937
  445   HG23  ILE  55          3HG2      ILE  55  -4.409  -0.397  -2.063
  446   HD11  ILE  55          3HD1      ILE  55  -4.084  -3.737  -3.300
  447   HD12  ILE  55          1HD1      ILE  55  -4.868  -2.893  -1.966
  448   HD13  ILE  55          2HD1      ILE  55  -3.794  -4.253  -1.639
  449    HA   PRO  56           HA       PRO  56  -3.128   1.980  -6.481
  450    HB2  PRO  56           2HB      PRO  56  -2.210   0.469  -8.886
  451    HB3  PRO  56           1HB      PRO  56  -1.628   2.005  -8.232
  452    HG2  PRO  56           2HG      PRO  56  -0.226  -0.226  -7.882
  453    HG3  PRO  56           1HG      PRO  56  -0.358   0.976  -6.585
  454    HD2  PRO  56           2HD      PRO  56  -1.713  -1.665  -6.871
  455    HD3  PRO  56           1HD      PRO  56  -1.140  -0.844  -5.405
  456    H    ASP  57           H        ASP  57  -3.615   2.011  -9.348
  457    HA   ASP  57           HA       ASP  57  -5.337   2.043 -10.834
  458    HB2  ASP  57           2HB      ASP  57  -6.612  -0.218  -9.304
  459    HB3  ASP  57           1HB      ASP  57  -6.745   0.150 -11.021
  460    H    HIS  58           H        HIS  58  -8.051   1.649 -10.583
  461    HA   HIS  58           HA       HIS  58  -8.895   4.020  -9.362
  462    HB2  HIS  58           2HB      HIS  58 -10.336   1.598 -10.398
  463    HB3  HIS  58           1HB      HIS  58 -11.225   2.874  -9.573
  464    HD1  HIS  58           1HD      HIS  58 -12.451   3.257 -11.891
  465    HD2  HIS  58           2HD      HIS  58  -8.391   4.146 -11.847
  466    HE1  HIS  58           1HE      HIS  58 -12.041   4.633 -13.956
  467    HE2  HIS  58           2HE      HIS  58  -9.595   5.229 -13.864
  468    H    ASP  59           H        ASP  59  -8.153   1.017  -7.983
  469    HA   ASP  59           HA       ASP  59  -9.963   1.025  -5.807
  470    HB2  ASP  59           2HB      ASP  59  -7.303  -0.341  -6.215
  471    HB3  ASP  59           1HB      ASP  59  -8.312  -0.595  -4.793
  472    H    ALA  60           H        ALA  60  -6.615   2.135  -6.174
  473    HA   ALA  60           HA       ALA  60  -6.541   3.133  -3.474
  474    HB1  ALA  60           1HB      ALA  60  -4.549   3.215  -5.723
  475    HB2  ALA  60           2HB      ALA  60  -4.507   2.206  -4.277
  476    HB3  ALA  60           3HB      ALA  60  -4.262   3.948  -4.144
  477    H    GLU  61           H        GLU  61  -7.148   4.348  -6.653
  478    HA   GLU  61           HA       GLU  61  -6.798   7.110  -5.971
  479    HB2  GLU  61           2HB      GLU  61  -7.806   5.631  -8.371
  480    HB3  GLU  61           1HB      GLU  61  -8.097   7.359  -8.229
  481    HG2  GLU  61           2HG      GLU  61  -5.448   7.229  -7.674
  482    HG3  GLU  61           1HG      GLU  61  -5.627   5.899  -8.818
  483    H    LYS  62           H        LYS  62  -9.484   4.860  -6.199
  484    HA   LYS  62           HA       LYS  62 -11.482   6.878  -5.794
  485    HB2  LYS  62           2HB      LYS  62 -11.596   3.863  -5.786
  486    HB3  LYS  62           1HB      LYS  62 -13.006   4.883  -5.527
  487    HG2  LYS  62           2HG      LYS  62 -11.420   4.434  -8.006
  488    HG3  LYS  62           1HG      LYS  62 -13.168   4.436  -7.769
  489    HD2  LYS  62           2HD      LYS  62 -11.465   6.910  -7.541
  490    HD3  LYS  62           1HD      LYS  62 -12.236   6.402  -9.044
  491    HE2  LYS  62           2HE      LYS  62 -14.364   6.812  -8.246
  492    HE3  LYS  62           1HE      LYS  62 -13.872   6.658  -6.559
  493    HZ1  LYS  62           3HZ      LYS  62 -13.485   8.946  -8.386
  494    HZ2  LYS  62           1HZ      LYS  62 -12.534   8.766  -6.997
  495    HZ3  LYS  62           2HZ      LYS  62 -14.212   8.924  -6.859
  496    H    ILE  63           H        ILE  63  -9.227   5.766  -3.782
  497    HA   ILE  63           HA       ILE  63 -10.979   5.661  -1.443
  498    HB   ILE  63           HB       ILE  63  -8.632   4.185  -2.163
  499   HG12  ILE  63          2HG1      ILE  63  -9.680   3.626   0.477
  500   HG13  ILE  63          1HG1      ILE  63 -10.988   3.878  -0.674
  501   HG21  ILE  63          1HG2      ILE  63  -8.425   5.789   0.378
  502   HG22  ILE  63          2HG2      ILE  63  -7.307   5.784  -0.986
  503   HG23  ILE  63          3HG2      ILE  63  -7.458   4.355   0.036
  504   HD11  ILE  63          3HD1      ILE  63 -10.551   1.579  -0.701
  505   HD12  ILE  63          1HD1      ILE  63  -8.806   1.826  -0.758
  506   HD13  ILE  63          2HD1      ILE  63  -9.797   2.212  -2.165
  507    H    GLN  64           H        GLN  64 -11.063   7.384  -0.151
  508    HA   GLN  64           HA       GLN  64  -8.865   9.296  -0.251
  509    HB2  GLN  64           2HB      GLN  64 -11.803   9.823   0.168
  510    HB3  GLN  64           1HB      GLN  64 -10.546  11.043   0.317
  511    HG2  GLN  64           2HG      GLN  64 -11.001  11.476  -1.821
  512    HG3  GLN  64           1HG      GLN  64 -10.027  10.044  -2.153
  513   HE21  GLN  64          1HE2      GLN  64 -11.248   7.965  -2.169
  514   HE22  GLN  64          2HE2      GLN  64 -12.819   7.969  -2.886
  515    H    SER  65           H        SER  65 -11.308   7.795   1.801
  516    HA   SER  65           HA       SER  65 -10.266   8.982   4.207
  517    HB2  SER  65           2HB      SER  65 -12.690   7.916   3.544
  518    HB3  SER  65           1HB      SER  65 -11.978   6.596   4.472
  519    HG   SER  65           HG       SER  65 -11.651   8.051   6.181
  520    H    ILE  66           H        ILE  66  -9.426   7.726   6.008
  521    HA   ILE  66           HA       ILE  66  -7.287   6.055   5.237
  522    HB   ILE  66           HB       ILE  66  -8.201   5.898   8.040
  523   HG12  ILE  66          2HG1      ILE  66  -6.906   8.321   8.047
  524   HG13  ILE  66          1HG1      ILE  66  -7.931   8.435   6.625
  525   HG21  ILE  66          1HG2      ILE  66  -5.874   6.142   8.515
  526   HG22  ILE  66          2HG2      ILE  66  -5.540   6.672   6.867
  527   HG23  ILE  66          3HG2      ILE  66  -6.038   5.008   7.175
  528   HD11  ILE  66          3HD1      ILE  66  -9.437   7.346   8.789
  529   HD12  ILE  66          1HD1      ILE  66  -9.699   8.837   7.885
  530   HD13  ILE  66          2HD1      ILE  66  -8.646   8.838   9.301
  531    HA   PRO  67           HA       PRO  67 -10.213   2.625   7.237
  532    HB2  PRO  67           2HB      PRO  67 -12.833   3.072   6.471
  533    HB3  PRO  67           1HB      PRO  67 -12.171   3.432   8.068
  534    HG2  PRO  67           2HG      PRO  67 -12.631   5.257   5.750
  535    HG3  PRO  67           1HG      PRO  67 -12.876   5.556   7.481
  536    HD2  PRO  67           2HD      PRO  67 -10.741   6.520   6.175
  537    HD3  PRO  67           1HD      PRO  67 -10.624   5.961   7.856
  538    H    ASP  68           H        ASP  68 -12.112   3.866   4.496
  539    HA   ASP  68           HA       ASP  68 -12.355   1.559   3.078
  540    HB2  ASP  68           2HB      ASP  68 -12.813   2.871   1.141
  541    HB3  ASP  68           1HB      ASP  68 -13.350   3.820   2.524
  542    H    ALA  69           H        ALA  69  -9.495   3.435   3.481
  543    HA   ALA  69           HA       ALA  69  -8.066   2.436   1.242
  544    HB1  ALA  69           1HB      ALA  69  -6.121   3.490   2.250
  545    HB2  ALA  69           2HB      ALA  69  -7.024   3.733   3.747
  546    HB3  ALA  69           3HB      ALA  69  -7.515   4.570   2.275
  547    H    VAL  70           H        VAL  70  -6.651   2.152   4.400
  548    HA   VAL  70           HA       VAL  70  -5.449  -0.327   3.843
  549    HB   VAL  70           HB       VAL  70  -4.591   1.359   5.476
  550   HG11  VAL  70          1HG1      VAL  70  -5.507   1.630   7.602
  551   HG12  VAL  70          2HG1      VAL  70  -6.487   0.170   7.471
  552   HG13  VAL  70          3HG1      VAL  70  -6.916   1.606   6.541
  553   HG21  VAL  70          3HG2      VAL  70  -4.075  -0.486   7.269
  554   HG22  VAL  70          1HG2      VAL  70  -3.432  -0.618   5.632
  555   HG23  VAL  70          2HG2      VAL  70  -4.858  -1.545   6.096
  556    H    GLU  71           H        GLU  71  -8.584   0.410   4.916
  557    HA   GLU  71           HA       GLU  71  -9.039  -1.994   6.387
  558    HB2  GLU  71           2HB      GLU  71 -11.093  -0.114   5.227
  559    HB3  GLU  71           1HB      GLU  71 -11.338  -1.280   6.519
  560    HG2  GLU  71           2HG      GLU  71  -9.425   1.025   6.732
  561    HG3  GLU  71           1HG      GLU  71 -11.115   1.119   7.225
  562    H    TYR  72           H        TYR  72  -9.833  -0.831   3.128
  563    HA   TYR  72           HA       TYR  72 -11.308  -3.104   2.376
  564    HB2  TYR  72           2HB      TYR  72 -11.723  -1.909   0.539
  565    HB3  TYR  72           1HB      TYR  72 -10.703  -0.650   1.222
  566    HD1  TYR  72           1HD      TYR  72  -8.312  -0.521   0.565
  567    HD2  TYR  72           2HD      TYR  72 -11.023  -3.179  -1.347
  568    HE1  TYR  72           1HE      TYR  72  -6.740  -0.760  -1.305
  569    HE2  TYR  72           2HE      TYR  72  -9.463  -3.423  -3.233
  570    HH   TYR  72           HH       TYR  72  -6.979  -1.378  -3.841
  571    H    ILE  73           H        ILE  73  -7.909  -2.256   1.809
  572    HA   ILE  73           HA       ILE  73  -7.339  -4.666   0.429
  573    HB   ILE  73           HB       ILE  73  -5.165  -4.013   0.249
  574   HG12  ILE  73          2HG1      ILE  73  -4.364  -4.178   2.451
  575   HG13  ILE  73          1HG1      ILE  73  -4.051  -2.510   1.979
  576   HG21  ILE  73          1HG2      ILE  73  -5.152  -1.373   0.596
  577   HG22  ILE  73          2HG2      ILE  73  -6.888  -1.662   0.661
  578   HG23  ILE  73          3HG2      ILE  73  -5.962  -2.169  -0.752
  579   HD11  ILE  73          3HD1      ILE  73  -6.571  -2.453   3.137
  580   HD12  ILE  73          1HD1      ILE  73  -5.055  -1.896   3.843
  581   HD13  ILE  73          2HD1      ILE  73  -5.619  -3.534   4.155
  582    H    ALA  74           H        ALA  74  -7.432  -3.781   3.769
  583    HA   ALA  74           HA       ALA  74  -5.873  -5.835   4.862
  584    HB1  ALA  74           1HB      ALA  74  -7.576  -3.773   5.833
  585    HB2  ALA  74           2HB      ALA  74  -6.328  -4.674   6.695
  586    HB3  ALA  74           3HB      ALA  74  -7.983  -5.279   6.655
  587    H    GLN  75           H        GLN  75  -9.259  -5.724   3.966
  588    HA   GLN  75           HA       GLN  75  -9.808  -8.345   4.971
  589    HB2  GLN  75           2HB      GLN  75 -11.490  -6.686   3.094
  590    HB3  GLN  75           1HB      GLN  75 -12.028  -8.047   4.068
  591    HG2  GLN  75           2HG      GLN  75 -11.774  -5.250   4.763
  592    HG3  GLN  75           1HG      GLN  75 -12.680  -6.537   5.557
  593   HE21  GLN  75          1HE2      GLN  75 -10.669  -4.282   6.319
  594   HE22  GLN  75          2HE2      GLN  75  -9.640  -5.070   7.462
  595    H    ASN  76           H        ASN  76  -8.726  -6.946   2.023
  596    HA   ASN  76           HA       ASN  76  -9.474  -8.803   0.123
  597    HB2  ASN  76           2HB      ASN  76  -7.320  -6.830   0.413
  598    HB3  ASN  76           1HB      ASN  76  -6.917  -8.170  -0.651
  599   HD21  ASN  76          1HD2      ASN  76  -8.860  -5.383  -0.180
  600   HD22  ASN  76          2HD2      ASN  76  -9.565  -5.333  -1.757
  601    HA   PRO  77           HA       PRO  77  -5.785 -11.598   1.151
  602    HB2  PRO  77           2HB      PRO  77  -3.833 -10.814   2.796
  603    HB3  PRO  77           1HB      PRO  77  -3.922 -10.215   1.135
  604    HG2  PRO  77           2HG      PRO  77  -4.713  -8.869   3.680
  605    HG3  PRO  77           1HG      PRO  77  -3.916  -8.188   2.251
  606    HD2  PRO  77           2HD      PRO  77  -6.630  -7.994   2.821
  607    HD3  PRO  77           1HD      PRO  77  -5.902  -7.769   1.218
  608    H    MET  78           H        MET  78  -7.267  -9.889   3.766
  609    HA   MET  78           HA       MET  78  -6.642 -11.692   5.857
  610    HB2  MET  78           2HB      MET  78  -8.493  -9.419   5.468
  611    HB3  MET  78           1HB      MET  78  -8.938 -10.571   6.718
  612    HG2  MET  78           2HG      MET  78  -6.222  -9.301   6.574
  613    HG3  MET  78           1HG      MET  78  -7.573  -8.580   7.448
  614    HE1  MET  78           3HE      MET  78  -7.634  -9.477  10.477
  615    HE2  MET  78           1HE      MET  78  -8.558 -10.918  10.050
  616    HE3  MET  78           2HE      MET  78  -8.780  -9.426   9.136
  617    H    ALA  79           H        ALA  79  -8.850 -11.861   3.248
  618    HA   ALA  79           HA       ALA  79  -9.676 -14.475   3.994
  619    HB1  ALA  79           1HB      ALA  79 -11.158 -12.646   5.260
  620    HB2  ALA  79           2HB      ALA  79 -11.801 -14.197   4.721
  621    HB3  ALA  79           3HB      ALA  79 -12.059 -12.750   3.747
  622    H    LYS  80           H        LYS  80  -8.472 -13.060   1.742
  623    HA   LYS  80           HA       LYS  80  -9.606 -12.391  -0.465
  624    HB2  LYS  80           2HB      LYS  80  -8.191 -15.033  -0.650
  625    HB3  LYS  80           1HB      LYS  80  -8.138 -13.676  -1.766
  626    HG2  LYS  80           2HG      LYS  80  -6.134 -13.337  -0.804
  627    HG3  LYS  80           1HG      LYS  80  -7.103 -12.502   0.410
  628    HD2  LYS  80           2HD      LYS  80  -5.615 -13.960   1.568
  629    HD3  LYS  80           1HD      LYS  80  -7.228 -14.670   1.666
  630    HE2  LYS  80           2HE      LYS  80  -6.640 -16.117  -0.270
  631    HE3  LYS  80           1HE      LYS  80  -4.998 -15.478  -0.194
  632    HZ1  LYS  80           3HZ      LYS  80  -4.555 -17.054   1.276
  633    HZ2  LYS  80           1HZ      LYS  80  -6.175 -17.542   1.341
  634    HZ3  LYS  80           2HZ      LYS  80  -5.619 -16.315   2.364
  635   H282  PNS 101          8H2       PNS 101   1.037  15.527 -10.600
  636   H281  PNS 101          9H2       PNS 101   0.843  13.804 -10.937
  637   H303  PNS 101          0H3       PNS 101   3.971  14.787  -8.350
  638   H302  PNS 101          1H3       PNS 101   2.313  15.347  -8.129
  639   H301  PNS 101          2H3       PNS 101   3.384  16.183  -9.253
  640   H313  PNS 101          3H3       PNS 101   2.627  12.744  -8.517
  641   H312  PNS 101          4H3       PNS 101   3.936  12.630  -9.695
  642   H311  PNS 101          5H3       PNS 101   2.285  12.228 -10.169
  643    H32  PNS 101           6H3      PNS 101   2.720  14.292 -11.947
  644    H33  PNS 101           7H3      PNS 101   4.298  16.393 -11.232
  645    H36  PNS 101           8H3      PNS 101   6.038  12.986 -10.485
  646   H372  PNS 101          9H3       PNS 101   6.559  14.814  -9.218
  647   H371  PNS 101          0H4       PNS 101   5.072  15.583  -9.772
  648   H382  PNS 101          1H4       PNS 101   6.083  16.473 -11.661
  649   H381  PNS 101          2H4       PNS 101   7.321  16.648 -10.419
  650    H41  PNS 101           3H4      PNS 101   6.792  14.001 -13.196
  651   H422  PNS 101          4H4       PNS 101   7.797  15.567 -14.913
  652   H421  PNS 101          5H4       PNS 101   6.094  15.842 -14.547
  653   H431  PNS 101          7H4       PNS 101   6.732  17.959 -14.145
  654   H432  PNS 101          6H4       PNS 101   7.339  17.321 -12.609
  655    H44  PNS 101           8H4      PNS 101   9.080  18.049 -15.063
  Start of MODEL    3
    1    H1   MET   1           1HT      MET   1  -5.783  -6.108   8.409
    2    H2   MET   1           2HT      MET   1  -6.516  -7.660   8.415
    3    H3   MET   1           3HT      MET   1  -4.806  -7.517   8.443
    4    HA   MET   1           HA       MET   1  -6.709  -6.741  10.548
    5    HB2  MET   1           2HB      MET   1  -5.495  -9.174   9.890
    6    HB3  MET   1           1HB      MET   1  -4.530  -8.539  11.216
    7    HG2  MET   1           2HG      MET   1  -7.285  -8.199  11.844
    8    HG3  MET   1           1HG      MET   1  -7.015  -9.863  11.330
    9    HE1  MET   1           2HE      MET   1  -4.949 -11.073  11.955
   10    HE2  MET   1           3HE      MET   1  -4.690 -11.415  13.666
   11    HE3  MET   1           1HE      MET   1  -3.685 -10.223  12.843
   12    H    ASN   2           H        ASN   2  -4.477  -7.271  12.417
   13    HA   ASN   2           HA       ASN   2  -3.509  -4.632  12.646
   14    HB2  ASN   2           2HB      ASN   2  -2.742  -7.195  14.031
   15    HB3  ASN   2           1HB      ASN   2  -1.980  -5.651  14.408
   16   HD21  ASN   2          1HD2      ASN   2  -5.349  -6.393  13.630
   17   HD22  ASN   2          2HD2      ASN   2  -6.002  -5.818  15.122
   18    H    ASP   3           H        ASP   3  -2.221  -7.514  11.191
   19    HA   ASP   3           HA       ASP   3   0.469  -6.760  11.003
   20    HB2  ASP   3           2HB      ASP   3  -0.842  -8.368   8.845
   21    HB3  ASP   3           1HB      ASP   3   0.749  -8.572   9.571
   22    H    VAL   4           H        VAL   4  -2.244  -6.190   8.843
   23    HA   VAL   4           HA       VAL   4  -0.727  -4.931   6.802
   24    HB   VAL   4           HB       VAL   4  -3.005  -4.021   6.084
   25   HG11  VAL   4          1HG1      VAL   4  -2.413  -5.813   4.816
   26   HG12  VAL   4          2HG1      VAL   4  -3.784  -6.530   5.666
   27   HG13  VAL   4          3HG1      VAL   4  -2.139  -6.852   6.215
   28   HG21  VAL   4          3HG2      VAL   4  -4.935  -5.244   7.099
   29   HG22  VAL   4          1HG2      VAL   4  -4.173  -4.066   8.168
   30   HG23  VAL   4          2HG2      VAL   4  -3.847  -5.786   8.376
   31    H    LEU   5           H        LEU   5  -2.739  -3.660   9.434
   32    HA   LEU   5           HA       LEU   5  -2.353  -0.943   8.805
   33    HB2  LEU   5           2HB      LEU   5  -3.702  -2.473  10.803
   34    HB3  LEU   5           1HB      LEU   5  -2.813  -1.174  11.572
   35    HG   LEU   5           HG       LEU   5  -4.015   0.185   9.559
   36   HD11  LEU   5          1HD1      LEU   5  -5.217  -2.185   9.234
   37   HD12  LEU   5          2HD1      LEU   5  -6.015  -0.645   8.912
   38   HD13  LEU   5          3HD1      LEU   5  -6.290  -1.478  10.442
   39   HD21  LEU   5          3HD2      LEU   5  -5.895   0.384  11.501
   40   HD22  LEU   5          1HD2      LEU   5  -4.346   1.227  11.522
   41   HD23  LEU   5          2HD2      LEU   5  -4.540  -0.285  12.410
   42    H    THR   6           H        THR   6  -0.599  -3.216  10.769
   43    HA   THR   6           HA       THR   6   0.992  -1.456  12.220
   44    HB   THR   6           HB       THR   6   0.798  -4.224  11.917
   45    HG1  THR   6           1HG      THR   6   2.689  -2.826  13.493
   46   HG21  THR   6          3HG2      THR   6   3.334  -4.713  12.008
   47   HG22  THR   6          1HG2      THR   6   3.475  -3.225  11.070
   48   HG23  THR   6          2HG2      THR   6   2.529  -4.577  10.444
   49    H    ARG   7           H        ARG   7   1.844  -3.178   9.244
   50    HA   ARG   7           HA       ARG   7   4.220  -1.652   8.871
   51    HB2  ARG   7           2HB      ARG   7   4.215  -3.931   8.123
   52    HB3  ARG   7           1HB      ARG   7   2.798  -3.653   7.120
   53    HG2  ARG   7           2HG      ARG   7   5.219  -2.024   6.583
   54    HG3  ARG   7           1HG      ARG   7   5.236  -3.724   6.113
   55    HD2  ARG   7           2HD      ARG   7   2.749  -2.684   5.302
   56    HD3  ARG   7           1HD      ARG   7   3.967  -1.501   4.827
   57    HE   ARG   7           HE       ARG   7   3.594  -4.144   3.745
   58   HH11  ARG   7          1HH1      ARG   7   5.814  -1.498   4.190
   59   HH12  ARG   7          2HH1      ARG   7   6.810  -1.937   2.844
   60   HH21  ARG   7          1HH2      ARG   7   4.902  -4.733   1.970
   61   HH22  ARG   7          2HH2      ARG   7   6.292  -3.777   1.581
   62    H    VAL   8           H        VAL   8   1.050  -1.794   7.314
   63    HA   VAL   8           HA       VAL   8   1.564   0.074   5.301
   64    HB   VAL   8           HB       VAL   8  -0.543  -1.509   5.849
   65   HG11  VAL   8          1HG1      VAL   8  -1.357  -0.100   7.658
   66   HG12  VAL   8          2HG1      VAL   8  -2.498  -0.107   6.313
   67   HG13  VAL   8          3HG1      VAL   8  -1.438   1.280   6.562
   68   HG21  VAL   8          3HG2      VAL   8  -1.548   0.579   4.208
   69   HG22  VAL   8          1HG2      VAL   8  -0.897  -0.988   3.724
   70   HG23  VAL   8          2HG2      VAL   8   0.177   0.402   3.885
   71    H    LEU   9           H        LEU   9   0.038   0.522   8.491
   72    HA   LEU   9           HA       LEU   9  -0.402   3.279   8.275
   73    HB2  LEU   9           2HB      LEU   9  -1.102   3.161  10.415
   74    HB3  LEU   9           1HB      LEU   9  -0.986   1.438  10.146
   75    HG   LEU   9           HG       LEU   9   1.499   1.853  11.018
   76   HD11  LEU   9          1HD1      LEU   9   0.474   4.374  11.317
   77   HD12  LEU   9          2HD1      LEU   9   1.869   3.724  12.179
   78   HD13  LEU   9          3HD1      LEU   9   0.273   3.684  12.928
   79   HD21  LEU   9          3HD2      LEU   9   0.674   1.272  13.281
   80   HD22  LEU   9          1HD2      LEU   9  -0.021   0.279  12.002
   81   HD23  LEU   9          2HD2      LEU   9  -0.971   1.578  12.721
   82    H    GLU  10           H        GLU  10   2.403   1.502   9.530
   83    HA   GLU  10           HA       GLU  10   3.878   3.775  10.303
   84    HB2  GLU  10           2HB      GLU  10   5.758   2.305  10.518
   85    HB3  GLU  10           1HB      GLU  10   4.329   1.433  11.056
   86    HG2  GLU  10           2HG      GLU  10   4.570  -0.130   9.497
   87    HG3  GLU  10           1HG      GLU  10   4.858   1.059   8.228
   88    H    VAL  11           H        VAL  11   3.526   2.053   7.313
   89    HA   VAL  11           HA       VAL  11   5.692   3.044   5.887
   90    HB   VAL  11           HB       VAL  11   3.137   1.818   5.204
   91   HG11  VAL  11          1HG1      VAL  11   3.151   3.822   3.754
   92   HG12  VAL  11          2HG1      VAL  11   3.247   2.310   2.850
   93   HG13  VAL  11          3HG1      VAL  11   4.696   3.287   3.091
   94   HG21  VAL  11          3HG2      VAL  11   5.036   0.826   3.521
   95   HG22  VAL  11          1HG2      VAL  11   4.653   0.178   5.118
   96   HG23  VAL  11          2HG2      VAL  11   5.995   1.308   4.922
   97    H    VAL  12           H        VAL  12   2.364   4.222   5.880
   98    HA   VAL  12           HA       VAL  12   2.882   6.497   4.285
   99    HB   VAL  12           HB       VAL  12   0.666   7.282   5.543
  100   HG11  VAL  12          1HG1      VAL  12  -0.222   5.194   3.857
  101   HG12  VAL  12          2HG1      VAL  12   1.288   5.809   3.184
  102   HG13  VAL  12          3HG1      VAL  12  -0.058   6.910   3.479
  103   HG21  VAL  12          3HG2      VAL  12   0.015   4.436   5.692
  104   HG22  VAL  12          1HG2      VAL  12  -0.405   5.755   6.784
  105   HG23  VAL  12          2HG2      VAL  12   1.169   4.969   6.915
  106    H    LYS  13           H        LYS  13   2.517   6.105   7.800
  107    HA   LYS  13           HA       LYS  13   2.745   8.754   8.567
  108    HB2  LYS  13           2HB      LYS  13   3.313   7.958  10.737
  109    HB3  LYS  13           1HB      LYS  13   2.224   6.769  10.037
  110    HG2  LYS  13           2HG      LYS  13   4.107   5.336   9.489
  111    HG3  LYS  13           1HG      LYS  13   5.225   6.539  10.152
  112    HD2  LYS  13           2HD      LYS  13   3.043   5.166  11.723
  113    HD3  LYS  13           1HD      LYS  13   4.737   4.673  11.718
  114    HE2  LYS  13           2HE      LYS  13   4.098   7.508  12.342
  115    HE3  LYS  13           1HE      LYS  13   3.757   6.290  13.571
  116    HZ1  LYS  13           3HZ      LYS  13   6.235   7.428  12.855
  117    HZ2  LYS  13           1HZ      LYS  13   6.298   5.758  12.592
  118    HZ3  LYS  13           2HZ      LYS  13   5.887   6.359  14.118
  119    H    ASN  14           H        ASN  14   5.345   6.367   8.129
  120    HA   ASN  14           HA       ASN  14   7.369   8.360   8.547
  121    HB2  ASN  14           2HB      ASN  14   7.739   5.520   7.594
  122    HB3  ASN  14           1HB      ASN  14   8.957   6.569   8.314
  123   HD21  ASN  14          1HD2      ASN  14   6.944   4.057   8.900
  124   HD22  ASN  14          2HD2      ASN  14   6.806   4.184  10.618
  125    H    PHE  15           H        PHE  15   5.413   7.627   6.022
  126    HA   PHE  15           HA       PHE  15   7.080   7.487   3.797
  127    HB2  PHE  15           2HB      PHE  15   4.328   7.677   4.255
  128    HB3  PHE  15           1HB      PHE  15   4.723   9.065   3.245
  129    HD1  PHE  15           2HD      PHE  15   5.752   8.719   1.025
  130    HD2  PHE  15           1HD      PHE  15   4.365   5.470   3.398
  131    HE1  PHE  15           2HE      PHE  15   5.776   7.264  -0.959
  132    HE2  PHE  15           1HE      PHE  15   4.388   4.009   1.419
  133    HZ   PHE  15           HZ       PHE  15   5.094   4.906  -0.763
  134    H    GLU  16           H        GLU  16   5.271  10.385   4.709
  135    HA   GLU  16           HA       GLU  16   7.339  12.179   4.976
  136    HB2  GLU  16           2HB      GLU  16   7.876  13.036   2.891
  137    HB3  GLU  16           1HB      GLU  16   7.721  11.320   2.546
  138    HG2  GLU  16           2HG      GLU  16   6.142  11.708   1.065
  139    HG3  GLU  16           1HG      GLU  16   5.183  12.585   2.253
  140    H    LYS  17           H        LYS  17   4.109  11.519   3.921
  141    HA   LYS  17           HA       LYS  17   3.082  14.090   3.667
  142    HB2  LYS  17           2HB      LYS  17   0.951  13.130   3.802
  143    HB3  LYS  17           1HB      LYS  17   1.960  11.838   3.179
  144    HG2  LYS  17           2HG      LYS  17   1.690  11.919   6.103
  145    HG3  LYS  17           1HG      LYS  17   0.214  11.565   5.208
  146    HD2  LYS  17           2HD      LYS  17   2.590  10.139   4.261
  147    HD3  LYS  17           1HD      LYS  17   2.084   9.717   5.899
  148    HE2  LYS  17           2HE      LYS  17   0.219   9.775   3.538
  149    HE3  LYS  17           1HE      LYS  17   1.073   8.324   4.066
  150    HZ1  LYS  17           3HZ      LYS  17   0.004   8.716   6.294
  151    HZ2  LYS  17           1HZ      LYS  17  -1.046   8.246   5.053
  152    HZ3  LYS  17           2HZ      LYS  17  -0.984   9.865   5.541
  153    H    VAL  18           H        VAL  18   3.261  12.054   6.588
  154    HA   VAL  18           HA       VAL  18   3.843  14.114   8.346
  155    HB   VAL  18           HB       VAL  18   1.321  13.854   9.407
  156   HG11  VAL  18          1HG1      VAL  18   1.103  16.225   8.174
  157   HG12  VAL  18          2HG1      VAL  18   2.833  15.945   7.970
  158   HG13  VAL  18          3HG1      VAL  18   2.126  15.960   9.586
  159   HG21  VAL  18          3HG2      VAL  18  -0.304  14.195   7.730
  160   HG22  VAL  18          1HG2      VAL  18   0.665  12.827   7.184
  161   HG23  VAL  18          2HG2      VAL  18   0.921  14.424   6.482
  162    H    ASP  19           H        ASP  19   3.200  13.501  10.696
  163    HA   ASP  19           HA       ASP  19   4.097  10.849  11.142
  164    HB2  ASP  19           2HB      ASP  19   3.135  13.062  12.932
  165    HB3  ASP  19           1HB      ASP  19   3.456  11.457  13.581
  166    H    ALA  20           H        ALA  20   2.991   9.080  12.007
  167    HA   ALA  20           HA       ALA  20   0.335   8.736  11.131
  168    HB1  ALA  20           1HB      ALA  20   1.106   6.838  13.170
  169    HB2  ALA  20           2HB      ALA  20   2.387   7.077  11.982
  170    HB3  ALA  20           3HB      ALA  20   0.779   6.581  11.456
  171    H    SER  21           H        SER  21   1.615  10.117  13.965
  172    HA   SER  21           HA       SER  21  -0.439   9.486  15.795
  173    HB2  SER  21           2HB      SER  21   1.731  11.534  15.666
  174    HB3  SER  21           1HB      SER  21   0.439  11.753  16.846
  175    HG   SER  21           HG       SER  21   1.531   9.215  16.720
  176    H    LYS  22           H        LYS  22  -0.281  11.644  13.147
  177    HA   LYS  22           HA       LYS  22  -2.444  13.319  14.086
  178    HB2  LYS  22           2HB      LYS  22  -2.170  14.487  11.925
  179    HB3  LYS  22           1HB      LYS  22  -0.666  14.386  12.832
  180    HG2  LYS  22           2HG      LYS  22   0.322  13.449  11.092
  181    HG3  LYS  22           1HG      LYS  22  -0.822  12.107  11.158
  182    HD2  LYS  22           2HD      LYS  22  -0.918  13.079   8.967
  183    HD3  LYS  22           1HD      LYS  22  -2.411  13.476   9.820
  184    HE2  LYS  22           2HE      LYS  22  -1.137  15.645  10.484
  185    HE3  LYS  22           1HE      LYS  22  -0.102  15.242   9.115
  186    HZ1  LYS  22           3HZ      LYS  22  -2.256  16.715   8.852
  187    HZ2  LYS  22           1HZ      LYS  22  -2.990  15.200   8.676
  188    HZ3  LYS  22           2HZ      LYS  22  -1.743  15.665   7.630
  189    H    VAL  23           H        VAL  23  -2.057  10.420  12.367
  190    HA   VAL  23           HA       VAL  23  -4.271  10.569  10.615
  191    HB   VAL  23           HB       VAL  23  -3.968   8.293  10.190
  192   HG11  VAL  23          1HG1      VAL  23  -1.325   8.041  10.593
  193   HG12  VAL  23          2HG1      VAL  23  -1.502   9.778  10.836
  194   HG13  VAL  23          3HG1      VAL  23  -2.022   9.043   9.320
  195   HG21  VAL  23          3HG2      VAL  23  -4.275   7.255  12.260
  196   HG22  VAL  23          1HG2      VAL  23  -2.939   8.135  13.003
  197   HG23  VAL  23          2HG2      VAL  23  -2.611   6.858  11.832
  198    H    THR  24           H        THR  24  -6.363  10.478  11.019
  199    HA   THR  24           HA       THR  24  -7.257   9.453  13.593
  200    HB   THR  24           HB       THR  24  -9.031  11.222  12.061
  201    HG1  THR  24           1HG      THR  24  -6.934  12.196  11.867
  202   HG21  THR  24          3HG2      THR  24  -8.637  12.147  14.676
  203   HG22  THR  24          1HG2      THR  24  -8.735  10.389  14.766
  204   HG23  THR  24          2HG2      THR  24 -10.042  11.308  14.019
  205    HA   PRO  25           HA       PRO  25  -9.711   6.291  11.788
  206    HB2  PRO  25           2HB      PRO  25 -12.068   7.389  13.231
  207    HB3  PRO  25           1HB      PRO  25 -11.379   5.763  13.275
  208    HG2  PRO  25           2HG      PRO  25 -11.038   7.445  15.315
  209    HG3  PRO  25           1HG      PRO  25  -9.736   6.355  14.800
  210    HD2  PRO  25           2HD      PRO  25 -10.062   9.286  14.316
  211    HD3  PRO  25           1HD      PRO  25  -8.588   8.353  14.647
  212    H    GLU  26           H        GLU  26 -11.155   9.517  11.844
  213    HA   GLU  26           HA       GLU  26 -12.612   8.897   9.390
  214    HB2  GLU  26           2HB      GLU  26 -13.372  10.266  11.710
  215    HB3  GLU  26           1HB      GLU  26 -13.172  11.513  10.486
  216    HG2  GLU  26           2HG      GLU  26 -15.192   9.394  10.719
  217    HG3  GLU  26           1HG      GLU  26 -15.312  11.013  10.033
  218    H    SER  27           H        SER  27  -9.708  10.037  10.221
  219    HA   SER  27           HA       SER  27  -9.405  12.467   8.870
  220    HB2  SER  27           2HB      SER  27  -7.634  11.847  10.293
  221    HB3  SER  27           1HB      SER  27  -7.483  10.253   9.554
  222    HG   SER  27           HG       SER  27  -7.118  12.320   7.794
  223    H    HIS  28           H        HIS  28  -9.210  13.013   6.789
  224    HA   HIS  28           HA       HIS  28  -9.693  11.032   4.781
  225    HB2  HIS  28           2HB      HIS  28  -9.304  14.019   4.662
  226    HB3  HIS  28           1HB      HIS  28  -9.566  13.033   3.227
  227    HD1  HIS  28           1HD      HIS  28 -11.896  11.520   3.423
  228    HD2  HIS  28           2HD      HIS  28 -11.600  14.976   5.711
  229    HE1  HIS  28           1HE      HIS  28 -14.258  12.118   4.045
  230    HE2  HIS  28           2HE      HIS  28 -14.060  14.262   5.355
  231    H    PHE  29           H        PHE  29  -8.343  10.534   3.013
  232    HA   PHE  29           HA       PHE  29  -5.597  10.317   3.642
  233    HB2  PHE  29           2HB      PHE  29  -7.042   8.805   2.131
  234    HB3  PHE  29           1HB      PHE  29  -6.712   9.987   0.869
  235    HD1  PHE  29           2HD      PHE  29  -3.865  10.307   2.561
  236    HD2  PHE  29           1HD      PHE  29  -5.924   7.297   0.366
  237    HE1  PHE  29           2HE      PHE  29  -1.724   9.196   2.082
  238    HE2  PHE  29           1HE      PHE  29  -3.786   6.180  -0.116
  239    HZ   PHE  29           HZ       PHE  29  -1.682   7.130   0.742
  240    H    VAL  30           H        VAL  30  -5.119  10.903   0.588
  241    HA   VAL  30           HA       VAL  30  -3.495  13.017   0.681
  242    HB   VAL  30           HB       VAL  30  -4.856  13.559  -1.686
  243   HG11  VAL  30          1HG1      VAL  30  -2.706  13.347  -2.221
  244   HG12  VAL  30          2HG1      VAL  30  -2.979  11.606  -2.304
  245   HG13  VAL  30          3HG1      VAL  30  -2.386  12.335  -0.811
  246   HG21  VAL  30          3HG2      VAL  30  -4.736  10.589  -1.553
  247   HG22  VAL  30          1HG2      VAL  30  -5.719  11.637  -2.577
  248   HG23  VAL  30          2HG2      VAL  30  -6.149  11.404  -0.882
  249    H    LYS  31           H        LYS  31  -6.953  13.177   0.776
  250    HA   LYS  31           HA       LYS  31  -7.263  15.940   0.319
  251    HB2  LYS  31           2HB      LYS  31  -9.089  14.264   2.031
  252    HB3  LYS  31           1HB      LYS  31  -9.502  15.676   1.067
  253    HG2  LYS  31           2HG      LYS  31  -9.251  14.463  -0.963
  254    HG3  LYS  31           1HG      LYS  31  -8.543  13.084  -0.119
  255    HD2  LYS  31           2HD      LYS  31 -10.863  12.633  -0.691
  256    HD3  LYS  31           1HD      LYS  31 -10.667  12.730   1.060
  257    HE2  LYS  31           2HE      LYS  31 -11.611  14.915   1.122
  258    HE3  LYS  31           1HE      LYS  31 -11.572  15.047  -0.636
  259    HZ1  LYS  31           3HZ      LYS  31 -13.047  12.762   0.139
  260    HZ2  LYS  31           1HZ      LYS  31 -13.556  14.104  -0.758
  261    HZ3  LYS  31           2HZ      LYS  31 -13.656  14.127   0.930
  262    H    ASP  32           H        ASP  32  -6.902  14.054   3.296
  263    HA   ASP  32           HA       ASP  32  -6.968  16.430   4.919
  264    HB2  ASP  32           2HB      ASP  32  -7.740  13.888   5.421
  265    HB3  ASP  32           1HB      ASP  32  -6.132  13.872   6.137
  266    H    LEU  33           H        LEU  33  -4.738  15.457   2.929
  267    HA   LEU  33           HA       LEU  33  -2.579  16.472   2.937
  268    HB2  LEU  33           2HB      LEU  33  -2.510  15.726   5.862
  269    HB3  LEU  33           1HB      LEU  33  -1.280  16.618   4.985
  270    HG   LEU  33           HG       LEU  33  -4.041  17.740   5.071
  271   HD11  LEU  33          1HD1      LEU  33  -2.069  17.919   7.345
  272   HD12  LEU  33          2HD1      LEU  33  -3.629  17.098   7.383
  273   HD13  LEU  33          3HD1      LEU  33  -3.560  18.849   7.195
  274   HD21  LEU  33          3HD2      LEU  33  -1.423  18.572   4.282
  275   HD22  LEU  33          1HD2      LEU  33  -2.015  19.634   5.560
  276   HD23  LEU  33          2HD2      LEU  33  -2.962  19.412   4.090
  277    H    GLY  34           H        GLY  34  -3.529  13.907   2.233
  278    HA2  GLY  34           2HA      GLY  34  -1.742  11.915   3.303
  279    HA3  GLY  34           1HA      GLY  34  -2.867  11.702   1.970
  280    H    LEU  35           H        LEU  35  -0.700  10.458   1.462
  281    HA   LEU  35           HA       LEU  35   1.497  11.930   0.479
  282    HB2  LEU  35           2HB      LEU  35   1.670   9.635  -0.920
  283    HB3  LEU  35           1HB      LEU  35   2.196   9.807   0.743
  284    HG   LEU  35           HG       LEU  35  -0.634   9.073   0.447
  285   HD11  LEU  35          1HD1      LEU  35  -0.450   7.280  -0.841
  286   HD12  LEU  35          2HD1      LEU  35   0.893   6.672   0.126
  287   HD13  LEU  35          3HD1      LEU  35   1.202   7.764  -1.224
  288   HD21  LEU  35          3HD2      LEU  35  -0.259   8.378   2.521
  289   HD22  LEU  35          1HD2      LEU  35   1.405   8.945   2.373
  290   HD23  LEU  35          2HD2      LEU  35   1.001   7.277   1.967
  291    H    ASN  36           H        ASN  36   2.123  12.392  -1.658
  292    HA   ASN  36           HA       ASN  36   0.041  13.305  -3.336
  293    HB2  ASN  36           2HB      ASN  36   2.424  14.220  -3.138
  294    HB3  ASN  36           1HB      ASN  36   2.897  12.902  -4.205
  295   HD21  ASN  36          1HD2      ASN  36   2.676  13.160  -6.327
  296   HD22  ASN  36          2HD2      ASN  36   1.873  14.483  -7.093
  297    H    SER  37           H        SER  37   0.443  12.739  -5.862
  298    HA   SER  37           HA       SER  37  -0.623  10.157  -6.199
  299    HB2  SER  37           2HB      SER  37   0.547  12.098  -8.196
  300    HB3  SER  37           1HB      SER  37  -0.260  10.597  -8.651
  301    H    LEU  38           H        LEU  38   2.620  11.415  -6.423
  302    HA   LEU  38           HA       LEU  38   3.725   9.039  -7.589
  303    HB2  LEU  38           2HB      LEU  38   5.730  10.143  -7.650
  304    HB3  LEU  38           1HB      LEU  38   4.616  11.496  -7.639
  305    HG   LEU  38           HG       LEU  38   6.489  11.917  -6.150
  306   HD11  LEU  38          1HD1      LEU  38   4.818  13.094  -5.215
  307   HD12  LEU  38          2HD1      LEU  38   4.965  11.896  -3.928
  308   HD13  LEU  38          3HD1      LEU  38   3.725  11.711  -5.168
  309   HD21  LEU  38          3HD2      LEU  38   6.302   9.209  -5.562
  310   HD22  LEU  38          1HD2      LEU  38   5.813  10.023  -4.075
  311   HD23  LEU  38          2HD2      LEU  38   7.377  10.385  -4.806
  312    H    ASP  39           H        ASP  39   3.229  10.264  -4.378
  313    HA   ASP  39           HA       ASP  39   4.930   8.356  -3.089
  314    HB2  ASP  39           2HB      ASP  39   4.568  10.417  -1.938
  315    HB3  ASP  39           1HB      ASP  39   2.819  10.243  -2.051
  316    H    VAL  40           H        VAL  40   1.493   8.652  -3.712
  317    HA   VAL  40           HA       VAL  40   0.669   6.389  -2.247
  318    HB   VAL  40           HB       VAL  40  -0.643   8.377  -3.621
  319   HG11  VAL  40          1HG1      VAL  40  -0.249   6.814  -5.656
  320   HG12  VAL  40          2HG1      VAL  40  -1.841   7.531  -5.411
  321   HG13  VAL  40          3HG1      VAL  40  -1.548   5.855  -4.948
  322   HG21  VAL  40          3HG2      VAL  40  -1.872   7.673  -1.875
  323   HG22  VAL  40          1HG2      VAL  40  -1.352   5.997  -2.055
  324   HG23  VAL  40          2HG2      VAL  40  -2.650   6.633  -3.068
  325    H    VAL  41           H        VAL  41   1.654   6.844  -5.607
  326    HA   VAL  41           HA       VAL  41   0.993   4.303  -6.576
  327    HB   VAL  41           HB       VAL  41   2.738   4.711  -8.310
  328   HG11  VAL  41          1HG1      VAL  41   1.582   7.245  -8.610
  329   HG12  VAL  41          2HG1      VAL  41   0.396   6.272  -7.741
  330   HG13  VAL  41          3HG1      VAL  41   1.021   5.718  -9.294
  331   HG21  VAL  41          3HG2      VAL  41   3.258   7.183  -6.664
  332   HG22  VAL  41          1HG2      VAL  41   3.851   6.930  -8.306
  333   HG23  VAL  41          2HG2      VAL  41   4.388   5.873  -7.000
  334    H    GLU  42           H        GLU  42   4.109   5.509  -5.325
  335    HA   GLU  42           HA       GLU  42   5.502   3.095  -5.513
  336    HB2  GLU  42           2HB      GLU  42   7.207   4.222  -4.551
  337    HB3  GLU  42           1HB      GLU  42   6.164   5.620  -4.779
  338    HG2  GLU  42           2HG      GLU  42   6.918   5.749  -2.567
  339    HG3  GLU  42           1HG      GLU  42   5.261   5.156  -2.465
  340    H    VAL  43           H        VAL  43   3.692   4.480  -2.829
  341    HA   VAL  43           HA       VAL  43   4.151   2.480  -0.943
  342    HB   VAL  43           HB       VAL  43   3.122   4.243   0.074
  343   HG11  VAL  43          1HG1      VAL  43   2.132   5.851  -1.080
  344   HG12  VAL  43          2HG1      VAL  43   0.783   4.788  -1.476
  345   HG13  VAL  43          3HG1      VAL  43   2.210   4.822  -2.509
  346   HG21  VAL  43          3HG2      VAL  43   1.810   2.044   0.371
  347   HG22  VAL  43          1HG2      VAL  43   0.577   2.862  -0.581
  348   HG23  VAL  43          2HG2      VAL  43   1.101   3.553   0.950
  349    H    VAL  44           H        VAL  44   1.656   2.765  -3.404
  350    HA   VAL  44           HA       VAL  44   0.101   0.560  -2.688
  351    HB   VAL  44           HB       VAL  44  -0.858   0.626  -4.848
  352   HG11  VAL  44          1HG1      VAL  44  -0.360   3.406  -5.096
  353   HG12  VAL  44          2HG1      VAL  44  -0.398   2.999  -3.381
  354   HG13  VAL  44          3HG1      VAL  44  -1.768   2.594  -4.416
  355   HG21  VAL  44          3HG2      VAL  44   0.833   2.429  -6.282
  356   HG22  VAL  44          1HG2      VAL  44   0.347   0.788  -6.705
  357   HG23  VAL  44          2HG2      VAL  44   1.784   1.055  -5.721
  358    H    PHE  45           H        PHE  45   3.080   0.780  -4.523
  359    HA   PHE  45           HA       PHE  45   3.050  -1.928  -5.416
  360    HB2  PHE  45           2HB      PHE  45   5.385  -0.018  -5.193
  361    HB3  PHE  45           1HB      PHE  45   5.355  -1.513  -6.120
  362    HD1  PHE  45           2HD      PHE  45   2.781  -1.395  -7.466
  363    HD2  PHE  45           1HD      PHE  45   5.606   1.699  -6.716
  364    HE1  PHE  45           2HE      PHE  45   1.944  -0.162  -9.424
  365    HE2  PHE  45           1HE      PHE  45   4.773   2.937  -8.673
  366    HZ   PHE  45           HZ       PHE  45   2.941   2.007 -10.029
  367    H    ALA  46           H        ALA  46   3.966  -0.299  -2.538
  368    HA   ALA  46           HA       ALA  46   5.802  -2.204  -1.530
  369    HB1  ALA  46           1HB      ALA  46   4.899  -1.045   0.711
  370    HB2  ALA  46           2HB      ALA  46   4.377   0.151  -0.476
  371    HB3  ALA  46           3HB      ALA  46   6.082  -0.291  -0.360
  372    H    ILE  47           H        ILE  47   2.701  -1.433  -0.057
  373    HA   ILE  47           HA       ILE  47   2.337  -3.759   1.350
  374    HB   ILE  47           HB       ILE  47  -0.052  -3.282   1.391
  375   HG12  ILE  47          2HG1      ILE  47  -0.141  -2.678  -1.081
  376   HG13  ILE  47          1HG1      ILE  47  -1.106  -1.676  -0.002
  377   HG21  ILE  47          1HG2      ILE  47   1.719  -0.853   1.551
  378   HG22  ILE  47          2HG2      ILE  47   1.304  -1.967   2.853
  379   HG23  ILE  47          3HG2      ILE  47   0.067  -0.914   2.166
  380   HD11  ILE  47          3HD1      ILE  47   1.131  -0.965  -1.720
  381   HD12  ILE  47          1HD1      ILE  47   1.275  -0.334  -0.079
  382   HD13  ILE  47          2HD1      ILE  47  -0.151   0.040  -1.045
  383    H    GLU  48           H        GLU  48   1.293  -3.075  -1.977
  384    HA   GLU  48           HA       GLU  48  -0.052  -5.452  -2.485
  385    HB2  GLU  48           2HB      GLU  48  -0.293  -3.811  -4.131
  386    HB3  GLU  48           1HB      GLU  48   1.438  -3.521  -4.228
  387    HG2  GLU  48           2HG      GLU  48   0.097  -6.046  -5.162
  388    HG3  GLU  48           1HG      GLU  48   0.469  -4.673  -6.204
  389    H    GLN  49           H        GLN  49   3.356  -4.685  -2.621
  390    HA   GLN  49           HA       GLN  49   4.334  -6.978  -3.851
  391    HB2  GLN  49           2HB      GLN  49   5.505  -5.126  -1.790
  392    HB3  GLN  49           1HB      GLN  49   6.405  -6.519  -2.374
  393    HG2  GLN  49           2HG      GLN  49   5.257  -4.812  -4.467
  394    HG3  GLN  49           1HG      GLN  49   6.502  -4.055  -3.475
  395   HE21  GLN  49          1HE2      GLN  49   6.274  -5.209  -6.322
  396   HE22  GLN  49          2HE2      GLN  49   7.722  -6.138  -6.486
  397    H    GLU  50           H        GLU  50   3.735  -6.362  -0.398
  398    HA   GLU  50           HA       GLU  50   4.044  -9.217   0.084
  399    HB2  GLU  50           2HB      GLU  50   4.756  -8.774   2.228
  400    HB3  GLU  50           1HB      GLU  50   5.363  -7.359   1.380
  401    HG2  GLU  50           2HG      GLU  50   4.306  -6.113   2.867
  402    HG3  GLU  50           1HG      GLU  50   2.787  -6.667   2.165
  403    H    PHE  51           H        PHE  51   1.674  -8.129  -1.088
  404    HA   PHE  51           HA       PHE  51  -0.242  -9.052   0.873
  405    HB2  PHE  51           2HB      PHE  51  -0.290  -6.369  -0.454
  406    HB3  PHE  51           1HB      PHE  51  -1.800  -7.156  -0.008
  407    HD1  PHE  51           2HD      PHE  51  -0.013  -8.447   2.435
  408    HD2  PHE  51           1HD      PHE  51  -1.154  -4.570   1.105
  409    HE1  PHE  51           2HE      PHE  51   0.231  -7.594   4.728
  410    HE2  PHE  51           1HE      PHE  51  -0.912  -3.709   3.397
  411    HZ   PHE  51           HZ       PHE  51  -0.219  -5.222   5.212
  412    H    ILE  52           H        ILE  52   1.009  -9.394  -2.101
  413    HA   ILE  52           HA       ILE  52   0.343 -10.300  -4.075
  414    HB   ILE  52           HB       ILE  52  -1.460 -12.065  -3.875
  415   HG12  ILE  52          2HG1      ILE  52  -1.889 -12.752  -1.462
  416   HG13  ILE  52          1HG1      ILE  52  -1.349 -11.140  -1.033
  417   HG21  ILE  52          1HG2      ILE  52  -0.017 -13.616  -2.732
  418   HG22  ILE  52          2HG2      ILE  52   0.842 -12.287  -1.954
  419   HG23  ILE  52          3HG2      ILE  52   0.958 -12.510  -3.700
  420   HD11  ILE  52          3HD1      ILE  52  -3.719 -11.863  -2.724
  421   HD12  ILE  52          1HD1      ILE  52  -3.135 -10.216  -2.487
  422   HD13  ILE  52          2HD1      ILE  52  -3.731 -11.146  -1.113
  423    H    LEU  53           H        LEU  53  -0.644  -7.765  -3.810
  424    HA   LEU  53           HA       LEU  53  -2.722  -7.730  -5.694
  425    HB2  LEU  53           2HB      LEU  53  -3.803  -8.367  -3.343
  426    HB3  LEU  53           1HB      LEU  53  -3.772  -6.626  -3.141
  427    HG   LEU  53           HG       LEU  53  -5.193  -6.296  -5.037
  428   HD11  LEU  53          1HD1      LEU  53  -6.004  -8.149  -6.408
  429   HD12  LEU  53          2HD1      LEU  53  -4.971  -9.264  -5.513
  430   HD13  LEU  53          3HD1      LEU  53  -4.250  -7.995  -6.503
  431   HD21  LEU  53          3HD2      LEU  53  -7.011  -8.192  -4.316
  432   HD22  LEU  53          1HD2      LEU  53  -6.753  -6.666  -3.471
  433   HD23  LEU  53          2HD2      LEU  53  -5.968  -8.135  -2.896
  434    H    ASP  54           H        ASP  54  -2.761  -5.789  -6.683
  435    HA   ASP  54           HA       ASP  54  -0.960  -3.766  -5.747
  436    HB2  ASP  54           2HB      ASP  54  -2.683  -3.210  -8.087
  437    HB3  ASP  54           1HB      ASP  54  -0.949  -2.984  -7.887
  438    H    ILE  55           H        ILE  55  -1.462  -1.696  -5.093
  439    HA   ILE  55           HA       ILE  55  -4.233  -1.291  -4.280
  440    HB   ILE  55           HB       ILE  55  -1.636  -0.218  -3.251
  441   HG12  ILE  55          2HG1      ILE  55  -3.936  -1.820  -2.200
  442   HG13  ILE  55          1HG1      ILE  55  -2.208  -2.124  -2.060
  443   HG21  ILE  55          1HG2      ILE  55  -4.283   1.103  -3.197
  444   HG22  ILE  55          2HG2      ILE  55  -2.664   1.800  -3.157
  445   HG23  ILE  55          3HG2      ILE  55  -3.359   1.102  -1.695
  446   HD11  ILE  55          3HD1      ILE  55  -3.926  -0.268  -0.468
  447   HD12  ILE  55          1HD1      ILE  55  -2.179  -0.048  -0.552
  448   HD13  ILE  55          2HD1      ILE  55  -2.849  -1.548   0.089
  449    HA   PRO  56           HA       PRO  56  -2.851   2.526  -6.933
  450    HB2  PRO  56           2HB      PRO  56  -1.699   1.809  -9.259
  451    HB3  PRO  56           1HB      PRO  56  -0.756   2.073  -7.786
  452    HG2  PRO  56           2HG      PRO  56  -1.672  -0.495  -9.016
  453    HG3  PRO  56           1HG      PRO  56  -0.102  -0.097  -8.294
  454    HD2  PRO  56           2HD      PRO  56  -2.059  -1.488  -6.990
  455    HD3  PRO  56           1HD      PRO  56  -0.844  -0.493  -6.162
  456    H    ASP  57           H        ASP  57  -3.211   2.686  -9.681
  457    HA   ASP  57           HA       ASP  57  -4.799   2.658 -11.309
  458    HB2  ASP  57           2HB      ASP  57  -4.669  -0.011 -10.371
  459    HB3  ASP  57           1HB      ASP  57  -6.376   0.376 -10.566
  460    H    HIS  58           H        HIS  58  -7.495   1.699 -11.142
  461    HA   HIS  58           HA       HIS  58  -8.750   3.935 -10.008
  462    HB2  HIS  58           2HB      HIS  58 -10.348   1.454 -10.318
  463    HB3  HIS  58           1HB      HIS  58 -10.687   3.088 -10.876
  464    HD1  HIS  58           1HD      HIS  58 -10.909   0.439 -12.619
  465    HD2  HIS  58           2HD      HIS  58  -7.788   3.182 -12.694
  466    HE1  HIS  58           1HE      HIS  58  -9.824   0.161 -14.871
  467    HE2  HIS  58           2HE      HIS  58  -7.884   1.769 -14.858
  468    H    ASP  59           H        ASP  59  -7.800   0.906  -8.644
  469    HA   ASP  59           HA       ASP  59  -9.568   0.786  -6.462
  470    HB2  ASP  59           2HB      ASP  59  -6.926  -0.417  -7.125
  471    HB3  ASP  59           1HB      ASP  59  -7.442  -0.464  -5.442
  472    H    ALA  60           H        ALA  60  -6.352   2.250  -6.791
  473    HA   ALA  60           HA       ALA  60  -6.357   3.227  -4.096
  474    HB1  ALA  60           1HB      ALA  60  -4.464   3.089  -6.296
  475    HB2  ALA  60           2HB      ALA  60  -4.179   3.075  -4.556
  476    HB3  ALA  60           3HB      ALA  60  -4.372   4.609  -5.405
  477    H    GLU  61           H        GLU  61  -7.356   4.380  -7.184
  478    HA   GLU  61           HA       GLU  61  -7.366   7.156  -6.510
  479    HB2  GLU  61           2HB      GLU  61  -8.929   5.831  -8.721
  480    HB3  GLU  61           1HB      GLU  61  -8.413   7.509  -8.629
  481    HG2  GLU  61           2HG      GLU  61  -6.063   6.043  -8.442
  482    HG3  GLU  61           1HG      GLU  61  -7.022   5.203  -9.659
  483    H    LYS  62           H        LYS  62  -9.665   4.523  -6.366
  484    HA   LYS  62           HA       LYS  62 -11.950   6.151  -5.875
  485    HB2  LYS  62           2HB      LYS  62 -11.333   3.264  -5.913
  486    HB3  LYS  62           1HB      LYS  62 -12.663   3.741  -4.867
  487    HG2  LYS  62           2HG      LYS  62 -12.444   3.828  -7.821
  488    HG3  LYS  62           1HG      LYS  62 -13.801   3.357  -6.796
  489    HD2  LYS  62           2HD      LYS  62 -14.059   5.766  -6.172
  490    HD3  LYS  62           1HD      LYS  62 -12.834   6.152  -7.384
  491    HE2  LYS  62           2HE      LYS  62 -14.291   4.987  -9.070
  492    HE3  LYS  62           1HE      LYS  62 -15.542   4.909  -7.829
  493    HZ1  LYS  62           3HZ      LYS  62 -15.802   6.822  -9.315
  494    HZ2  LYS  62           1HZ      LYS  62 -14.296   7.415  -8.824
  495    HZ3  LYS  62           2HZ      LYS  62 -15.564   7.300  -7.710
  496    H    ILE  63           H        ILE  63  -9.366   6.101  -4.088
  497    HA   ILE  63           HA       ILE  63 -10.728   5.807  -1.519
  498    HB   ILE  63           HB       ILE  63  -8.187   4.952  -2.370
  499   HG12  ILE  63          2HG1      ILE  63  -8.558   4.940   0.516
  500   HG13  ILE  63          1HG1      ILE  63 -10.020   4.450  -0.333
  501   HG21  ILE  63          1HG2      ILE  63  -7.958   7.066  -0.234
  502   HG22  ILE  63          2HG2      ILE  63  -7.392   7.234  -1.896
  503   HG23  ILE  63          3HG2      ILE  63  -6.663   6.031  -0.833
  504   HD11  ILE  63          3HD1      ILE  63  -7.337   3.152  -0.286
  505   HD12  ILE  63          1HD1      ILE  63  -8.428   2.886  -1.645
  506   HD13  ILE  63          2HD1      ILE  63  -8.932   2.451  -0.012
  507    H    GLN  64           H        GLN  64 -11.315   7.598  -0.489
  508    HA   GLN  64           HA       GLN  64  -9.897  10.073  -1.078
  509    HB2  GLN  64           2HB      GLN  64 -12.124  11.162  -0.358
  510    HB3  GLN  64           1HB      GLN  64 -12.014  10.444  -1.957
  511    HG2  GLN  64           2HG      GLN  64 -14.067   9.999  -0.383
  512    HG3  GLN  64           1HG      GLN  64 -13.438   8.752  -1.460
  513   HE21  GLN  64          1HE2      GLN  64 -13.258   6.852  -0.556
  514   HE22  GLN  64          2HE2      GLN  64 -12.919   6.535   1.106
  515    H    SER  65           H        SER  65 -10.750   7.836   1.301
  516    HA   SER  65           HA       SER  65  -9.819   9.681   3.392
  517    HB2  SER  65           2HB      SER  65 -11.423   8.794   4.969
  518    HB3  SER  65           1HB      SER  65 -12.293   9.348   3.540
  519    HG   SER  65           HG       SER  65 -13.105   7.363   3.948
  520    H    ILE  66           H        ILE  66  -8.862   8.612   5.257
  521    HA   ILE  66           HA       ILE  66  -7.003   6.636   4.519
  522    HB   ILE  66           HB       ILE  66  -7.765   7.225   7.368
  523   HG12  ILE  66          2HG1      ILE  66  -7.307   9.249   5.664
  524   HG13  ILE  66          1HG1      ILE  66  -6.775   9.280   7.342
  525   HG21  ILE  66          1HG2      ILE  66  -6.052   5.430   6.585
  526   HG22  ILE  66          2HG2      ILE  66  -5.649   6.499   7.928
  527   HG23  ILE  66          3HG2      ILE  66  -4.998   6.819   6.320
  528   HD11  ILE  66          3HD1      ILE  66  -5.075   8.417   5.015
  529   HD12  ILE  66          1HD1      ILE  66  -4.560   8.596   6.691
  530   HD13  ILE  66          2HD1      ILE  66  -5.043  10.015   5.762
  531    HA   PRO  67           HA       PRO  67 -10.120   3.887   7.296
  532    HB2  PRO  67           2HB      PRO  67 -12.481   4.878   5.765
  533    HB3  PRO  67           1HB      PRO  67 -12.370   4.358   7.450
  534    HG2  PRO  67           2HG      PRO  67 -12.514   6.945   6.834
  535    HG3  PRO  67           1HG      PRO  67 -11.473   6.378   8.152
  536    HD2  PRO  67           2HD      PRO  67 -10.736   7.282   5.409
  537    HD3  PRO  67           1HD      PRO  67  -9.855   7.475   6.938
  538    H    ASP  68           H        ASP  68 -11.708   4.557   4.183
  539    HA   ASP  68           HA       ASP  68 -11.887   1.921   3.356
  540    HB2  ASP  68           2HB      ASP  68 -12.706   4.323   2.342
  541    HB3  ASP  68           1HB      ASP  68 -11.472   3.856   1.176
  542    H    ALA  69           H        ALA  69  -9.146   3.947   3.480
  543    HA   ALA  69           HA       ALA  69  -7.598   2.826   1.409
  544    HB1  ALA  69           1HB      ALA  69  -5.717   3.913   2.431
  545    HB2  ALA  69           2HB      ALA  69  -6.597   4.091   3.949
  546    HB3  ALA  69           3HB      ALA  69  -7.113   4.987   2.521
  547    H    VAL  70           H        VAL  70  -6.513   2.553   4.717
  548    HA   VAL  70           HA       VAL  70  -5.307   0.041   4.304
  549    HB   VAL  70           HB       VAL  70  -4.518   1.626   6.010
  550   HG11  VAL  70          1HG1      VAL  70  -6.181   2.637   7.145
  551   HG12  VAL  70          2HG1      VAL  70  -5.988   1.273   8.246
  552   HG13  VAL  70          3HG1      VAL  70  -7.256   1.244   7.020
  553   HG21  VAL  70          3HG2      VAL  70  -3.937   0.017   7.660
  554   HG22  VAL  70          1HG2      VAL  70  -4.071  -0.847   6.129
  555   HG23  VAL  70          2HG2      VAL  70  -5.371  -0.949   7.316
  556    H    GLU  71           H        GLU  71  -8.523   0.900   4.989
  557    HA   GLU  71           HA       GLU  71  -9.305  -1.378   6.482
  558    HB2  GLU  71           2HB      GLU  71 -10.841   0.636   4.854
  559    HB3  GLU  71           1HB      GLU  71 -11.632  -0.703   5.673
  560    HG2  GLU  71           2HG      GLU  71  -9.905   1.325   7.066
  561    HG3  GLU  71           1HG      GLU  71 -11.657   1.455   6.918
  562    H    TYR  72           H        TYR  72  -9.730  -0.537   3.044
  563    HA   TYR  72           HA       TYR  72 -10.854  -3.007   2.301
  564    HB2  TYR  72           2HB      TYR  72 -11.143  -1.968   0.340
  565    HB3  TYR  72           1HB      TYR  72 -10.341  -0.569   1.048
  566    HD1  TYR  72           1HD      TYR  72  -7.765  -0.491   0.866
  567    HD2  TYR  72           2HD      TYR  72 -10.211  -3.034  -1.511
  568    HE1  TYR  72           1HE      TYR  72  -5.940  -0.707  -0.769
  569    HE2  TYR  72           2HE      TYR  72  -8.393  -3.256  -3.153
  570    HH   TYR  72           HH       TYR  72  -5.645  -2.990  -2.905
  571    H    ILE  73           H        ILE  73  -7.568  -1.765   2.009
  572    HA   ILE  73           HA       ILE  73  -6.464  -4.068   0.833
  573    HB   ILE  73           HB       ILE  73  -4.821  -2.591   0.566
  574   HG12  ILE  73          2HG1      ILE  73  -3.989  -4.107   2.505
  575   HG13  ILE  73          1HG1      ILE  73  -3.079  -2.652   2.113
  576   HG21  ILE  73          1HG2      ILE  73  -6.169  -1.109   2.793
  577   HG22  ILE  73          2HG2      ILE  73  -6.064  -0.692   1.083
  578   HG23  ILE  73          3HG2      ILE  73  -4.641  -0.549   2.115
  579   HD11  ILE  73          3HD1      ILE  73  -4.254  -3.412   4.582
  580   HD12  ILE  73          1HD1      ILE  73  -5.024  -1.928   4.021
  581   HD13  ILE  73          2HD1      ILE  73  -3.271  -1.995   4.210
  582    H    ALA  74           H        ALA  74  -6.639  -2.994   4.177
  583    HA   ALA  74           HA       ALA  74  -5.149  -4.992   5.388
  584    HB1  ALA  74           1HB      ALA  74  -7.500  -3.410   6.384
  585    HB2  ALA  74           2HB      ALA  74  -5.787  -3.141   6.706
  586    HB3  ALA  74           3HB      ALA  74  -6.607  -4.537   7.407
  587    H    GLN  75           H        GLN  75  -8.506  -4.991   4.397
  588    HA   GLN  75           HA       GLN  75  -9.053  -7.566   5.516
  589    HB2  GLN  75           2HB      GLN  75 -10.577  -5.589   3.882
  590    HB3  GLN  75           1HB      GLN  75 -11.151  -7.250   3.947
  591    HG2  GLN  75           2HG      GLN  75 -11.879  -5.332   5.683
  592    HG3  GLN  75           1HG      GLN  75 -11.879  -7.056   6.056
  593   HE21  GLN  75          1HE2      GLN  75 -10.653  -4.015   6.863
  594   HE22  GLN  75          2HE2      GLN  75  -9.491  -4.520   8.037
  595    H    ASN  76           H        ASN  76  -7.654  -6.394   2.650
  596    HA   ASN  76           HA       ASN  76  -8.405  -8.375   0.808
  597    HB2  ASN  76           2HB      ASN  76  -6.389  -6.271   0.979
  598    HB3  ASN  76           1HB      ASN  76  -5.815  -7.686   0.102
  599   HD21  ASN  76          1HD2      ASN  76  -7.824  -4.937   0.045
  600   HD22  ASN  76          2HD2      ASN  76  -8.477  -5.159  -1.538
  601    HA   PRO  77           HA       PRO  77  -4.528 -10.851   2.149
  602    HB2  PRO  77           2HB      PRO  77  -3.047 -10.003   4.229
  603    HB3  PRO  77           1HB      PRO  77  -2.809  -9.371   2.595
  604    HG2  PRO  77           2HG      PRO  77  -4.288  -8.161   4.898
  605    HG3  PRO  77           1HG      PRO  77  -3.193  -7.384   3.738
  606    HD2  PRO  77           2HD      PRO  77  -5.922  -7.275   3.560
  607    HD3  PRO  77           1HD      PRO  77  -4.838  -7.149   2.160
  608    H    MET  78           H        MET  78  -6.206  -9.282   4.844
  609    HA   MET  78           HA       MET  78  -6.030 -11.512   6.598
  610    HB2  MET  78           2HB      MET  78  -6.386  -9.201   7.392
  611    HB3  MET  78           1HB      MET  78  -7.973  -9.198   6.636
  612    HG2  MET  78           2HG      MET  78  -8.307  -9.603   8.935
  613    HG3  MET  78           1HG      MET  78  -8.576 -11.133   8.103
  614    HE1  MET  78           3HE      MET  78  -5.175 -12.577   8.139
  615    HE2  MET  78           1HE      MET  78  -6.852 -12.685   7.604
  616    HE3  MET  78           2HE      MET  78  -6.338 -13.524   9.067
  617    H    ALA  79           H        ALA  79  -8.015 -10.759   3.927
  618    HA   ALA  79           HA       ALA  79 -10.134 -12.548   4.725
  619    HB1  ALA  79           1HB      ALA  79  -9.770 -10.665   2.434
  620    HB2  ALA  79           2HB      ALA  79 -11.013 -10.665   3.685
  621    HB3  ALA  79           3HB      ALA  79 -11.043 -11.886   2.413
  622    H    LYS  80           H        LYS  80  -7.379 -12.439   2.637
  623    HA   LYS  80           HA       LYS  80  -7.145 -13.959   0.713
  624    HB2  LYS  80           2HB      LYS  80  -6.069 -15.015   3.329
  625    HB3  LYS  80           1HB      LYS  80  -5.591 -15.634   1.756
  626    HG2  LYS  80           2HG      LYS  80  -5.345 -12.751   1.922
  627    HG3  LYS  80           1HG      LYS  80  -4.386 -13.587   3.144
  628    HD2  LYS  80           2HD      LYS  80  -2.856 -14.027   1.594
  629    HD3  LYS  80           1HD      LYS  80  -4.046 -15.011   0.739
  630    HE2  LYS  80           2HE      LYS  80  -3.013 -12.345   0.121
  631    HE3  LYS  80           1HE      LYS  80  -3.727 -13.558  -0.940
  632    HZ1  LYS  80           3HZ      LYS  80  -5.033 -11.410   0.571
  633    HZ2  LYS  80           1HZ      LYS  80  -5.903 -12.830   0.268
  634    HZ3  LYS  80           2HZ      LYS  80  -5.295 -11.919  -1.020
  635   H282  PNS 101          8H2       PNS 101  -0.106  12.953 -11.507
  636   H281  PNS 101          9H2       PNS 101  -0.366  11.620 -10.378
  637   H303  PNS 101          0H3       PNS 101   1.806  13.181  -8.745
  638   H302  PNS 101          1H3       PNS 101   2.655  13.989 -10.064
  639   H301  PNS 101          2H3       PNS 101   3.333  12.529  -9.341
  640   H313  PNS 101          3H3       PNS 101   1.319  10.486  -9.396
  641   H312  PNS 101          4H3       PNS 101   2.917  10.533 -10.142
  642   H311  PNS 101          5H3       PNS 101   1.502  10.126 -11.113
  643    H32  PNS 101           6H3      PNS 101   1.849  11.573 -12.510
  644    H33  PNS 101           7H3      PNS 101   0.640  13.012 -13.089
  645    H36  PNS 101           8H3      PNS 101   4.625  11.697 -10.668
  646   H372  PNS 101          9H3       PNS 101   4.437  13.875  -9.643
  647   H371  PNS 101          0H4       PNS 101   4.254  14.559 -11.257
  648   H382  PNS 101          1H4       PNS 101   6.451  15.071 -10.652
  649   H381  PNS 101          2H4       PNS 101   6.720  13.480  -9.940
  650    H41  PNS 101           3H4      PNS 101   5.078  14.072 -12.819
  651   H422  PNS 101          4H4       PNS 101   6.859  14.119 -14.863
  652   H421  PNS 101          5H4       PNS 101   6.722  12.405 -14.474
  653   H431  PNS 101          7H4       PNS 101   5.188  13.280 -16.301
  654   H432  PNS 101          6H4       PNS 101   4.414  12.370 -14.996
  655    H44  PNS 101           8H4      PNS 101   2.999  14.497 -15.292
  Start of MODEL    4
    1    H1   MET   1           1HT      MET   1  -2.245  -9.833   9.475
    2    H2   MET   1           2HT      MET   1  -3.318 -11.078   9.971
    3    H3   MET   1           3HT      MET   1  -2.199 -10.412  11.088
    4    HA   MET   1           HA       MET   1  -4.459  -9.018   9.818
    5    HB2  MET   1           2HB      MET   1  -3.959 -10.020  12.628
    6    HB3  MET   1           1HB      MET   1  -5.304  -8.985  12.168
    7    HG2  MET   1           2HG      MET   1  -6.245 -11.092  12.183
    8    HG3  MET   1           1HG      MET   1  -5.873 -10.836  10.479
    9    HE1  MET   1           2HE      MET   1  -2.725 -13.043  12.975
   10    HE2  MET   1           3HE      MET   1  -3.866 -11.894  13.673
   11    HE3  MET   1           1HE      MET   1  -2.667 -11.347  12.501
   12    H    ASN   2           H        ASN   2  -2.813  -8.594  12.908
   13    HA   ASN   2           HA       ASN   2  -2.712  -5.807  12.725
   14    HB2  ASN   2           2HB      ASN   2  -0.986  -7.631  14.406
   15    HB3  ASN   2           1HB      ASN   2  -1.194  -5.900  14.657
   16   HD21  ASN   2          1HD2      ASN   2  -1.880  -8.445  16.195
   17   HD22  ASN   2          2HD2      ASN   2  -3.519  -8.196  16.681
   18    H    ASP   3           H        ASP   3  -0.488  -8.262  11.691
   19    HA   ASP   3           HA       ASP   3   1.838  -6.786  11.391
   20    HB2  ASP   3           2HB      ASP   3   2.665  -8.576  10.217
   21    HB3  ASP   3           1HB      ASP   3   1.280  -9.339  10.991
   22    H    VAL   4           H        VAL   4  -1.010  -6.862   9.380
   23    HA   VAL   4           HA       VAL   4   0.164  -5.633   7.111
   24    HB   VAL   4           HB       VAL   4  -2.413  -6.616   7.830
   25   HG11  VAL   4          1HG1      VAL   4  -2.403  -3.924   6.475
   26   HG12  VAL   4          2HG1      VAL   4  -3.112  -4.310   8.044
   27   HG13  VAL   4          3HG1      VAL   4  -3.794  -5.004   6.573
   28   HG21  VAL   4          3HG2      VAL   4  -0.660  -6.791   5.740
   29   HG22  VAL   4          1HG2      VAL   4  -1.976  -5.838   5.052
   30   HG23  VAL   4          2HG2      VAL   4  -2.306  -7.424   5.747
   31    H    LEU   5           H        LEU   5  -2.064  -4.285   9.562
   32    HA   LEU   5           HA       LEU   5  -1.777  -1.640   8.620
   33    HB2  LEU   5           2HB      LEU   5  -2.952  -0.959  10.661
   34    HB3  LEU   5           1HB      LEU   5  -3.770  -2.244   9.805
   35    HG   LEU   5           HG       LEU   5  -3.805  -2.474  12.277
   36   HD11  LEU   5          1HD1      LEU   5  -3.649  -4.362  10.392
   37   HD12  LEU   5          2HD1      LEU   5  -3.855  -4.713  12.109
   38   HD13  LEU   5          3HD1      LEU   5  -2.253  -4.806  11.373
   39   HD21  LEU   5          3HD2      LEU   5  -1.057  -3.484  12.383
   40   HD22  LEU   5          1HD2      LEU   5  -1.969  -2.543  13.560
   41   HD23  LEU   5          2HD2      LEU   5  -1.193  -1.737  12.199
   42    H    THR   6           H        THR   6  -0.111  -3.499  11.043
   43    HA   THR   6           HA       THR   6   1.193  -1.390  12.351
   44    HB   THR   6           HB       THR   6   1.173  -3.507  13.418
   45    HG1  THR   6           1HG      THR   6   3.372  -2.207  13.069
   46   HG21  THR   6          3HG2      THR   6   2.993  -4.973  11.717
   47   HG22  THR   6          1HG2      THR   6   1.469  -4.602  10.909
   48   HG23  THR   6          2HG2      THR   6   1.465  -5.473  12.444
   49    H    ARG   7           H        ARG   7   2.348  -3.502   9.761
   50    HA   ARG   7           HA       ARG   7   4.763  -2.028   9.412
   51    HB2  ARG   7           2HB      ARG   7   4.786  -4.392   8.953
   52    HB3  ARG   7           1HB      ARG   7   3.477  -4.225   7.791
   53    HG2  ARG   7           2HG      ARG   7   6.237  -3.060   7.487
   54    HG3  ARG   7           1HG      ARG   7   5.649  -4.530   6.708
   55    HD2  ARG   7           2HD      ARG   7   3.747  -2.948   5.848
   56    HD3  ARG   7           1HD      ARG   7   4.924  -1.682   6.191
   57    HE   ARG   7           HE       ARG   7   5.032  -3.632   4.067
   58   HH11  ARG   7          1HH1      ARG   7   6.828  -1.375   6.019
   59   HH12  ARG   7          2HH1      ARG   7   8.106  -1.194   4.865
   60   HH21  ARG   7          1HH2      ARG   7   6.710  -3.401   2.540
   61   HH22  ARG   7          2HH2      ARG   7   8.039  -2.345   2.886
   62    H    VAL   8           H        VAL   8   1.804  -2.475   7.520
   63    HA   VAL   8           HA       VAL   8   2.479  -0.789   5.406
   64    HB   VAL   8           HB       VAL   8   0.385  -2.414   5.879
   65   HG11  VAL   8          1HG1      VAL   8  -0.737  -0.932   7.407
   66   HG12  VAL   8          2HG1      VAL   8  -1.663  -1.013   5.908
   67   HG13  VAL   8          3HG1      VAL   8  -0.653   0.393   6.246
   68   HG21  VAL   8          3HG2      VAL   8  -0.670  -1.030   3.867
   69   HG22  VAL   8          1HG2      VAL   8   0.761  -2.043   3.672
   70   HG23  VAL   8          2HG2      VAL   8   0.936  -0.299   3.879
   71    H    LEU   9           H        LEU   9   0.564  -0.105   8.327
   72    HA   LEU   9           HA       LEU   9   0.016   2.580   7.792
   73    HB2  LEU   9           2HB      LEU   9  -0.671   2.767  10.002
   74    HB3  LEU   9           1HB      LEU   9  -0.878   1.062   9.664
   75    HG   LEU   9           HG       LEU   9   1.425   0.735  10.735
   76   HD11  LEU   9          1HD1      LEU   9   1.131   3.597  10.959
   77   HD12  LEU   9          2HD1      LEU   9   2.542   2.582  11.258
   78   HD13  LEU   9          3HD1      LEU   9   1.360   2.849  12.540
   79   HD21  LEU   9          3HD2      LEU   9   0.405   0.984  13.064
   80   HD22  LEU   9          1HD2      LEU   9  -0.431  -0.062  11.918
   81   HD23  LEU   9          2HD2      LEU   9  -1.040   1.561  12.235
   82    H    GLU  10           H        GLU  10   2.773   1.118   9.477
   83    HA   GLU  10           HA       GLU  10   4.027   3.521  10.209
   84    HB2  GLU  10           2HB      GLU  10   6.017   2.178  10.591
   85    HB3  GLU  10           1HB      GLU  10   4.596   1.341  11.198
   86    HG2  GLU  10           2HG      GLU  10   4.741  -0.318   9.663
   87    HG3  GLU  10           1HG      GLU  10   5.440   0.730   8.430
   88    H    VAL  11           H        VAL  11   4.106   1.640   7.274
   89    HA   VAL  11           HA       VAL  11   6.333   2.828   6.065
   90    HB   VAL  11           HB       VAL  11   4.002   1.881   4.511
   91   HG11  VAL  11          1HG1      VAL  11   6.815   1.251   3.843
   92   HG12  VAL  11          2HG1      VAL  11   6.261   2.911   3.615
   93   HG13  VAL  11          3HG1      VAL  11   5.449   1.587   2.778
   94   HG21  VAL  11          3HG2      VAL  11   5.667  -0.307   4.799
   95   HG22  VAL  11          1HG2      VAL  11   4.087  -0.086   5.552
   96   HG23  VAL  11          2HG2      VAL  11   5.551   0.370   6.424
   97    H    VAL  12           H        VAL  12   2.920   3.635   5.887
   98    HA   VAL  12           HA       VAL  12   3.262   5.807   4.083
   99    HB   VAL  12           HB       VAL  12   1.071   5.404   3.947
  100   HG11  VAL  12          1HG1      VAL  12   1.017   3.367   5.065
  101   HG12  VAL  12          2HG1      VAL  12  -0.192   4.325   5.920
  102   HG13  VAL  12          3HG1      VAL  12   1.411   4.099   6.621
  103   HG21  VAL  12          3HG2      VAL  12  -0.366   6.540   5.702
  104   HG22  VAL  12          1HG2      VAL  12   0.830   7.552   4.893
  105   HG23  VAL  12          2HG2      VAL  12   1.138   6.954   6.523
  106    H    LYS  13           H        LYS  13   2.739   5.649   7.597
  107    HA   LYS  13           HA       LYS  13   2.770   8.396   8.095
  108    HB2  LYS  13           2HB      LYS  13   2.758   7.842  10.320
  109    HB3  LYS  13           1HB      LYS  13   2.244   6.311   9.627
  110    HG2  LYS  13           2HG      LYS  13   4.329   5.319   9.964
  111    HG3  LYS  13           1HG      LYS  13   5.133   6.880  10.189
  112    HD2  LYS  13           2HD      LYS  13   3.192   5.536  12.067
  113    HD3  LYS  13           1HD      LYS  13   4.915   5.807  12.330
  114    HE2  LYS  13           2HE      LYS  13   2.816   7.953  12.039
  115    HE3  LYS  13           1HE      LYS  13   3.542   7.424  13.556
  116    HZ1  LYS  13           3HZ      LYS  13   5.157   8.492  11.316
  117    HZ2  LYS  13           1HZ      LYS  13   5.617   8.290  12.932
  118    HZ3  LYS  13           2HZ      LYS  13   4.501   9.490  12.514
  119    H    ASN  14           H        ASN  14   5.446   6.051   8.245
  120    HA   ASN  14           HA       ASN  14   7.357   8.137   8.730
  121    HB2  ASN  14           2HB      ASN  14   7.987   5.265   8.082
  122    HB3  ASN  14           1HB      ASN  14   8.973   6.417   8.979
  123   HD21  ASN  14          1HD2      ASN  14   7.066   3.798   9.293
  124   HD22  ASN  14          2HD2      ASN  14   6.544   3.997  10.927
  125    H    PHE  15           H        PHE  15   5.801   7.106   6.032
  126    HA   PHE  15           HA       PHE  15   7.899   6.939   4.148
  127    HB2  PHE  15           2HB      PHE  15   5.040   6.792   4.128
  128    HB3  PHE  15           1HB      PHE  15   5.568   7.872   2.844
  129    HD1  PHE  15           1HD      PHE  15   7.817   5.228   3.875
  130    HD2  PHE  15           2HD      PHE  15   4.666   6.266   1.210
  131    HE1  PHE  15           1HE      PHE  15   8.368   3.283   2.473
  132    HE2  PHE  15           2HE      PHE  15   5.210   4.321  -0.197
  133    HZ   PHE  15           HZ       PHE  15   7.064   2.827   0.434
  134    H    GLU  16           H        GLU  16   5.988   9.576   5.401
  135    HA   GLU  16           HA       GLU  16   7.156  11.727   5.560
  136    HB2  GLU  16           2HB      GLU  16   8.272  12.644   3.663
  137    HB3  GLU  16           1HB      GLU  16   8.850  10.999   3.861
  138    HG2  GLU  16           2HG      GLU  16   7.726  12.212   1.576
  139    HG3  GLU  16           1HG      GLU  16   8.317  10.564   1.768
  140    H    LYS  17           H        LYS  17   4.689  10.278   3.820
  141    HA   LYS  17           HA       LYS  17   3.525  12.498   2.533
  142    HB2  LYS  17           2HB      LYS  17   1.373  11.009   2.926
  143    HB3  LYS  17           1HB      LYS  17   2.599  10.561   1.753
  144    HG2  LYS  17           2HG      LYS  17   3.170   9.518   4.398
  145    HG3  LYS  17           1HG      LYS  17   1.611   8.975   3.770
  146    HD2  LYS  17           2HD      LYS  17   3.960   8.916   1.956
  147    HD3  LYS  17           1HD      LYS  17   3.849   7.685   3.217
  148    HE2  LYS  17           2HE      LYS  17   1.319   7.683   2.190
  149    HE3  LYS  17           1HE      LYS  17   2.292   8.016   0.758
  150    HZ1  LYS  17           3HZ      LYS  17   3.399   5.925   2.364
  151    HZ2  LYS  17           1HZ      LYS  17   3.025   5.934   0.713
  152    HZ3  LYS  17           2HZ      LYS  17   1.829   5.561   1.850
  153    H    VAL  18           H        VAL  18   3.268  11.240   5.807
  154    HA   VAL  18           HA       VAL  18   2.591  13.663   6.973
  155    HB   VAL  18           HB       VAL  18   0.132  12.876   7.589
  156   HG11  VAL  18          1HG1      VAL  18   1.272  14.832   5.960
  157   HG12  VAL  18          2HG1      VAL  18  -0.370  14.803   6.603
  158   HG13  VAL  18          3HG1      VAL  18  -0.037  14.137   5.004
  159   HG21  VAL  18          3HG2      VAL  18  -0.997  11.644   6.018
  160   HG22  VAL  18          1HG2      VAL  18   0.590  10.882   5.937
  161   HG23  VAL  18          2HG2      VAL  18   0.119  12.070   4.722
  162    H    ASP  19           H        ASP  19   2.564  13.529   9.190
  163    HA   ASP  19           HA       ASP  19   3.461  11.081  10.330
  164    HB2  ASP  19           2HB      ASP  19   2.729  13.726  11.593
  165    HB3  ASP  19           1HB      ASP  19   3.436  12.373  12.473
  166    H    ALA  20           H        ALA  20   2.442   9.783  11.873
  167    HA   ALA  20           HA       ALA  20  -0.303   9.331  11.504
  168    HB1  ALA  20           1HB      ALA  20   0.066   7.979  13.735
  169    HB2  ALA  20           2HB      ALA  20   1.763   8.302  13.380
  170    HB3  ALA  20           3HB      ALA  20   0.767   7.437  12.210
  171    H    SER  21           H        SER  21   1.346  11.565  13.482
  172    HA   SER  21           HA       SER  21  -0.509  11.815  15.594
  173    HB2  SER  21           2HB      SER  21   0.920  13.381  16.376
  174    HB3  SER  21           1HB      SER  21   1.964  12.874  15.047
  175    HG   SER  21           HG       SER  21   0.827  14.524  13.783
  176    H    LYS  22           H        LYS  22  -0.646  12.733  12.324
  177    HA   LYS  22           HA       LYS  22  -2.747  14.695  12.843
  178    HB2  LYS  22           2HB      LYS  22  -2.451  15.404  10.521
  179    HB3  LYS  22           1HB      LYS  22  -0.930  15.467  11.400
  180    HG2  LYS  22           2HG      LYS  22  -1.159  12.902  10.202
  181    HG3  LYS  22           1HG      LYS  22  -1.517  14.126   8.982
  182    HD2  LYS  22           2HD      LYS  22   0.953  13.932  10.702
  183    HD3  LYS  22           1HD      LYS  22   0.845  13.684   8.958
  184    HE2  LYS  22           2HE      LYS  22  -0.250  16.223   9.471
  185    HE3  LYS  22           1HE      LYS  22   1.228  16.118  10.428
  186    HZ1  LYS  22           3HZ      LYS  22   1.186  16.836   7.874
  187    HZ2  LYS  22           1HZ      LYS  22   1.415  15.169   7.688
  188    HZ3  LYS  22           2HZ      LYS  22   2.514  16.078   8.597
  189    H    VAL  23           H        VAL  23  -2.236  11.496  11.842
  190    HA   VAL  23           HA       VAL  23  -4.610  11.280  10.229
  191    HB   VAL  23           HB       VAL  23  -4.067   9.009   9.910
  192   HG11  VAL  23          1HG1      VAL  23  -1.475   9.130   9.605
  193   HG12  VAL  23          2HG1      VAL  23  -1.703  10.825  10.033
  194   HG13  VAL  23          3HG1      VAL  23  -2.532  10.151   8.630
  195   HG21  VAL  23          3HG2      VAL  23  -3.656   7.911  11.837
  196   HG22  VAL  23          1HG2      VAL  23  -2.803   9.277  12.555
  197   HG23  VAL  23          2HG2      VAL  23  -1.970   8.218  11.417
  198    H    THR  24           H        THR  24  -6.589  10.922  10.950
  199    HA   THR  24           HA       THR  24  -6.938   9.945  13.669
  200    HB   THR  24           HB       THR  24  -9.155  11.351  12.353
  201    HG1  THR  24           1HG      THR  24  -7.155  12.542  11.869
  202   HG21  THR  24          3HG2      THR  24  -8.531  12.479  14.840
  203   HG22  THR  24          1HG2      THR  24  -8.356  10.733  15.015
  204   HG23  THR  24          2HG2      THR  24  -9.877  11.412  14.436
  205    HA   PRO  25           HA       PRO  25  -9.187   6.384  12.434
  206    HB2  PRO  25           2HB      PRO  25 -11.489   7.316  14.068
  207    HB3  PRO  25           1HB      PRO  25 -10.596   5.793  14.147
  208    HG2  PRO  25           2HG      PRO  25 -10.251   7.676  16.002
  209    HG3  PRO  25           1HG      PRO  25  -8.885   6.709  15.414
  210    HD2  PRO  25           2HD      PRO  25  -9.635   9.527  14.760
  211    HD3  PRO  25           1HD      PRO  25  -8.026   8.808  14.978
  212    H    GLU  26           H        GLU  26 -11.016   9.409  12.427
  213    HA   GLU  26           HA       GLU  26 -12.649   8.406  10.224
  214    HB2  GLU  26           2HB      GLU  26 -14.081   9.234  11.882
  215    HB3  GLU  26           1HB      GLU  26 -13.038  10.607  12.223
  216    HG2  GLU  26           2HG      GLU  26 -14.915  11.468  11.104
  217    HG3  GLU  26           1HG      GLU  26 -13.603  11.464   9.927
  218    H    SER  27           H        SER  27  -9.902  10.154  10.756
  219    HA   SER  27           HA       SER  27 -10.129  12.362   9.052
  220    HB2  SER  27           2HB      SER  27  -8.252  11.929  10.664
  221    HB3  SER  27           1HB      SER  27  -7.625  10.734   9.530
  222    HG   SER  27           HG       SER  27  -7.774  13.527   9.278
  223    H    HIS  28           H        HIS  28 -10.093  12.611   6.910
  224    HA   HIS  28           HA       HIS  28 -10.207  10.292   5.240
  225    HB2  HIS  28           2HB      HIS  28 -10.098  13.036   4.088
  226    HB3  HIS  28           1HB      HIS  28 -11.096  11.663   3.619
  227    HD1  HIS  28           1HD      HIS  28 -12.886  11.048   5.767
  228    HD2  HIS  28           2HD      HIS  28 -11.611  14.962   5.201
  229    HE1  HIS  28           1HE      HIS  28 -14.591  12.485   6.930
  230    HE2  HIS  28           2HE      HIS  28 -13.844  14.852   6.501
  231    H    PHE  29           H        PHE  29  -8.822   9.807   3.497
  232    HA   PHE  29           HA       PHE  29  -6.079  10.234   4.007
  233    HB2  PHE  29           2HB      PHE  29  -7.309   8.279   2.769
  234    HB3  PHE  29           1HB      PHE  29  -7.053   9.283   1.346
  235    HD1  PHE  29           2HD      PHE  29  -4.425  10.420   1.791
  236    HD2  PHE  29           1HD      PHE  29  -5.859   6.498   2.608
  237    HE1  PHE  29           2HE      PHE  29  -2.134   9.543   1.586
  238    HE2  PHE  29           1HE      PHE  29  -3.572   5.614   2.404
  239    HZ   PHE  29           HZ       PHE  29  -1.706   7.138   1.893
  240    H    VAL  30           H        VAL  30  -7.484  10.807   0.842
  241    HA   VAL  30           HA       VAL  30  -5.646  12.751   0.084
  242    HB   VAL  30           HB       VAL  30  -7.209  13.325  -1.739
  243   HG11  VAL  30          1HG1      VAL  30  -7.218  11.142  -2.807
  244   HG12  VAL  30          2HG1      VAL  30  -6.963  10.359  -1.247
  245   HG13  VAL  30          3HG1      VAL  30  -5.708  11.393  -1.931
  246   HG21  VAL  30          3HG2      VAL  30  -9.202  11.387  -1.473
  247   HG22  VAL  30          1HG2      VAL  30  -9.394  13.136  -1.366
  248   HG23  VAL  30          2HG2      VAL  30  -9.118  12.190   0.095
  249    H    LYS  31           H        LYS  31  -8.658  13.048   1.774
  250    HA   LYS  31           HA       LYS  31  -8.863  15.876   1.489
  251    HB2  LYS  31           2HB      LYS  31 -10.271  14.682   3.765
  252    HB3  LYS  31           1HB      LYS  31 -10.893  15.653   2.439
  253    HG2  LYS  31           2HG      LYS  31 -10.813  13.654   0.987
  254    HG3  LYS  31           1HG      LYS  31 -10.308  12.701   2.383
  255    HD2  LYS  31           2HD      LYS  31 -12.502  12.343   2.681
  256    HD3  LYS  31           1HD      LYS  31 -12.520  13.978   3.344
  257    HE2  LYS  31           2HE      LYS  31 -12.758  13.724   0.406
  258    HE3  LYS  31           1HE      LYS  31 -14.136  13.182   1.362
  259    HZ1  LYS  31           3HZ      LYS  31 -14.706  15.334   1.256
  260    HZ2  LYS  31           1HZ      LYS  31 -13.134  15.861   0.916
  261    HZ3  LYS  31           2HZ      LYS  31 -13.590  15.531   2.511
  262    H    ASP  32           H        ASP  32  -7.129  13.783   3.571
  263    HA   ASP  32           HA       ASP  32  -6.842  15.724   5.676
  264    HB2  ASP  32           2HB      ASP  32  -6.940  13.479   6.435
  265    HB3  ASP  32           1HB      ASP  32  -5.736  12.956   5.261
  266    H    LEU  33           H        LEU  33  -5.560  15.484   2.699
  267    HA   LEU  33           HA       LEU  33  -3.824  17.394   2.533
  268    HB2  LEU  33           2HB      LEU  33  -2.633  15.369   4.346
  269    HB3  LEU  33           1HB      LEU  33  -1.557  16.118   3.182
  270    HG   LEU  33           HG       LEU  33  -3.215  18.041   4.642
  271   HD11  LEU  33          1HD1      LEU  33  -2.924  17.274   6.701
  272   HD12  LEU  33          2HD1      LEU  33  -1.187  17.473   6.481
  273   HD13  LEU  33          3HD1      LEU  33  -1.950  15.925   6.115
  274   HD21  LEU  33          3HD2      LEU  33  -1.227  18.462   3.115
  275   HD22  LEU  33          1HD2      LEU  33  -0.223  17.868   4.437
  276   HD23  LEU  33          2HD2      LEU  33  -1.227  19.298   4.668
  277    H    GLY  34           H        GLY  34  -4.664  14.272   1.714
  278    HA2  GLY  34           2HA      GLY  34  -3.916  12.802   0.048
  279    HA3  GLY  34           1HA      GLY  34  -4.300  14.232  -0.898
  280    H    LEU  35           H        LEU  35  -1.878  12.071   0.052
  281    HA   LEU  35           HA       LEU  35   0.416  13.686  -0.252
  282    HB2  LEU  35           2HB      LEU  35   1.003  11.027  -1.056
  283    HB3  LEU  35           1HB      LEU  35   1.401  11.825   0.453
  284    HG   LEU  35           HG       LEU  35  -0.879  11.160   1.297
  285   HD11  LEU  35          1HD1      LEU  35  -2.358  10.177  -0.031
  286   HD12  LEU  35          2HD1      LEU  35  -1.194   8.932  -0.486
  287   HD13  LEU  35          3HD1      LEU  35  -1.259  10.450  -1.383
  288   HD21  LEU  35          3HD2      LEU  35   0.026   8.549   1.006
  289   HD22  LEU  35          1HD2      LEU  35   0.430   9.672   2.305
  290   HD23  LEU  35          2HD2      LEU  35   1.480   9.541   0.894
  291    H    ASN  36           H        ASN  36   1.953  13.670  -2.006
  292    HA   ASN  36           HA       ASN  36   0.839  14.270  -4.488
  293    HB2  ASN  36           2HB      ASN  36   3.431  13.594  -5.116
  294    HB3  ASN  36           1HB      ASN  36   2.899  15.166  -4.538
  295   HD21  ASN  36          1HD2      ASN  36   3.067  12.180  -2.733
  296   HD22  ASN  36          2HD2      ASN  36   4.264  12.704  -1.602
  297    H    SER  37           H        SER  37   1.825  13.108  -6.559
  298    HA   SER  37           HA       SER  37   0.494  10.639  -6.753
  299    HB2  SER  37           2HB      SER  37   2.453  12.022  -8.579
  300    HB3  SER  37           1HB      SER  37   1.676  10.494  -8.997
  301    H    LEU  38           H        LEU  38   3.939  11.400  -6.749
  302    HA   LEU  38           HA       LEU  38   4.905   8.797  -6.933
  303    HB2  LEU  38           2HB      LEU  38   7.008   9.641  -6.186
  304    HB3  LEU  38           1HB      LEU  38   6.259  10.855  -7.202
  305    HG   LEU  38           HG       LEU  38   7.280  11.147  -4.583
  306   HD11  LEU  38          1HD1      LEU  38   6.032  12.874  -6.663
  307   HD12  LEU  38          2HD1      LEU  38   7.674  12.889  -6.020
  308   HD13  LEU  38          3HD1      LEU  38   6.346  13.539  -5.060
  309   HD21  LEU  38          3HD2      LEU  38   5.224  12.359  -3.651
  310   HD22  LEU  38          1HD2      LEU  38   5.276  10.602  -3.524
  311   HD23  LEU  38          2HD2      LEU  38   4.299  11.367  -4.776
  312    H    ASP  39           H        ASP  39   3.174  10.206  -4.420
  313    HA   ASP  39           HA       ASP  39   4.358   8.686  -2.272
  314    HB2  ASP  39           2HB      ASP  39   2.245  10.722  -2.544
  315    HB3  ASP  39           1HB      ASP  39   1.961   9.525  -1.285
  316    H    VAL  40           H        VAL  40   0.913   8.786  -2.541
  317    HA   VAL  40           HA       VAL  40   0.254   6.326  -1.772
  318    HB   VAL  40           HB       VAL  40  -1.183   8.283  -2.938
  319   HG11  VAL  40          1HG1      VAL  40  -0.342   7.069  -5.165
  320   HG12  VAL  40          2HG1      VAL  40  -1.915   7.853  -5.041
  321   HG13  VAL  40          3HG1      VAL  40  -1.784   6.105  -4.849
  322   HG21  VAL  40          3HG2      VAL  40  -2.580   7.130  -1.636
  323   HG22  VAL  40          1HG2      VAL  40  -1.697   5.625  -1.893
  324   HG23  VAL  40          2HG2      VAL  40  -2.924   6.136  -3.052
  325    H    VAL  41           H        VAL  41   1.554   7.121  -4.939
  326    HA   VAL  41           HA       VAL  41   1.122   4.626  -6.167
  327    HB   VAL  41           HB       VAL  41   2.764   5.296  -7.818
  328   HG11  VAL  41          1HG1      VAL  41   1.853   7.813  -8.039
  329   HG12  VAL  41          2HG1      VAL  41   0.690   7.173  -6.877
  330   HG13  VAL  41          3HG1      VAL  41   0.890   6.393  -8.445
  331   HG21  VAL  41          3HG2      VAL  41   3.485   7.452  -5.839
  332   HG22  VAL  41          1HG2      VAL  41   4.004   7.443  -7.524
  333   HG23  VAL  41          2HG2      VAL  41   4.519   6.154  -6.435
  334    H    GLU  42           H        GLU  42   4.120   5.962  -4.744
  335    HA   GLU  42           HA       GLU  42   5.658   3.658  -4.985
  336    HB2  GLU  42           2HB      GLU  42   7.243   4.881  -3.971
  337    HB3  GLU  42           1HB      GLU  42   6.068   6.189  -4.006
  338    HG2  GLU  42           2HG      GLU  42   6.653   6.224  -1.807
  339    HG3  GLU  42           1HG      GLU  42   5.281   5.118  -1.746
  340    H    VAL  43           H        VAL  43   3.465   4.662  -2.450
  341    HA   VAL  43           HA       VAL  43   4.062   2.590  -0.629
  342    HB   VAL  43           HB       VAL  43   2.920   4.218   0.486
  343   HG11  VAL  43          1HG1      VAL  43   1.859   5.858  -0.570
  344   HG12  VAL  43          2HG1      VAL  43   0.602   4.753  -1.118
  345   HG13  VAL  43          3HG1      VAL  43   2.068   4.963  -2.072
  346   HG21  VAL  43          3HG2      VAL  43   1.726   1.970   0.631
  347   HG22  VAL  43          1HG2      VAL  43   0.504   2.720  -0.389
  348   HG23  VAL  43          2HG2      VAL  43   0.858   3.400   1.196
  349    H    VAL  44           H        VAL  44   1.627   2.932  -3.144
  350    HA   VAL  44           HA       VAL  44   0.150   0.626  -2.615
  351    HB   VAL  44           HB       VAL  44  -0.652   0.729  -4.879
  352   HG11  VAL  44          1HG1      VAL  44  -0.593   3.538  -4.818
  353   HG12  VAL  44          2HG1      VAL  44  -0.562   2.994  -3.142
  354   HG13  VAL  44          3HG1      VAL  44  -1.856   2.466  -4.217
  355   HG21  VAL  44          3HG2      VAL  44   1.053   2.921  -5.794
  356   HG22  VAL  44          1HG2      VAL  44   0.512   1.473  -6.645
  357   HG23  VAL  44          2HG2      VAL  44   1.908   1.395  -5.568
  358    H    PHE  45           H        PHE  45   3.212   1.089  -4.183
  359    HA   PHE  45           HA       PHE  45   3.366  -1.542  -5.292
  360    HB2  PHE  45           2HB      PHE  45   4.842   0.885  -5.480
  361    HB3  PHE  45           1HB      PHE  45   5.954  -0.389  -4.984
  362    HD1  PHE  45           1HD      PHE  45   6.154  -2.433  -6.372
  363    HD2  PHE  45           2HD      PHE  45   4.029   1.008  -7.680
  364    HE1  PHE  45           1HE      PHE  45   6.295  -3.240  -8.697
  365    HE2  PHE  45           2HE      PHE  45   4.161   0.214 -10.008
  366    HZ   PHE  45           HZ       PHE  45   5.296  -1.913 -10.518
  367    H    ALA  46           H        ALA  46   4.283   0.037  -2.355
  368    HA   ALA  46           HA       ALA  46   6.019  -1.979  -1.374
  369    HB1  ALA  46           1HB      ALA  46   5.022  -0.606   0.827
  370    HB2  ALA  46           2HB      ALA  46   5.034   0.572  -0.485
  371    HB3  ALA  46           3HB      ALA  46   6.518  -0.274  -0.044
  372    H    ILE  47           H        ILE  47   3.059  -0.948   0.214
  373    HA   ILE  47           HA       ILE  47   2.557  -3.183   1.684
  374    HB   ILE  47           HB       ILE  47   0.394  -2.438   2.040
  375   HG12  ILE  47          2HG1      ILE  47  -0.125  -2.633  -0.501
  376   HG13  ILE  47          1HG1      ILE  47  -1.067  -1.514   0.475
  377   HG21  ILE  47          1HG2      ILE  47   2.085  -0.710   2.549
  378   HG22  ILE  47          2HG2      ILE  47   0.496  -0.034   2.187
  379   HG23  ILE  47          3HG2      ILE  47   1.774   0.019   0.973
  380   HD11  ILE  47          3HD1      ILE  47   0.865  -0.984  -1.680
  381   HD12  ILE  47          1HD1      ILE  47   0.889   0.130  -0.312
  382   HD13  ILE  47          2HD1      ILE  47  -0.602  -0.118  -1.221
  383    H    GLU  48           H        GLU  48   1.452  -2.598  -1.653
  384    HA   GLU  48           HA       GLU  48  -0.014  -4.936  -1.988
  385    HB2  GLU  48           2HB      GLU  48   1.549  -3.259  -3.938
  386    HB3  GLU  48           1HB      GLU  48   0.632  -4.667  -4.453
  387    HG2  GLU  48           2HG      GLU  48  -0.366  -2.087  -3.318
  388    HG3  GLU  48           1HG      GLU  48  -0.803  -2.880  -4.830
  389    H    GLN  49           H        GLN  49   3.417  -4.351  -2.191
  390    HA   GLN  49           HA       GLN  49   4.253  -6.736  -3.369
  391    HB2  GLN  49           2HB      GLN  49   6.364  -6.065  -2.848
  392    HB3  GLN  49           1HB      GLN  49   5.544  -4.546  -2.513
  393    HG2  GLN  49           2HG      GLN  49   5.392  -5.220  -0.130
  394    HG3  GLN  49           1HG      GLN  49   6.360  -6.642  -0.516
  395   HE21  GLN  49          1HE2      GLN  49   6.775  -3.459  -1.918
  396   HE22  GLN  49          2HE2      GLN  49   8.323  -3.144  -1.221
  397    H    GLU  50           H        GLU  50   3.830  -5.951   0.077
  398    HA   GLU  50           HA       GLU  50   3.949  -8.800   0.667
  399    HB2  GLU  50           2HB      GLU  50   4.877  -8.333   2.693
  400    HB3  GLU  50           1HB      GLU  50   5.391  -6.883   1.840
  401    HG2  GLU  50           2HG      GLU  50   3.196  -5.857   2.705
  402    HG3  GLU  50           1HG      GLU  50   3.185  -7.212   3.835
  403    H    PHE  51           H        PHE  51   1.625  -7.601  -0.466
  404    HA   PHE  51           HA       PHE  51  -0.267  -8.033   1.702
  405    HB2  PHE  51           2HB      PHE  51  -0.123  -5.798  -0.244
  406    HB3  PHE  51           1HB      PHE  51  -1.724  -6.412   0.150
  407    HD1  PHE  51           1HD      PHE  51   0.335  -6.940   2.919
  408    HD2  PHE  51           2HD      PHE  51  -1.764  -3.865   0.860
  409    HE1  PHE  51           1HE      PHE  51   0.322  -5.583   4.970
  410    HE2  PHE  51           2HE      PHE  51  -1.782  -2.502   2.908
  411    HZ   PHE  51           HZ       PHE  51  -0.738  -3.360   4.967
  412    H    ILE  52           H        ILE  52   0.758  -8.800  -1.445
  413    HA   ILE  52           HA       ILE  52   0.034 -10.324  -2.975
  414    HB   ILE  52           HB       ILE  52  -2.161 -11.185  -1.128
  415   HG12  ILE  52          2HG1      ILE  52   0.049 -12.783  -0.543
  416   HG13  ILE  52          1HG1      ILE  52   0.668 -11.136  -0.538
  417   HG21  ILE  52          1HG2      ILE  52  -2.348 -12.584  -2.879
  418   HG22  ILE  52          2HG2      ILE  52  -0.999 -13.421  -2.113
  419   HG23  ILE  52          3HG2      ILE  52  -0.699 -12.282  -3.427
  420   HD11  ILE  52          3HD1      ILE  52  -1.588 -12.229   1.113
  421   HD12  ILE  52          1HD1      ILE  52  -1.153 -10.522   1.031
  422   HD13  ILE  52          2HD1      ILE  52  -0.003 -11.695   1.675
  423    H    LEU  53           H        LEU  53  -0.944  -7.708  -3.121
  424    HA   LEU  53           HA       LEU  53  -3.168  -8.085  -4.846
  425    HB2  LEU  53           2HB      LEU  53  -4.423  -8.098  -2.790
  426    HB3  LEU  53           1HB      LEU  53  -3.609  -6.648  -2.235
  427    HG   LEU  53           HG       LEU  53  -4.667  -5.436  -4.187
  428   HD11  LEU  53          1HD1      LEU  53  -5.475  -8.085  -4.827
  429   HD12  LEU  53          2HD1      LEU  53  -5.766  -6.594  -5.721
  430   HD13  LEU  53          3HD1      LEU  53  -6.916  -7.124  -4.494
  431   HD21  LEU  53          3HD2      LEU  53  -5.473  -5.406  -1.799
  432   HD22  LEU  53          1HD2      LEU  53  -6.653  -6.632  -2.266
  433   HD23  LEU  53          2HD2      LEU  53  -6.691  -5.037  -3.020
  434    H    ASP  54           H        ASP  54  -3.922  -5.936  -5.752
  435    HA   ASP  54           HA       ASP  54  -1.715  -4.033  -5.754
  436    HB2  ASP  54           2HB      ASP  54  -3.475  -4.840  -8.068
  437    HB3  ASP  54           1HB      ASP  54  -2.270  -3.556  -8.126
  438    H    ILE  55           H        ILE  55  -2.188  -1.853  -5.745
  439    HA   ILE  55           HA       ILE  55  -5.013  -1.157  -5.400
  440    HB   ILE  55           HB       ILE  55  -2.640   0.074  -4.003
  441   HG12  ILE  55          2HG1      ILE  55  -4.889  -1.696  -3.034
  442   HG13  ILE  55          1HG1      ILE  55  -3.165  -2.051  -3.014
  443   HG21  ILE  55          1HG2      ILE  55  -5.193   1.163  -4.601
  444   HG22  ILE  55          2HG2      ILE  55  -3.889   1.869  -3.644
  445   HG23  ILE  55          3HG2      ILE  55  -5.112   0.866  -2.864
  446   HD11  ILE  55          3HD1      ILE  55  -3.265   0.229  -1.543
  447   HD12  ILE  55          1HD1      ILE  55  -3.283  -1.406  -0.882
  448   HD13  ILE  55          2HD1      ILE  55  -4.798  -0.537  -1.126
  449    HA   PRO  56           HA       PRO  56  -2.639   1.700  -8.443
  450    HB2  PRO  56           2HB      PRO  56  -2.549   0.343 -10.762
  451    HB3  PRO  56           1HB      PRO  56  -1.284   0.180  -9.536
  452    HG2  PRO  56           2HG      PRO  56  -3.594  -1.630 -10.128
  453    HG3  PRO  56           1HG      PRO  56  -1.908  -2.047  -9.771
  454    HD2  PRO  56           2HD      PRO  56  -3.921  -2.152  -7.920
  455    HD3  PRO  56           1HD      PRO  56  -2.217  -1.873  -7.506
  456    H    ASP  57           H        ASP  57  -3.489   2.156 -10.898
  457    HA   ASP  57           HA       ASP  57  -5.243   3.240 -11.910
  458    HB2  ASP  57           2HB      ASP  57  -6.918   0.808 -11.621
  459    HB3  ASP  57           1HB      ASP  57  -6.508   1.729 -13.065
  460    H    HIS  58           H        HIS  58  -8.059   2.442 -11.630
  461    HA   HIS  58           HA       HIS  58  -8.913   4.336  -9.789
  462    HB2  HIS  58           2HB      HIS  58 -10.644   1.972 -10.400
  463    HB3  HIS  58           1HB      HIS  58 -11.078   3.675 -10.294
  464    HD1  HIS  58           1HD      HIS  58 -10.769   5.110 -12.409
  465    HD2  HIS  58           2HD      HIS  58  -9.657   1.137 -12.894
  466    HE1  HIS  58           1HE      HIS  58 -10.491   4.788 -14.887
  467    HE2  HIS  58           2HE      HIS  58  -9.907   2.352 -15.163
  468    H    ASP  59           H        ASP  59  -7.568   1.326  -9.169
  469    HA   ASP  59           HA       ASP  59  -9.006   0.477  -6.909
  470    HB2  ASP  59           2HB      ASP  59  -6.047   0.043  -7.242
  471    HB3  ASP  59           1HB      ASP  59  -7.239  -1.028  -6.512
  472    H    ALA  60           H        ALA  60  -6.146   2.552  -7.220
  473    HA   ALA  60           HA       ALA  60  -6.116   3.063  -4.377
  474    HB1  ALA  60           1HB      ALA  60  -4.253   3.385  -6.582
  475    HB2  ALA  60           2HB      ALA  60  -3.940   3.156  -4.862
  476    HB3  ALA  60           3HB      ALA  60  -4.273   4.770  -5.489
  477    H    GLU  61           H        GLU  61  -7.185   4.567  -7.298
  478    HA   GLU  61           HA       GLU  61  -7.438   7.206  -6.252
  479    HB2  GLU  61           2HB      GLU  61  -8.707   5.907  -8.667
  480    HB3  GLU  61           1HB      GLU  61  -8.790   7.624  -8.296
  481    HG2  GLU  61           2HG      GLU  61  -6.106   7.165  -8.206
  482    HG3  GLU  61           1HG      GLU  61  -6.627   6.054  -9.472
  483    H    LYS  62           H        LYS  62  -9.417   4.361  -6.241
  484    HA   LYS  62           HA       LYS  62 -11.887   5.659  -5.680
  485    HB2  LYS  62           2HB      LYS  62 -10.894   2.856  -5.692
  486    HB3  LYS  62           1HB      LYS  62 -12.350   3.196  -4.767
  487    HG2  LYS  62           2HG      LYS  62 -11.890   3.377  -7.707
  488    HG3  LYS  62           1HG      LYS  62 -13.199   2.594  -6.820
  489    HD2  LYS  62           2HD      LYS  62 -14.373   4.413  -7.445
  490    HD3  LYS  62           1HD      LYS  62 -13.561   5.167  -6.070
  491    HE2  LYS  62           2HE      LYS  62 -11.793   5.969  -7.580
  492    HE3  LYS  62           1HE      LYS  62 -12.646   5.248  -8.945
  493    HZ1  LYS  62           3HZ      LYS  62 -14.277   6.827  -8.880
  494    HZ2  LYS  62           1HZ      LYS  62 -12.965   7.752  -8.346
  495    HZ3  LYS  62           2HZ      LYS  62 -14.082   7.147  -7.230
  496    H    ILE  63           H        ILE  63  -9.257   5.825  -3.921
  497    HA   ILE  63           HA       ILE  63 -10.564   5.358  -1.346
  498    HB   ILE  63           HB       ILE  63  -7.751   5.230  -2.240
  499   HG12  ILE  63          2HG1      ILE  63  -8.604   3.829   0.192
  500   HG13  ILE  63          1HG1      ILE  63  -9.600   3.467  -1.214
  501   HG21  ILE  63          1HG2      ILE  63  -7.516   7.072  -0.747
  502   HG22  ILE  63          2HG2      ILE  63  -6.951   5.631   0.099
  503   HG23  ILE  63          3HG2      ILE  63  -8.542   6.298   0.461
  504   HD11  ILE  63          3HD1      ILE  63  -7.663   1.928  -0.819
  505   HD12  ILE  63          1HD1      ILE  63  -6.603   3.276  -1.232
  506   HD13  ILE  63          2HD1      ILE  63  -7.741   2.651  -2.426
  507    H    GLN  64           H        GLN  64 -11.293   7.068  -0.269
  508    HA   GLN  64           HA       GLN  64 -10.105   9.672  -0.818
  509    HB2  GLN  64           2HB      GLN  64 -12.942   9.180   0.069
  510    HB3  GLN  64           1HB      GLN  64 -12.244  10.707  -0.455
  511    HG2  GLN  64           2HG      GLN  64 -13.347   8.511  -2.020
  512    HG3  GLN  64           1HG      GLN  64 -13.158  10.217  -2.426
  513   HE21  GLN  64          1HE2      GLN  64 -12.147   7.129  -3.104
  514   HE22  GLN  64          2HE2      GLN  64 -10.695   7.498  -3.964
  515    H    SER  65           H        SER  65 -11.595   7.625   1.637
  516    HA   SER  65           HA       SER  65 -10.494   9.376   3.724
  517    HB2  SER  65           2HB      SER  65 -12.509   7.157   4.105
  518    HB3  SER  65           1HB      SER  65 -12.103   8.451   5.233
  519    HG   SER  65           HG       SER  65 -12.935   9.344   2.779
  520    H    ILE  66           H        ILE  66  -9.402   8.436   5.526
  521    HA   ILE  66           HA       ILE  66  -7.480   6.513   4.827
  522    HB   ILE  66           HB       ILE  66  -8.229   7.165   7.667
  523   HG12  ILE  66          2HG1      ILE  66  -7.892   9.155   5.919
  524   HG13  ILE  66          1HG1      ILE  66  -7.279   9.247   7.565
  525   HG21  ILE  66          1HG2      ILE  66  -5.845   6.088   6.257
  526   HG22  ILE  66          2HG2      ILE  66  -6.563   5.610   7.796
  527   HG23  ILE  66          3HG2      ILE  66  -5.593   7.079   7.693
  528   HD11  ILE  66          3HD1      ILE  66  -5.675   9.985   5.823
  529   HD12  ILE  66          1HD1      ILE  66  -5.647   8.330   5.214
  530   HD13  ILE  66          2HD1      ILE  66  -5.077   8.678   6.846
  531    HA   PRO  67           HA       PRO  67 -10.409   3.707   7.734
  532    HB2  PRO  67           2HB      PRO  67 -12.874   4.597   6.312
  533    HB3  PRO  67           1HB      PRO  67 -12.658   4.122   8.000
  534    HG2  PRO  67           2HG      PRO  67 -12.924   6.686   7.337
  535    HG3  PRO  67           1HG      PRO  67 -11.795   6.186   8.611
  536    HD2  PRO  67           2HD      PRO  67 -11.235   7.036   5.805
  537    HD3  PRO  67           1HD      PRO  67 -10.291   7.317   7.282
  538    H    ASP  68           H        ASP  68 -12.162   4.301   4.696
  539    HA   ASP  68           HA       ASP  68 -12.297   1.652   3.894
  540    HB2  ASP  68           2HB      ASP  68 -12.714   4.270   2.633
  541    HB3  ASP  68           1HB      ASP  68 -12.251   3.003   1.501
  542    H    ALA  69           H        ALA  69  -9.629   3.780   3.872
  543    HA   ALA  69           HA       ALA  69  -8.128   2.719   1.743
  544    HB1  ALA  69           1HB      ALA  69  -6.814   4.414   2.297
  545    HB2  ALA  69           2HB      ALA  69  -6.379   3.599   3.798
  546    HB3  ALA  69           3HB      ALA  69  -7.773   4.678   3.754
  547    H    VAL  70           H        VAL  70  -6.903   2.433   5.000
  548    HA   VAL  70           HA       VAL  70  -5.655  -0.045   4.504
  549    HB   VAL  70           HB       VAL  70  -4.815   1.519   6.193
  550   HG11  VAL  70          1HG1      VAL  70  -6.665   2.483   7.207
  551   HG12  VAL  70          2HG1      VAL  70  -6.050   1.407   8.463
  552   HG13  VAL  70          3HG1      VAL  70  -7.445   0.927   7.494
  553   HG21  VAL  70          3HG2      VAL  70  -5.597  -0.998   7.628
  554   HG22  VAL  70          1HG2      VAL  70  -4.092  -0.086   7.733
  555   HG23  VAL  70          2HG2      VAL  70  -4.458  -1.017   6.282
  556    H    GLU  71           H        GLU  71  -8.855   0.738   5.336
  557    HA   GLU  71           HA       GLU  71  -9.538  -1.564   6.833
  558    HB2  GLU  71           2HB      GLU  71 -11.156   0.437   5.274
  559    HB3  GLU  71           1HB      GLU  71 -11.906  -0.935   6.077
  560    HG2  GLU  71           2HG      GLU  71 -10.189   1.092   7.485
  561    HG3  GLU  71           1HG      GLU  71 -11.945   1.197   7.368
  562    H    TYR  72           H        TYR  72 -10.080  -0.720   3.414
  563    HA   TYR  72           HA       TYR  72 -11.182  -3.202   2.686
  564    HB2  TYR  72           2HB      TYR  72 -11.550  -2.116   0.767
  565    HB3  TYR  72           1HB      TYR  72 -10.644  -0.751   1.414
  566    HD1  TYR  72           1HD      TYR  72  -8.092  -0.779   1.087
  567    HD2  TYR  72           2HD      TYR  72 -10.757  -3.269  -1.102
  568    HE1  TYR  72           1HE      TYR  72  -6.364  -1.104  -0.631
  569    HE2  TYR  72           2HE      TYR  72  -9.039  -3.598  -2.830
  570    HH   TYR  72           HH       TYR  72  -7.054  -2.777  -3.634
  571    H    ILE  73           H        ILE  73  -7.920  -1.918   2.336
  572    HA   ILE  73           HA       ILE  73  -6.802  -4.207   1.145
  573    HB   ILE  73           HB       ILE  73  -5.184  -2.712   0.841
  574   HG12  ILE  73          2HG1      ILE  73  -4.324  -4.190   2.822
  575   HG13  ILE  73          1HG1      ILE  73  -3.414  -2.762   2.336
  576   HG21  ILE  73          1HG2      ILE  73  -5.014  -0.656   2.391
  577   HG22  ILE  73          2HG2      ILE  73  -6.545  -1.227   3.053
  578   HG23  ILE  73          3HG2      ILE  73  -6.423  -0.817   1.343
  579   HD11  ILE  73          3HD1      ILE  73  -4.521  -3.399   4.871
  580   HD12  ILE  73          1HD1      ILE  73  -5.300  -1.937   4.265
  581   HD13  ILE  73          2HD1      ILE  73  -3.542  -2.007   4.406
  582    H    ALA  74           H        ALA  74  -7.313  -3.287   4.464
  583    HA   ALA  74           HA       ALA  74  -5.634  -5.200   5.667
  584    HB1  ALA  74           1HB      ALA  74  -6.452  -3.295   6.915
  585    HB2  ALA  74           2HB      ALA  74  -6.951  -4.790   7.706
  586    HB3  ALA  74           3HB      ALA  74  -8.111  -3.870   6.747
  587    H    GLN  75           H        GLN  75  -9.091  -5.223   4.977
  588    HA   GLN  75           HA       GLN  75  -9.407  -7.934   5.820
  589    HB2  GLN  75           2HB      GLN  75 -11.343  -6.225   4.266
  590    HB3  GLN  75           1HB      GLN  75 -11.719  -7.694   5.157
  591    HG2  GLN  75           2HG      GLN  75 -11.666  -6.653   7.177
  592    HG3  GLN  75           1HG      GLN  75 -10.486  -5.452   6.653
  593   HE21  GLN  75          1HE2      GLN  75 -11.205  -3.481   6.284
  594   HE22  GLN  75          2HE2      GLN  75 -12.852  -3.035   6.012
  595    H    ASN  76           H        ASN  76 -10.546  -6.632   2.763
  596    HA   ASN  76           HA       ASN  76 -10.673  -8.699   1.164
  597    HB2  ASN  76           2HB      ASN  76  -9.624  -5.982   0.694
  598    HB3  ASN  76           1HB      ASN  76  -9.179  -7.169  -0.529
  599   HD21  ASN  76          1HD2      ASN  76 -11.282  -4.846   0.044
  600   HD22  ASN  76          2HD2      ASN  76 -12.682  -5.451  -0.769
  601    HA   PRO  77           HA       PRO  77  -5.943  -9.249   0.195
  602    HB2  PRO  77           2HB      PRO  77  -4.771  -7.442   2.245
  603    HB3  PRO  77           1HB      PRO  77  -4.257  -7.740   0.581
  604    HG2  PRO  77           2HG      PRO  77  -5.498  -5.477   1.223
  605    HG3  PRO  77           1HG      PRO  77  -5.849  -6.302  -0.307
  606    HD2  PRO  77           2HD      PRO  77  -7.453  -6.238   2.220
  607    HD3  PRO  77           1HD      PRO  77  -7.997  -6.180   0.531
  608    H    MET  78           H        MET  78  -6.878  -8.536   3.553
  609    HA   MET  78           HA       MET  78  -5.172 -10.252   4.893
  610    HB2  MET  78           2HB      MET  78  -6.360  -9.068   6.421
  611    HB3  MET  78           1HB      MET  78  -7.818  -9.064   5.438
  612    HG2  MET  78           2HG      MET  78  -8.533 -11.104   6.256
  613    HG3  MET  78           1HG      MET  78  -6.916 -11.575   6.776
  614    HE1  MET  78           3HE      MET  78  -8.218 -12.493   8.771
  615    HE2  MET  78           1HE      MET  78  -9.777 -11.669   8.755
  616    HE3  MET  78           2HE      MET  78  -8.723 -11.535  10.162
  617    H    ALA  79           H        ALA  79  -7.719 -11.021   2.756
  618    HA   ALA  79           HA       ALA  79  -7.360 -13.842   3.352
  619    HB1  ALA  79           1HB      ALA  79  -9.709 -12.419   3.922
  620    HB2  ALA  79           2HB      ALA  79  -9.459 -14.164   3.989
  621    HB3  ALA  79           3HB      ALA  79 -10.057 -13.415   2.508
  622    H    LYS  80           H        LYS  80  -6.760 -11.652   1.191
  623    HA   LYS  80           HA       LYS  80  -7.113 -11.448  -1.140
  624    HB2  LYS  80           2HB      LYS  80  -5.514 -13.952  -0.600
  625    HB3  LYS  80           1HB      LYS  80  -5.613 -13.181  -2.177
  626    HG2  LYS  80           2HG      LYS  80  -3.746 -12.140  -1.501
  627    HG3  LYS  80           1HG      LYS  80  -4.875 -11.079  -0.658
  628    HD2  LYS  80           2HD      LYS  80  -3.238 -11.694   0.936
  629    HD3  LYS  80           1HD      LYS  80  -4.673 -12.648   1.316
  630    HE2  LYS  80           2HE      LYS  80  -3.584 -14.444  -0.192
  631    HE3  LYS  80           1HE      LYS  80  -2.102 -13.519   0.048
  632    HZ1  LYS  80           3HZ      LYS  80  -3.069 -15.448   1.707
  633    HZ2  LYS  80           1HZ      LYS  80  -3.501 -14.015   2.497
  634    HZ3  LYS  80           2HZ      LYS  80  -1.883 -14.308   2.102
  635   H282  PNS 101          8H2       PNS 101   2.986  15.422  -9.856
  636   H281  PNS 101          9H2       PNS 101   3.322  13.780  -9.300
  637   H303  PNS 101          0H3       PNS 101   2.954  16.442  -6.126
  638   H302  PNS 101          1H3       PNS 101   2.068  14.930  -6.315
  639   H301  PNS 101          2H3       PNS 101   1.722  16.293  -7.378
  640   H313  PNS 101          3H3       PNS 101   4.885  14.608  -6.303
  641   H312  PNS 101          4H3       PNS 101   5.081  13.814  -7.865
  642   H311  PNS 101          5H3       PNS 101   3.715  13.399  -6.831
  643    H32  PNS 101           6H3      PNS 101   3.713  17.055  -8.699
  644    H33  PNS 101           7H3      PNS 101   4.709  16.843  -6.301
  645    H36  PNS 101           8H3      PNS 101   6.430  14.908  -8.338
  646   H372  PNS 101          9H3       PNS 101   5.477  14.221 -10.989
  647   H371  PNS 101          0H4       PNS 101   6.439  13.212  -9.909
  648   H382  PNS 101          1H4       PNS 101   7.917  15.538 -10.779
  649   H381  PNS 101          2H4       PNS 101   8.339  13.829 -10.884
  650    H41  PNS 101           3H4      PNS 101   5.352  14.647 -12.743
  651   H422  PNS 101          4H4       PNS 101   6.563  16.703 -14.201
  652   H421  PNS 101          5H4       PNS 101   4.985  16.782 -13.421
  653   H431  PNS 101          7H4       PNS 101   5.780  18.117 -11.823
  654   H432  PNS 101          6H4       PNS 101   7.086  16.980 -11.460
  655    H44  PNS 101           8H4      PNS 101   7.944  18.372 -13.892
  Start of MODEL    5
    1    H1   MET   1           1HT      MET   1  -4.466  -8.250   8.852
    2    H2   MET   1           2HT      MET   1  -4.854  -8.353  10.520
    3    H3   MET   1           3HT      MET   1  -4.928  -9.754   9.531
    4    HA   MET   1           HA       MET   1  -2.991  -9.903  10.783
    5    HB2  MET   1           2HB      MET   1  -2.385  -8.918   7.986
    6    HB3  MET   1           1HB      MET   1  -1.315  -9.902   8.974
    7    HG2  MET   1           2HG      MET   1  -3.962 -10.681   7.790
    8    HG3  MET   1           1HG      MET   1  -2.370 -11.337   7.415
    9    HE1  MET   1           2HE      MET   1  -1.418 -12.857  10.865
   10    HE2  MET   1           3HE      MET   1  -2.087 -11.295  11.336
   11    HE3  MET   1           1HE      MET   1  -1.033 -11.413   9.928
   12    H    ASN   2           H        ASN   2  -1.653  -8.887  12.129
   13    HA   ASN   2           HA       ASN   2  -1.603  -6.098  12.389
   14    HB2  ASN   2           2HB      ASN   2   0.383  -8.106  13.467
   15    HB3  ASN   2           1HB      ASN   2   0.193  -6.447  14.025
   16   HD21  ASN   2          1HD2      ASN   2  -0.570  -6.637  16.018
   17   HD22  ASN   2          2HD2      ASN   2  -1.975  -7.533  16.473
   18    H    ASP   3           H        ASP   3   0.439  -8.288  10.623
   19    HA   ASP   3           HA       ASP   3   2.668  -6.674  10.215
   20    HB2  ASP   3           2HB      ASP   3   3.025  -8.025   8.144
   21    HB3  ASP   3           1HB      ASP   3   2.719  -8.997   9.581
   22    H    VAL   4           H        VAL   4  -0.472  -6.589   8.725
   23    HA   VAL   4           HA       VAL   4   0.237  -4.953   6.512
   24    HB   VAL   4           HB       VAL   4  -2.097  -6.256   7.425
   25   HG11  VAL   4          1HG1      VAL   4  -2.475  -3.304   6.968
   26   HG12  VAL   4          2HG1      VAL   4  -2.922  -4.240   8.395
   27   HG13  VAL   4          3HG1      VAL   4  -3.781  -4.485   6.874
   28   HG21  VAL   4          3HG2      VAL   4  -1.218  -6.430   5.188
   29   HG22  VAL   4          1HG2      VAL   4  -1.492  -4.709   4.910
   30   HG23  VAL   4          2HG2      VAL   4  -2.864  -5.799   5.117
   31    H    LEU   5           H        LEU   5  -1.521  -4.164   9.526
   32    HA   LEU   5           HA       LEU   5  -1.513  -1.388   9.021
   33    HB2  LEU   5           2HB      LEU   5  -2.733  -1.195  10.906
   34    HB3  LEU   5           1HB      LEU   5  -2.910  -2.922  10.689
   35    HG   LEU   5           HG       LEU   5  -2.436  -2.396  13.010
   36   HD11  LEU   5          1HD1      LEU   5  -1.070  -4.219  11.410
   37   HD12  LEU   5          2HD1      LEU   5  -1.301  -4.292  13.157
   38   HD13  LEU   5          3HD1      LEU   5   0.147  -3.538  12.489
   39   HD21  LEU   5          3HD2      LEU   5  -0.977  -0.846  13.650
   40   HD22  LEU   5          1HD2      LEU   5  -0.747  -0.448  11.948
   41   HD23  LEU   5          2HD2      LEU   5   0.324  -1.609  12.735
   42    H    THR   6           H        THR   6   0.625  -3.487  10.813
   43    HA   THR   6           HA       THR   6   2.112  -1.525  12.134
   44    HB   THR   6           HB       THR   6   2.146  -4.313  11.952
   45    HG1  THR   6           1HG      THR   6   3.955  -2.685  13.395
   46   HG21  THR   6          3HG2      THR   6   4.715  -4.573  11.964
   47   HG22  THR   6          1HG2      THR   6   4.693  -3.119  10.967
   48   HG23  THR   6          2HG2      THR   6   3.850  -4.571  10.426
   49    H    ARG   7           H        ARG   7   2.995  -3.307   9.201
   50    HA   ARG   7           HA       ARG   7   5.211  -1.596   8.671
   51    HB2  ARG   7           2HB      ARG   7   5.347  -3.923   8.040
   52    HB3  ARG   7           1HB      ARG   7   3.920  -3.768   7.024
   53    HG2  ARG   7           2HG      ARG   7   6.318  -2.077   6.480
   54    HG3  ARG   7           1HG      ARG   7   6.284  -3.762   5.955
   55    HD2  ARG   7           2HD      ARG   7   4.146  -3.297   4.784
   56    HD3  ARG   7           1HD      ARG   7   4.313  -1.599   5.224
   57    HE   ARG   7           HE       ARG   7   5.722  -1.373   3.456
   58   HH11  ARG   7          1HH1      ARG   7   5.787  -4.699   4.482
   59   HH12  ARG   7          2HH1      ARG   7   6.862  -5.204   3.220
   60   HH21  ARG   7          1HH2      ARG   7   7.136  -2.025   1.789
   61   HH22  ARG   7          2HH2      ARG   7   7.629  -3.683   1.689
   62    H    VAL   8           H        VAL   8   1.994  -2.048   7.317
   63    HA   VAL   8           HA       VAL   8   2.276  -0.252   5.177
   64    HB   VAL   8           HB       VAL   8  -0.282  -1.008   6.584
   65   HG11  VAL   8          1HG1      VAL   8  -1.032  -0.732   4.078
   66   HG12  VAL   8          2HG1      VAL   8   0.355   0.358   4.023
   67   HG13  VAL   8          3HG1      VAL   8  -0.955   0.652   5.169
   68   HG21  VAL   8          3HG2      VAL   8  -0.444  -2.895   5.181
   69   HG22  VAL   8          1HG2      VAL   8   1.204  -2.921   5.809
   70   HG23  VAL   8          2HG2      VAL   8   0.895  -2.354   4.169
   71    H    LEU   9           H        LEU   9   0.791   0.201   8.397
   72    HA   LEU   9           HA       LEU   9   0.106   2.904   8.011
   73    HB2  LEU   9           2HB      LEU   9  -0.809   2.657  10.022
   74    HB3  LEU   9           1HB      LEU   9  -0.163   1.035  10.060
   75    HG   LEU   9           HG       LEU   9   1.975   2.582  10.892
   76   HD11  LEU   9          1HD1      LEU   9   0.070   4.387  11.039
   77   HD12  LEU   9          2HD1      LEU   9   1.293   4.248  12.301
   78   HD13  LEU   9          3HD1      LEU   9  -0.306   3.544  12.542
   79   HD21  LEU   9          3HD2      LEU   9   1.622   1.539  13.019
   80   HD22  LEU   9          1HD2      LEU   9   1.173   0.395  11.755
   81   HD23  LEU   9          2HD2      LEU   9  -0.079   1.255  12.651
   82    H    GLU  10           H        GLU  10   2.984   1.400   9.418
   83    HA   GLU  10           HA       GLU  10   4.293   3.785  10.139
   84    HB2  GLU  10           2HB      GLU  10   6.205   2.455  10.529
   85    HB3  GLU  10           1HB      GLU  10   4.833   1.417  10.897
   86    HG2  GLU  10           2HG      GLU  10   5.354  -0.032   9.288
   87    HG3  GLU  10           1HG      GLU  10   5.683   1.244   8.116
   88    H    VAL  11           H        VAL  11   4.158   1.944   7.193
   89    HA   VAL  11           HA       VAL  11   6.313   3.026   5.834
   90    HB   VAL  11           HB       VAL  11   3.841   1.679   5.040
   91   HG11  VAL  11          1HG1      VAL  11   5.036   2.093   2.611
   92   HG12  VAL  11          2HG1      VAL  11   5.136   3.678   3.372
   93   HG13  VAL  11          3HG1      VAL  11   3.570   2.888   3.180
   94   HG21  VAL  11          3HG2      VAL  11   6.309   0.955   3.709
   95   HG22  VAL  11          1HG2      VAL  11   5.221  -0.032   4.685
   96   HG23  VAL  11          2HG2      VAL  11   6.461   0.950   5.465
   97    H    VAL  12           H        VAL  12   2.948   4.079   5.834
   98    HA   VAL  12           HA       VAL  12   3.383   6.302   4.115
   99    HB   VAL  12           HB       VAL  12   1.169   5.828   4.055
  100   HG11  VAL  12          1HG1      VAL  12   0.743   4.080   5.417
  101   HG12  VAL  12          2HG1      VAL  12   0.005   5.322   6.429
  102   HG13  VAL  12          3HG1      VAL  12   1.646   4.769   6.764
  103   HG21  VAL  12          3HG2      VAL  12   0.597   7.408   6.467
  104   HG22  VAL  12          1HG2      VAL  12   0.091   7.659   4.796
  105   HG23  VAL  12          2HG2      VAL  12   1.698   8.168   5.317
  106    H    LYS  13           H        LYS  13   2.847   6.080   7.633
  107    HA   LYS  13           HA       LYS  13   3.076   8.770   8.252
  108    HB2  LYS  13           2HB      LYS  13   4.088   6.494   9.961
  109    HB3  LYS  13           1HB      LYS  13   3.576   8.082  10.513
  110    HG2  LYS  13           2HG      LYS  13   2.008   5.706   9.971
  111    HG3  LYS  13           1HG      LYS  13   1.597   7.153  10.904
  112    HD2  LYS  13           2HD      LYS  13   1.334   8.267   8.573
  113    HD3  LYS  13           1HD      LYS  13   1.216   6.607   7.983
  114    HE2  LYS  13           2HE      LYS  13  -0.631   6.207   9.566
  115    HE3  LYS  13           1HE      LYS  13  -0.533   7.891  10.079
  116    HZ1  LYS  13           3HZ      LYS  13  -1.615   6.756   7.624
  117    HZ2  LYS  13           1HZ      LYS  13  -0.792   8.227   7.473
  118    HZ3  LYS  13           2HZ      LYS  13  -2.122   8.105   8.509
  119    H    ASN  14           H        ASN  14   5.648   6.321   8.136
  120    HA   ASN  14           HA       ASN  14   7.707   8.263   8.620
  121    HB2  ASN  14           2HB      ASN  14   8.961   6.478   9.100
  122    HB3  ASN  14           1HB      ASN  14   7.503   5.523   8.904
  123   HD21  ASN  14          1HD2      ASN  14   7.134   4.474   6.953
  124   HD22  ASN  14          2HD2      ASN  14   8.422   4.125   5.860
  125    H    PHE  15           H        PHE  15   5.929   7.444   5.961
  126    HA   PHE  15           HA       PHE  15   8.050   7.305   4.122
  127    HB2  PHE  15           2HB      PHE  15   5.229   6.961   4.026
  128    HB3  PHE  15           1HB      PHE  15   5.657   8.136   2.787
  129    HD1  PHE  15           2HD      PHE  15   7.423   5.108   4.054
  130    HD2  PHE  15           1HD      PHE  15   5.610   7.079   0.747
  131    HE1  PHE  15           2HE      PHE  15   8.143   3.278   2.575
  132    HE2  PHE  15           1HE      PHE  15   6.326   5.252  -0.739
  133    HZ   PHE  15           HZ       PHE  15   7.594   3.349   0.174
  134    H    GLU  16           H        GLU  16   6.404   9.869   5.652
  135    HA   GLU  16           HA       GLU  16   7.409  12.045   5.678
  136    HB2  GLU  16           2HB      GLU  16   8.555  12.933   3.857
  137    HB3  GLU  16           1HB      GLU  16   8.948  11.224   3.769
  138    HG2  GLU  16           2HG      GLU  16   8.184  11.154   1.705
  139    HG3  GLU  16           1HG      GLU  16   6.590  11.643   2.273
  140    H    LYS  17           H        LYS  17   4.824  10.563   4.366
  141    HA   LYS  17           HA       LYS  17   3.507  12.557   2.899
  142    HB2  LYS  17           2HB      LYS  17   2.513  10.225   4.522
  143    HB3  LYS  17           1HB      LYS  17   1.406  11.308   3.690
  144    HG2  LYS  17           2HG      LYS  17   1.642  10.043   1.891
  145    HG3  LYS  17           1HG      LYS  17   3.308  10.612   1.776
  146    HD2  LYS  17           2HD      LYS  17   3.958   8.504   2.079
  147    HD3  LYS  17           1HD      LYS  17   3.356   8.625   3.732
  148    HE2  LYS  17           2HE      LYS  17   1.563   7.345   3.300
  149    HE3  LYS  17           1HE      LYS  17   1.281   8.103   1.733
  150    HZ1  LYS  17           3HZ      LYS  17   2.848   5.737   2.397
  151    HZ2  LYS  17           1HZ      LYS  17   3.456   6.729   1.169
  152    HZ3  LYS  17           2HZ      LYS  17   1.908   6.064   1.030
  153    H    VAL  18           H        VAL  18   3.332  11.748   6.359
  154    HA   VAL  18           HA       VAL  18   3.166  14.360   7.278
  155    HB   VAL  18           HB       VAL  18   0.517  13.774   7.937
  156   HG11  VAL  18          1HG1      VAL  18   1.876  15.938   7.253
  157   HG12  VAL  18          2HG1      VAL  18   0.117  15.875   7.145
  158   HG13  VAL  18          3HG1      VAL  18   1.098  15.638   5.699
  159   HG21  VAL  18          3HG2      VAL  18  -0.635  13.097   6.088
  160   HG22  VAL  18          1HG2      VAL  18   0.870  12.215   5.824
  161   HG23  VAL  18          2HG2      VAL  18   0.573  13.728   4.968
  162    H    ASP  19           H        ASP  19   2.529  14.500   9.572
  163    HA   ASP  19           HA       ASP  19   3.544  12.320  11.044
  164    HB2  ASP  19           2HB      ASP  19   3.335  14.910  11.600
  165    HB3  ASP  19           1HB      ASP  19   1.855  14.376  12.392
  166    H    ALA  20           H        ALA  20   2.577  10.564  11.830
  167    HA   ALA  20           HA       ALA  20  -0.036   9.843  11.175
  168    HB1  ALA  20           1HB      ALA  20   1.056   8.558  13.579
  169    HB2  ALA  20           2HB      ALA  20   2.114   8.524  12.168
  170    HB3  ALA  20           3HB      ALA  20   0.488   7.847  12.067
  171    H    SER  21           H        SER  21   1.121  11.834  13.700
  172    HA   SER  21           HA       SER  21  -0.920  11.425  15.605
  173    HB2  SER  21           2HB      SER  21   0.226  12.938  16.823
  174    HB3  SER  21           1HB      SER  21   1.416  12.883  15.523
  175    HG   SER  21           HG       SER  21   0.882  14.840  15.000
  176    H    LYS  22           H        LYS  22  -0.828  13.096  12.616
  177    HA   LYS  22           HA       LYS  22  -3.131  14.742  13.224
  178    HB2  LYS  22           2HB      LYS  22  -2.780  15.797  11.142
  179    HB3  LYS  22           1HB      LYS  22  -1.171  15.501  11.789
  180    HG2  LYS  22           2HG      LYS  22  -1.338  13.301  10.383
  181    HG3  LYS  22           1HG      LYS  22  -2.557  14.215   9.491
  182    HD2  LYS  22           2HD      LYS  22   0.366  14.569   9.616
  183    HD3  LYS  22           1HD      LYS  22  -0.764  14.906   8.303
  184    HE2  LYS  22           2HE      LYS  22  -1.523  16.916   9.535
  185    HE3  LYS  22           1HE      LYS  22  -0.290  16.597  10.754
  186    HZ1  LYS  22           3HZ      LYS  22   0.049  17.468   7.961
  187    HZ2  LYS  22           1HZ      LYS  22   1.302  16.644   8.747
  188    HZ3  LYS  22           2HZ      LYS  22   0.732  18.110   9.370
  189    H    VAL  23           H        VAL  23  -2.476  11.648  11.998
  190    HA   VAL  23           HA       VAL  23  -4.861  11.461  10.386
  191    HB   VAL  23           HB       VAL  23  -4.180   9.298   9.786
  192   HG11  VAL  23          1HG1      VAL  23  -2.302   9.840   8.687
  193   HG12  VAL  23          2HG1      VAL  23  -1.420  10.198  10.173
  194   HG13  VAL  23          3HG1      VAL  23  -2.488  11.411   9.465
  195   HG21  VAL  23          3HG2      VAL  23  -3.005   9.276  12.466
  196   HG22  VAL  23          1HG2      VAL  23  -2.012   8.492  11.238
  197   HG23  VAL  23          2HG2      VAL  23  -3.670   7.955  11.506
  198    H    THR  24           H        THR  24  -6.801  10.896  11.117
  199    HA   THR  24           HA       THR  24  -6.990   9.630  13.734
  200    HB   THR  24           HB       THR  24  -8.188  11.980  12.778
  201    HG1  THR  24           1HG      THR  24  -9.102  11.980  14.846
  202   HG21  THR  24          3HG2      THR  24  -9.888  10.344  11.771
  203   HG22  THR  24          1HG2      THR  24 -10.483  11.681  12.755
  204   HG23  THR  24          2HG2      THR  24 -10.380  10.060  13.440
  205    HA   PRO  25           HA       PRO  25  -9.122   6.080  12.270
  206    HB2  PRO  25           2HB      PRO  25 -11.581   6.181  13.539
  207    HB3  PRO  25           1HB      PRO  25 -10.093   5.566  14.264
  208    HG2  PRO  25           2HG      PRO  25 -11.375   8.250  14.551
  209    HG3  PRO  25           1HG      PRO  25 -10.567   7.255  15.776
  210    HD2  PRO  25           2HD      PRO  25  -9.349   9.368  14.663
  211    HD3  PRO  25           1HD      PRO  25  -8.448   7.893  15.075
  212    H    GLU  26           H        GLU  26 -11.095   9.013  12.240
  213    HA   GLU  26           HA       GLU  26 -12.522   8.014   9.897
  214    HB2  GLU  26           2HB      GLU  26 -13.868   8.813  11.838
  215    HB3  GLU  26           1HB      GLU  26 -13.177  10.413  11.608
  216    HG2  GLU  26           2HG      GLU  26 -14.540   9.101   9.314
  217    HG3  GLU  26           1HG      GLU  26 -15.517   9.786  10.613
  218    H    SER  27           H        SER  27  -9.764   9.441  10.316
  219    HA   SER  27           HA       SER  27  -9.915  11.894   8.936
  220    HB2  SER  27           2HB      SER  27  -7.885  11.873   9.926
  221    HB3  SER  27           1HB      SER  27  -7.799  10.112   9.915
  222    HG   SER  27           HG       SER  27  -7.475  11.606   7.545
  223    H    HIS  28           H        HIS  28  -9.955  12.378   6.829
  224    HA   HIS  28           HA       HIS  28 -10.312  10.270   4.927
  225    HB2  HIS  28           2HB      HIS  28 -10.137  13.227   4.360
  226    HB3  HIS  28           1HB      HIS  28 -10.897  11.989   3.365
  227    HD1  HIS  28           1HD      HIS  28 -13.353  11.934   3.567
  228    HD2  HIS  28           2HD      HIS  28 -11.558  13.370   7.030
  229    HE1  HIS  28           1HE      HIS  28 -15.248  12.537   5.107
  230    HE2  HIS  28           2HE      HIS  28 -14.138  13.485   7.162
  231    H    PHE  29           H        PHE  29  -9.035   9.886   3.075
  232    HA   PHE  29           HA       PHE  29  -6.249  10.078   3.501
  233    HB2  PHE  29           2HB      PHE  29  -7.366   8.244   2.233
  234    HB3  PHE  29           1HB      PHE  29  -7.675   9.388   0.932
  235    HD1  PHE  29           2HD      PHE  29  -5.418  10.758   0.274
  236    HD2  PHE  29           1HD      PHE  29  -5.603   6.831   1.902
  237    HE1  PHE  29           2HE      PHE  29  -3.210  10.259  -0.690
  238    HE2  PHE  29           1HE      PHE  29  -3.394   6.325   0.941
  239    HZ   PHE  29           HZ       PHE  29  -2.196   8.040  -0.358
  240    H    VAL  30           H        VAL  30  -7.683  11.050   0.459
  241    HA   VAL  30           HA       VAL  30  -5.771  13.080   0.038
  242    HB   VAL  30           HB       VAL  30  -7.709  13.713  -1.751
  243   HG11  VAL  30          1HG1      VAL  30  -6.468  12.375  -3.343
  244   HG12  VAL  30          2HG1      VAL  30  -5.747  11.439  -2.034
  245   HG13  VAL  30          3HG1      VAL  30  -5.356  13.149  -2.215
  246   HG21  VAL  30          3HG2      VAL  30  -9.035  11.788  -0.632
  247   HG22  VAL  30          1HG2      VAL  30  -7.956  10.737  -1.549
  248   HG23  VAL  30          2HG2      VAL  30  -8.991  11.890  -2.392
  249    H    LYS  31           H        LYS  31  -8.988  13.070   1.315
  250    HA   LYS  31           HA       LYS  31  -9.428  15.866   1.152
  251    HB2  LYS  31           2HB      LYS  31 -10.840  14.378   3.269
  252    HB3  LYS  31           1HB      LYS  31 -11.477  15.429   2.010
  253    HG2  LYS  31           2HG      LYS  31 -10.659  12.547   1.729
  254    HG3  LYS  31           1HG      LYS  31 -12.292  13.212   1.650
  255    HD2  LYS  31           2HD      LYS  31 -10.723  14.609  -0.242
  256    HD3  LYS  31           1HD      LYS  31 -10.383  12.890  -0.448
  257    HE2  LYS  31           2HE      LYS  31 -12.261  13.652  -1.845
  258    HE3  LYS  31           1HE      LYS  31 -12.742  12.416  -0.684
  259    HZ1  LYS  31           3HZ      LYS  31 -14.365  13.835  -0.171
  260    HZ2  LYS  31           1HZ      LYS  31 -13.603  15.152  -0.910
  261    HZ3  LYS  31           2HZ      LYS  31 -13.186  14.710   0.668
  262    H    ASP  32           H        ASP  32  -7.636  13.898   3.323
  263    HA   ASP  32           HA       ASP  32  -7.699  15.888   5.419
  264    HB2  ASP  32           2HB      ASP  32  -7.864  13.481   5.992
  265    HB3  ASP  32           1HB      ASP  32  -6.234  13.253   5.366
  266    H    LEU  33           H        LEU  33  -6.019  15.572   2.633
  267    HA   LEU  33           HA       LEU  33  -4.254  17.550   2.892
  268    HB2  LEU  33           2HB      LEU  33  -2.765  17.063   4.459
  269    HB3  LEU  33           1HB      LEU  33  -3.463  15.470   4.674
  270    HG   LEU  33           HG       LEU  33  -1.643  15.849   2.357
  271   HD11  LEU  33          1HD1      LEU  33   0.341  15.709   3.616
  272   HD12  LEU  33          2HD1      LEU  33  -0.538  15.424   5.118
  273   HD13  LEU  33          3HD1      LEU  33  -0.597  17.011   4.349
  274   HD21  LEU  33          3HD2      LEU  33  -2.613  13.702   2.610
  275   HD22  LEU  33          1HD2      LEU  33  -2.234  13.658   4.333
  276   HD23  LEU  33          2HD2      LEU  33  -0.937  13.561   3.142
  277    H    GLY  34           H        GLY  34  -4.957  14.456   1.618
  278    HA2  GLY  34           2HA      GLY  34  -4.479  13.478  -0.410
  279    HA3  GLY  34           1HA      GLY  34  -4.174  15.110  -0.984
  280    H    LEU  35           H        LEU  35  -2.808  12.114  -0.110
  281    HA   LEU  35           HA       LEU  35  -0.146  12.913   0.382
  282    HB2  LEU  35           2HB      LEU  35  -1.359  10.322  -0.549
  283    HB3  LEU  35           1HB      LEU  35   0.366  10.508  -0.294
  284    HG   LEU  35           HG       LEU  35   0.000  10.993   2.064
  285   HD11  LEU  35          1HD1      LEU  35  -1.999  12.096   2.296
  286   HD12  LEU  35          2HD1      LEU  35  -2.436  10.484   2.861
  287   HD13  LEU  35          3HD1      LEU  35  -2.860  10.989   1.225
  288   HD21  LEU  35          3HD2      LEU  35  -0.123   8.821   2.607
  289   HD22  LEU  35          1HD2      LEU  35  -0.224   8.559   0.866
  290   HD23  LEU  35          2HD2      LEU  35  -1.696   8.615   1.836
  291    H    ASN  36           H        ASN  36   1.707  12.630  -0.998
  292    HA   ASN  36           HA       ASN  36   1.406  13.832  -3.524
  293    HB2  ASN  36           2HB      ASN  36   3.501  13.324  -1.796
  294    HB3  ASN  36           1HB      ASN  36   3.880  12.307  -3.177
  295   HD21  ASN  36          1HD2      ASN  36   2.428  14.225  -4.936
  296   HD22  ASN  36          2HD2      ASN  36   3.528  15.533  -5.173
  297    H    SER  37           H        SER  37   1.315  12.997  -5.578
  298    HA   SER  37           HA       SER  37   0.254  10.481  -6.021
  299    HB2  SER  37           2HB      SER  37   1.935  11.906  -8.076
  300    HB3  SER  37           1HB      SER  37   0.517  10.892  -8.338
  301    H    LEU  38           H        LEU  38   3.583  11.554  -6.074
  302    HA   LEU  38           HA       LEU  38   4.664   9.058  -6.934
  303    HB2  LEU  38           2HB      LEU  38   6.792  10.017  -6.593
  304    HB3  LEU  38           1HB      LEU  38   5.766  11.319  -7.163
  305    HG   LEU  38           HG       LEU  38   7.279  12.032  -5.359
  306   HD11  LEU  38          1HD1      LEU  38   5.254  13.264  -5.630
  307   HD12  LEU  38          2HD1      LEU  38   5.544  13.057  -3.903
  308   HD13  LEU  38          3HD1      LEU  38   4.342  12.060  -4.721
  309   HD21  LEU  38          3HD2      LEU  38   6.754   9.611  -4.214
  310   HD22  LEU  38          1HD2      LEU  38   5.786  10.708  -3.227
  311   HD23  LEU  38          2HD2      LEU  38   7.519  10.978  -3.405
  312    H    ASP  39           H        ASP  39   3.788  10.466  -3.905
  313    HA   ASP  39           HA       ASP  39   5.250   8.617  -2.284
  314    HB2  ASP  39           2HB      ASP  39   4.714  10.816  -1.398
  315    HB3  ASP  39           1HB      ASP  39   2.992  10.507  -1.601
  316    H    VAL  40           H        VAL  40   2.008   8.857  -3.554
  317    HA   VAL  40           HA       VAL  40   0.934   6.699  -2.047
  318    HB   VAL  40           HB       VAL  40  -0.278   8.630  -3.393
  319   HG11  VAL  40          1HG1      VAL  40   0.595   6.977  -5.482
  320   HG12  VAL  40          2HG1      VAL  40  -0.525   8.335  -5.581
  321   HG13  VAL  40          3HG1      VAL  40  -1.140   6.701  -5.336
  322   HG21  VAL  40          3HG2      VAL  40  -1.917   7.625  -2.278
  323   HG22  VAL  40          1HG2      VAL  40  -1.044   6.092  -2.283
  324   HG23  VAL  40          2HG2      VAL  40  -2.098   6.514  -3.634
  325    H    VAL  41           H        VAL  41   2.606   6.977  -5.104
  326    HA   VAL  41           HA       VAL  41   1.932   4.415  -6.104
  327    HB   VAL  41           HB       VAL  41   2.739   5.787  -7.779
  328   HG11  VAL  41          1HG1      VAL  41   4.767   7.151  -7.622
  329   HG12  VAL  41          2HG1      VAL  41   5.036   6.556  -5.983
  330   HG13  VAL  41          3HG1      VAL  41   3.621   7.545  -6.342
  331   HG21  VAL  41          3HG2      VAL  41   5.421   4.802  -7.625
  332   HG22  VAL  41          1HG2      VAL  41   4.107   4.290  -8.681
  333   HG23  VAL  41          2HG2      VAL  41   4.300   3.550  -7.092
  334    H    GLU  42           H        GLU  42   4.742   5.660  -4.325
  335    HA   GLU  42           HA       GLU  42   6.165   3.241  -4.234
  336    HB2  GLU  42           2HB      GLU  42   6.206   5.712  -2.524
  337    HB3  GLU  42           1HB      GLU  42   7.235   4.332  -2.160
  338    HG2  GLU  42           2HG      GLU  42   7.811   4.650  -4.758
  339    HG3  GLU  42           1HG      GLU  42   7.414   6.314  -4.331
  340    H    VAL  43           H        VAL  43   3.847   4.694  -2.037
  341    HA   VAL  43           HA       VAL  43   3.969   2.746  -0.013
  342    HB   VAL  43           HB       VAL  43   2.876   4.657   0.700
  343   HG11  VAL  43          1HG1      VAL  43   1.998   6.121  -0.715
  344   HG12  VAL  43          2HG1      VAL  43   0.702   4.996  -1.121
  345   HG13  VAL  43          3HG1      VAL  43   2.221   4.949  -2.014
  346   HG21  VAL  43          3HG2      VAL  43   1.575   2.449   1.049
  347   HG22  VAL  43          1HG2      VAL  43   0.434   3.165  -0.084
  348   HG23  VAL  43          2HG2      VAL  43   0.794   3.985   1.432
  349    H    VAL  44           H        VAL  44   1.636   3.194  -2.624
  350    HA   VAL  44           HA       VAL  44   0.135   0.877  -2.197
  351    HB   VAL  44           HB       VAL  44  -0.597   1.075  -4.525
  352   HG11  VAL  44          1HG1      VAL  44  -0.845   3.034  -2.530
  353   HG12  VAL  44          2HG1      VAL  44  -1.937   2.721  -3.879
  354   HG13  VAL  44          3HG1      VAL  44  -0.635   3.899  -4.052
  355   HG21  VAL  44          3HG2      VAL  44   0.371   2.979  -5.888
  356   HG22  VAL  44          1HG2      VAL  44   1.393   1.553  -5.702
  357   HG23  VAL  44          2HG2      VAL  44   1.707   2.995  -4.736
  358    H    PHE  45           H        PHE  45   3.206   1.427  -3.682
  359    HA   PHE  45           HA       PHE  45   3.391  -1.107  -4.988
  360    HB2  PHE  45           2HB      PHE  45   4.867   1.318  -4.943
  361    HB3  PHE  45           1HB      PHE  45   5.966   0.027  -4.466
  362    HD1  PHE  45           1HD      PHE  45   6.257  -1.931  -5.962
  363    HD2  PHE  45           2HD      PHE  45   4.179   1.576  -7.177
  364    HE1  PHE  45           1HE      PHE  45   6.533  -2.592  -8.320
  365    HE2  PHE  45           2HE      PHE  45   4.449   0.925  -9.538
  366    HZ   PHE  45           HZ       PHE  45   5.627  -1.162 -10.111
  367    H    ALA  46           H        ALA  46   4.116   0.210  -1.886
  368    HA   ALA  46           HA       ALA  46   5.834  -1.848  -0.970
  369    HB1  ALA  46           1HB      ALA  46   4.729  -0.789   1.300
  370    HB2  ALA  46           2HB      ALA  46   4.586   0.535   0.143
  371    HB3  ALA  46           3HB      ALA  46   6.164  -0.177   0.477
  372    H    ILE  47           H        ILE  47   2.475  -1.074  -0.210
  373    HA   ILE  47           HA       ILE  47   1.890  -3.393   1.239
  374    HB   ILE  47           HB       ILE  47  -0.527  -2.808   0.167
  375   HG12  ILE  47          2HG1      ILE  47   0.973  -0.947  -1.089
  376   HG13  ILE  47          1HG1      ILE  47  -0.719  -0.701  -0.670
  377   HG21  ILE  47          1HG2      ILE  47   0.598  -1.026   2.291
  378   HG22  ILE  47          2HG2      ILE  47   0.403  -2.754   2.574
  379   HG23  ILE  47          3HG2      ILE  47  -1.000  -1.762   2.183
  380   HD11  ILE  47          3HD1      ILE  47  -0.119   0.535   1.283
  381   HD12  ILE  47          1HD1      ILE  47   0.768   1.195  -0.092
  382   HD13  ILE  47          2HD1      ILE  47   1.587   0.144   1.064
  383    H    GLU  48           H        GLU  48   1.739  -2.692  -2.209
  384    HA   GLU  48           HA       GLU  48   0.352  -4.929  -3.093
  385    HB2  GLU  48           2HB      GLU  48   1.321  -2.846  -4.374
  386    HB3  GLU  48           1HB      GLU  48   2.694  -3.909  -4.649
  387    HG2  GLU  48           2HG      GLU  48  -0.039  -4.904  -5.271
  388    HG3  GLU  48           1HG      GLU  48   0.724  -3.753  -6.368
  389    H    GLN  49           H        GLN  49   3.688  -4.535  -2.168
  390    HA   GLN  49           HA       GLN  49   4.616  -7.047  -3.084
  391    HB2  GLN  49           2HB      GLN  49   5.646  -4.841  -1.446
  392    HB3  GLN  49           1HB      GLN  49   6.265  -6.420  -0.979
  393    HG2  GLN  49           2HG      GLN  49   7.812  -5.627  -2.522
  394    HG3  GLN  49           1HG      GLN  49   6.810  -6.744  -3.448
  395   HE21  GLN  49          1HE2      GLN  49   4.746  -5.509  -4.315
  396   HE22  GLN  49          2HE2      GLN  49   5.115  -4.062  -5.182
  397    H    GLU  50           H        GLU  50   3.366  -5.911   0.033
  398    HA   GLU  50           HA       GLU  50   3.406  -8.655   0.999
  399    HB2  GLU  50           2HB      GLU  50   3.702  -7.884   3.113
  400    HB3  GLU  50           1HB      GLU  50   4.354  -6.497   2.253
  401    HG2  GLU  50           2HG      GLU  50   1.719  -5.860   2.359
  402    HG3  GLU  50           1HG      GLU  50   1.927  -6.746   3.870
  403    H    PHE  51           H        PHE  51   1.422  -7.812  -0.880
  404    HA   PHE  51           HA       PHE  51  -0.941  -8.367   0.705
  405    HB2  PHE  51           2HB      PHE  51  -0.458  -5.917  -0.841
  406    HB3  PHE  51           1HB      PHE  51  -2.014  -6.679  -1.141
  407    HD1  PHE  51           2HD      PHE  51  -3.380  -7.332   0.976
  408    HD2  PHE  51           1HD      PHE  51  -0.236  -4.463   0.935
  409    HE1  PHE  51           2HE      PHE  51  -4.284  -6.318   3.027
  410    HE2  PHE  51           1HE      PHE  51  -1.134  -3.445   2.987
  411    HZ   PHE  51           HZ       PHE  51  -3.161  -4.372   4.035
  412    H    ILE  52           H        ILE  52   0.824  -8.735  -2.226
  413    HA   ILE  52           HA       ILE  52   0.564 -10.140  -3.995
  414    HB   ILE  52           HB       ILE  52  -1.860 -11.370  -2.742
  415   HG12  ILE  52          2HG1      ILE  52   0.436 -12.760  -1.838
  416   HG13  ILE  52          1HG1      ILE  52   0.669 -11.060  -1.448
  417   HG21  ILE  52          1HG2      ILE  52  -1.334 -13.221  -3.970
  418   HG22  ILE  52          2HG2      ILE  52   0.397 -12.886  -3.938
  419   HG23  ILE  52          3HG2      ILE  52  -0.659 -11.970  -5.013
  420   HD11  ILE  52          3HD1      ILE  52  -1.728 -12.706  -0.687
  421   HD12  ILE  52          1HD1      ILE  52  -1.441 -11.020  -0.259
  422   HD13  ILE  52          2HD1      ILE  52  -0.386 -12.282   0.378
  423    H    LEU  53           H        LEU  53  -0.809  -7.579  -3.847
  424    HA   LEU  53           HA       LEU  53  -2.378  -7.780  -6.185
  425    HB2  LEU  53           2HB      LEU  53  -3.980  -8.653  -4.455
  426    HB3  LEU  53           1HB      LEU  53  -3.926  -7.073  -3.696
  427    HG   LEU  53           HG       LEU  53  -5.191  -6.081  -5.330
  428   HD11  LEU  53          1HD1      LEU  53  -5.420  -7.410  -7.621
  429   HD12  LEU  53          2HD1      LEU  53  -3.834  -8.003  -7.128
  430   HD13  LEU  53          3HD1      LEU  53  -4.109  -6.271  -7.315
  431   HD21  LEU  53          3HD2      LEU  53  -6.038  -8.972  -5.500
  432   HD22  LEU  53          1HD2      LEU  53  -7.019  -7.582  -5.964
  433   HD23  LEU  53          2HD2      LEU  53  -6.549  -7.806  -4.279
  434    H    ASP  54           H        ASP  54  -2.417  -5.845  -7.202
  435    HA   ASP  54           HA       ASP  54  -1.049  -3.658  -5.966
  436    HB2  ASP  54           2HB      ASP  54  -1.044  -2.635  -8.115
  437    HB3  ASP  54           1HB      ASP  54  -0.786  -4.356  -8.383
  438    H    ILE  55           H        ILE  55  -1.851  -1.659  -5.427
  439    HA   ILE  55           HA       ILE  55  -4.745  -1.518  -5.108
  440    HB   ILE  55           HB       ILE  55  -2.489  -0.100  -3.722
  441   HG12  ILE  55          2HG1      ILE  55  -4.751  -1.875  -2.782
  442   HG13  ILE  55          1HG1      ILE  55  -3.042  -2.293  -2.846
  443   HG21  ILE  55          1HG2      ILE  55  -5.124   0.914  -4.250
  444   HG22  ILE  55          2HG2      ILE  55  -3.769   1.689  -3.430
  445   HG23  ILE  55          3HG2      ILE  55  -4.890   0.680  -2.518
  446   HD11  ILE  55          3HD1      ILE  55  -4.529  -0.659  -0.887
  447   HD12  ILE  55          1HD1      ILE  55  -2.878  -0.165  -1.262
  448   HD13  ILE  55          2HD1      ILE  55  -3.195  -1.789  -0.650
  449    HA   PRO  56           HA       PRO  56  -2.933   2.638  -7.285
  450    HB2  PRO  56           2HB      PRO  56  -1.753   0.897  -9.408
  451    HB3  PRO  56           1HB      PRO  56  -1.222   2.481  -8.828
  452    HG2  PRO  56           2HG      PRO  56   0.053   0.269  -8.078
  453    HG3  PRO  56           1HG      PRO  56  -0.214   1.598  -6.935
  454    HD2  PRO  56           2HD      PRO  56  -1.570  -1.045  -7.117
  455    HD3  PRO  56           1HD      PRO  56  -1.220  -0.049  -5.691
  456    H    ASP  57           H        ASP  57  -3.272   2.973  -9.929
  457    HA   ASP  57           HA       ASP  57  -4.804   3.046 -11.610
  458    HB2  ASP  57           2HB      ASP  57  -5.246   0.269 -10.560
  459    HB3  ASP  57           1HB      ASP  57  -6.318   0.926 -11.793
  460    H    HIS  58           H        HIS  58  -7.315   2.803 -11.983
  461    HA   HIS  58           HA       HIS  58  -8.683   4.624 -10.580
  462    HB2  HIS  58           2HB      HIS  58 -10.573   2.542 -11.006
  463    HB3  HIS  58           1HB      HIS  58 -10.292   3.976 -11.988
  464    HD1  HIS  58           1HD      HIS  58  -9.835   0.322 -11.946
  465    HD2  HIS  58           2HD      HIS  58  -8.490   3.554 -14.185
  466    HE1  HIS  58           1HE      HIS  58  -8.864  -0.670 -14.043
  467    HE2  HIS  58           2HE      HIS  58  -7.981   1.299 -15.343
  468    H    ASP  59           H        ASP  59  -7.844   1.469  -9.441
  469    HA   ASP  59           HA       ASP  59  -9.716   1.257  -7.339
  470    HB2  ASP  59           2HB      ASP  59  -7.268  -0.138  -8.183
  471    HB3  ASP  59           1HB      ASP  59  -7.563  -0.177  -6.447
  472    H    ALA  60           H        ALA  60  -6.392   2.491  -7.464
  473    HA   ALA  60           HA       ALA  60  -6.259   3.125  -4.702
  474    HB1  ALA  60           1HB      ALA  60  -4.600   4.317  -6.913
  475    HB2  ALA  60           2HB      ALA  60  -4.285   2.743  -6.183
  476    HB3  ALA  60           3HB      ALA  60  -4.188   4.205  -5.202
  477    H    GLU  61           H        GLU  61  -7.534   4.725  -7.472
  478    HA   GLU  61           HA       GLU  61  -7.586   7.335  -6.257
  479    HB2  GLU  61           2HB      GLU  61  -8.905   6.330  -8.783
  480    HB3  GLU  61           1HB      GLU  61  -8.802   8.013  -8.284
  481    HG2  GLU  61           2HG      GLU  61  -6.222   6.648  -8.398
  482    HG3  GLU  61           1HG      GLU  61  -7.058   6.748  -9.947
  483    H    LYS  62           H        LYS  62  -9.634   4.569  -6.444
  484    HA   LYS  62           HA       LYS  62 -12.093   5.892  -5.892
  485    HB2  LYS  62           2HB      LYS  62 -11.179   3.038  -5.834
  486    HB3  LYS  62           1HB      LYS  62 -12.750   3.477  -5.180
  487    HG2  LYS  62           2HG      LYS  62 -11.832   3.333  -7.968
  488    HG3  LYS  62           1HG      LYS  62 -13.431   3.049  -7.278
  489    HD2  LYS  62           2HD      LYS  62 -13.849   5.412  -7.135
  490    HD3  LYS  62           1HD      LYS  62 -12.197   5.777  -7.637
  491    HE2  LYS  62           2HE      LYS  62 -13.892   6.030  -9.446
  492    HE3  LYS  62           1HE      LYS  62 -12.595   4.896  -9.823
  493    HZ1  LYS  62           3HZ      LYS  62 -15.420   4.422  -9.529
  494    HZ2  LYS  62           1HZ      LYS  62 -14.458   3.305  -8.696
  495    HZ3  LYS  62           2HZ      LYS  62 -14.253   3.524 -10.361
  496    H    ILE  63           H        ILE  63  -9.501   5.914  -4.062
  497    HA   ILE  63           HA       ILE  63 -10.889   5.387  -1.544
  498    HB   ILE  63           HB       ILE  63  -8.404   4.550  -2.320
  499   HG12  ILE  63          2HG1      ILE  63  -8.511   4.892   0.556
  500   HG13  ILE  63          1HG1      ILE  63 -10.073   4.380  -0.077
  501   HG21  ILE  63          1HG2      ILE  63  -7.650   6.940  -2.157
  502   HG22  ILE  63          2HG2      ILE  63  -6.730   5.794  -1.182
  503   HG23  ILE  63          3HG2      ILE  63  -7.933   6.836  -0.419
  504   HD11  ILE  63          3HD1      ILE  63  -7.539   2.917   0.120
  505   HD12  ILE  63          1HD1      ILE  63  -8.431   2.686  -1.383
  506   HD13  ILE  63          2HD1      ILE  63  -9.203   2.331   0.163
  507    H    GLN  64           H        GLN  64 -11.595   7.074  -0.417
  508    HA   GLN  64           HA       GLN  64 -10.319   9.661  -0.835
  509    HB2  GLN  64           2HB      GLN  64 -13.206   9.126  -0.141
  510    HB3  GLN  64           1HB      GLN  64 -12.482  10.713  -0.360
  511    HG2  GLN  64           2HG      GLN  64 -13.243  10.547  -2.447
  512    HG3  GLN  64           1HG      GLN  64 -11.847   9.502  -2.708
  513   HE21  GLN  64          1HE2      GLN  64 -12.199   7.176  -2.318
  514   HE22  GLN  64          2HE2      GLN  64 -13.729   6.500  -2.751
  515    H    SER  65           H        SER  65 -11.310   7.283   1.427
  516    HA   SER  65           HA       SER  65 -10.454   9.035   3.635
  517    HB2  SER  65           2HB      SER  65 -12.303   6.751   4.167
  518    HB3  SER  65           1HB      SER  65 -12.148   8.290   5.012
  519    HG   SER  65           HG       SER  65 -13.223   7.977   2.404
  520    H    ILE  66           H        ILE  66  -9.276   8.064   5.328
  521    HA   ILE  66           HA       ILE  66  -7.417   6.113   4.514
  522    HB   ILE  66           HB       ILE  66  -7.967   6.792   7.391
  523   HG12  ILE  66          2HG1      ILE  66  -7.763   8.788   5.655
  524   HG13  ILE  66          1HG1      ILE  66  -6.972   8.858   7.225
  525   HG21  ILE  66          1HG2      ILE  66  -5.855   5.464   5.895
  526   HG22  ILE  66          2HG2      ILE  66  -6.224   5.419   7.619
  527   HG23  ILE  66          3HG2      ILE  66  -5.253   6.734   6.960
  528   HD11  ILE  66          3HD1      ILE  66  -4.885   8.098   6.183
  529   HD12  ILE  66          1HD1      ILE  66  -5.474   9.610   5.492
  530   HD13  ILE  66          2HD1      ILE  66  -5.689   8.095   4.613
  531    HA   PRO  67           HA       PRO  67 -10.251   3.415   7.623
  532    HB2  PRO  67           2HB      PRO  67 -12.744   4.298   6.243
  533    HB3  PRO  67           1HB      PRO  67 -12.490   3.856   7.936
  534    HG2  PRO  67           2HG      PRO  67 -12.741   6.409   7.225
  535    HG3  PRO  67           1HG      PRO  67 -11.584   5.921   8.478
  536    HD2  PRO  67           2HD      PRO  67 -11.091   6.711   5.645
  537    HD3  PRO  67           1HD      PRO  67 -10.100   7.000   7.088
  538    H    ASP  68           H        ASP  68 -12.064   3.955   4.610
  539    HA   ASP  68           HA       ASP  68 -12.275   1.288   3.890
  540    HB2  ASP  68           2HB      ASP  68 -12.871   3.828   2.704
  541    HB3  ASP  68           1HB      ASP  68 -12.128   2.792   1.489
  542    H    ALA  69           H        ALA  69  -9.545   3.325   3.780
  543    HA   ALA  69           HA       ALA  69  -8.132   2.153   1.638
  544    HB1  ALA  69           1HB      ALA  69  -7.594   4.351   2.657
  545    HB2  ALA  69           2HB      ALA  69  -6.199   3.286   2.490
  546    HB3  ALA  69           3HB      ALA  69  -6.964   3.496   4.065
  547    H    VAL  70           H        VAL  70  -6.856   1.985   4.891
  548    HA   VAL  70           HA       VAL  70  -5.643  -0.525   4.477
  549    HB   VAL  70           HB       VAL  70  -4.792   1.112   6.108
  550   HG11  VAL  70          1HG1      VAL  70  -7.438   1.180   6.985
  551   HG12  VAL  70          2HG1      VAL  70  -6.057   2.013   7.698
  552   HG13  VAL  70          3HG1      VAL  70  -6.535   0.427   8.299
  553   HG21  VAL  70          3HG2      VAL  70  -3.786  -0.549   7.204
  554   HG22  VAL  70          1HG2      VAL  70  -4.874  -1.644   6.352
  555   HG23  VAL  70          2HG2      VAL  70  -5.293  -1.061   7.963
  556    H    GLU  71           H        GLU  71  -8.816   0.349   5.346
  557    HA   GLU  71           HA       GLU  71  -9.500  -1.948   6.866
  558    HB2  GLU  71           2HB      GLU  71 -11.170   0.082   5.388
  559    HB3  GLU  71           1HB      GLU  71 -11.867  -1.231   6.326
  560    HG2  GLU  71           2HG      GLU  71  -9.964   0.784   7.485
  561    HG3  GLU  71           1HG      GLU  71 -11.715   0.991   7.484
  562    H    TYR  72           H        TYR  72  -9.851  -1.058   3.455
  563    HA   TYR  72           HA       TYR  72 -11.241  -3.385   2.683
  564    HB2  TYR  72           2HB      TYR  72 -11.393  -2.308   0.730
  565    HB3  TYR  72           1HB      TYR  72 -10.436  -1.015   1.444
  566    HD1  TYR  72           1HD      TYR  72  -8.031  -0.859   1.003
  567    HD2  TYR  72           2HD      TYR  72 -10.419  -3.861  -0.836
  568    HE1  TYR  72           1HE      TYR  72  -6.235  -1.282  -0.621
  569    HE2  TYR  72           2HE      TYR  72  -8.629  -4.293  -2.467
  570    HH   TYR  72           HH       TYR  72  -5.653  -3.615  -2.154
  571    H    ILE  73           H        ILE  73  -7.830  -2.500   2.454
  572    HA   ILE  73           HA       ILE  73  -6.991  -4.951   1.331
  573    HB   ILE  73           HB       ILE  73  -4.706  -4.186   2.375
  574   HG12  ILE  73          2HG1      ILE  73  -6.442  -2.249   3.438
  575   HG13  ILE  73          1HG1      ILE  73  -4.683  -2.249   3.492
  576   HG21  ILE  73          1HG2      ILE  73  -6.111  -3.644  -0.031
  577   HG22  ILE  73          2HG2      ILE  73  -4.372  -3.776   0.227
  578   HG23  ILE  73          3HG2      ILE  73  -5.172  -2.215   0.396
  579   HD11  ILE  73          3HD1      ILE  73  -5.660  -0.152   2.633
  580   HD12  ILE  73          1HD1      ILE  73  -6.313  -1.055   1.267
  581   HD13  ILE  73          2HD1      ILE  73  -4.568  -0.938   1.492
  582    H    ALA  74           H        ALA  74  -7.430  -3.841   4.598
  583    HA   ALA  74           HA       ALA  74  -6.011  -5.885   5.914
  584    HB1  ALA  74           1HB      ALA  74  -6.646  -3.813   7.033
  585    HB2  ALA  74           2HB      ALA  74  -7.250  -5.219   7.910
  586    HB3  ALA  74           3HB      ALA  74  -8.346  -4.265   6.911
  587    H    GLN  75           H        GLN  75  -9.434  -5.534   5.149
  588    HA   GLN  75           HA       GLN  75 -10.087  -8.141   6.117
  589    HB2  GLN  75           2HB      GLN  75 -11.532  -5.812   5.135
  590    HB3  GLN  75           1HB      GLN  75 -12.221  -7.325   4.567
  591    HG2  GLN  75           2HG      GLN  75 -13.302  -7.427   6.494
  592    HG3  GLN  75           1HG      GLN  75 -11.752  -7.775   7.253
  593   HE21  GLN  75          1HE2      GLN  75 -10.792  -5.074   6.543
  594   HE22  GLN  75          2HE2      GLN  75 -11.510  -4.024   7.707
  595    H    ASN  76           H        ASN  76 -10.958  -6.861   2.957
  596    HA   ASN  76           HA       ASN  76 -11.320  -8.988   1.468
  597    HB2  ASN  76           2HB      ASN  76  -9.911  -6.461   0.885
  598    HB3  ASN  76           1HB      ASN  76  -9.602  -7.764  -0.258
  599   HD21  ASN  76          1HD2      ASN  76 -11.414  -5.159   0.172
  600   HD22  ASN  76          2HD2      ASN  76 -12.854  -5.620  -0.666
  601    HA   PRO  77           HA       PRO  77  -6.674 -10.189   0.671
  602    HB2  PRO  77           2HB      PRO  77  -5.347  -8.427   2.668
  603    HB3  PRO  77           1HB      PRO  77  -4.816  -8.892   1.049
  604    HG2  PRO  77           2HG      PRO  77  -5.777  -6.455   1.502
  605    HG3  PRO  77           1HG      PRO  77  -6.174  -7.323   0.009
  606    HD2  PRO  77           2HD      PRO  77  -7.851  -6.886   2.448
  607    HD3  PRO  77           1HD      PRO  77  -8.319  -6.884   0.736
  608    H    MET  78           H        MET  78  -7.607  -9.177   3.950
  609    HA   MET  78           HA       MET  78  -6.173 -11.021   5.436
  610    HB2  MET  78           2HB      MET  78  -7.223  -9.593   6.852
  611    HB3  MET  78           1HB      MET  78  -8.651  -9.465   5.834
  612    HG2  MET  78           2HG      MET  78  -9.466 -11.587   6.646
  613    HG3  MET  78           1HG      MET  78  -7.999 -11.815   7.596
  614    HE1  MET  78           3HE      MET  78  -8.509 -11.945   9.920
  615    HE2  MET  78           1HE      MET  78 -10.197 -12.272   9.525
  616    HE3  MET  78           2HE      MET  78  -9.796 -11.093  10.774
  617    H    ALA  79           H        ALA  79  -8.755 -11.583   3.269
  618    HA   ALA  79           HA       ALA  79  -8.745 -14.389   4.000
  619    HB1  ALA  79           1HB      ALA  79 -11.187 -12.665   3.803
  620    HB2  ALA  79           2HB      ALA  79 -10.691 -13.726   5.121
  621    HB3  ALA  79           3HB      ALA  79 -11.262 -14.415   3.600
  622    H    LYS  80           H        LYS  80  -7.873 -12.465   1.743
  623    HA   LYS  80           HA       LYS  80  -8.745 -12.380  -0.611
  624    HB2  LYS  80           2HB      LYS  80  -6.436 -14.246  -0.047
  625    HB3  LYS  80           1HB      LYS  80  -6.826 -13.603  -1.637
  626    HG2  LYS  80           2HG      LYS  80  -6.332 -11.382  -0.951
  627    HG3  LYS  80           1HG      LYS  80  -6.209 -11.869   0.741
  628    HD2  LYS  80           2HD      LYS  80  -4.248 -13.222   0.221
  629    HD3  LYS  80           1HD      LYS  80  -4.381 -12.778  -1.482
  630    HE2  LYS  80           2HE      LYS  80  -3.010 -11.085  -1.013
  631    HE3  LYS  80           1HE      LYS  80  -4.375 -10.346  -0.178
  632    HZ1  LYS  80           3HZ      LYS  80  -3.642 -11.258   1.879
  633    HZ2  LYS  80           1HZ      LYS  80  -2.311 -10.496   1.164
  634    HZ3  LYS  80           2HZ      LYS  80  -2.442 -12.182   1.126
  635   H282  PNS 101          8H2       PNS 101   2.018  13.173 -11.282
  636   H281  PNS 101          9H2       PNS 101   2.317  12.519  -9.669
  637   H303  PNS 101          0H3       PNS 101   3.030  15.646  -8.453
  638   H302  PNS 101          1H3       PNS 101   1.873  15.826  -9.771
  639   H301  PNS 101          2H3       PNS 101   3.515  16.445  -9.949
  640   H313  PNS 101          3H3       PNS 101   4.719  14.433  -8.470
  641   H312  PNS 101          4H3       PNS 101   5.173  13.295  -9.739
  642   H311  PNS 101          5H3       PNS 101   3.874  12.893  -8.616
  643    H32  PNS 101           6H3      PNS 101   3.171  14.211 -12.076
  644    H33  PNS 101           7H3      PNS 101   3.879  15.959 -12.821
  645    H36  PNS 101           8H3      PNS 101   6.447  14.844 -11.313
  646   H372  PNS 101          9H3       PNS 101   7.069  12.010 -11.547
  647   H371  PNS 101          0H4       PNS 101   6.984  12.677  -9.918
  648   H382  PNS 101          1H4       PNS 101   8.683  14.373 -10.612
  649   H381  PNS 101          2H4       PNS 101   9.266  12.709 -10.584
  650    H41  PNS 101           3H4      PNS 101   7.535  14.823 -12.683
  651   H422  PNS 101          4H4       PNS 101   9.556  14.554 -14.812
  652   H421  PNS 101          5H4       PNS 101   7.873  15.001 -15.082
  653   H431  PNS 101          7H4       PNS 101   8.522  17.133 -14.993
  654   H432  PNS 101          6H4       PNS 101   8.843  16.892 -13.270
  655    H44  PNS 101           8H4      PNS 101  11.219  15.982 -14.859
  Start of MODEL    6
    1    H1   MET   1           1HT      MET   1  -5.502  -7.662   8.546
    2    H2   MET   1           2HT      MET   1  -5.869  -9.330   8.717
    3    H3   MET   1           3HT      MET   1  -4.263  -8.833   8.373
    4    HA   MET   1           HA       MET   1  -5.805  -8.477  10.845
    5    HB2  MET   1           2HB      MET   1  -3.891 -10.351   9.855
    6    HB3  MET   1           1HB      MET   1  -3.142  -9.442  11.159
    7    HG2  MET   1           2HG      MET   1  -5.128  -9.986  12.570
    8    HG3  MET   1           1HG      MET   1  -5.679 -11.049  11.276
    9    HE1  MET   1           2HE      MET   1  -4.839 -11.925  14.531
   10    HE2  MET   1           3HE      MET   1  -3.749 -10.552  14.335
   11    HE3  MET   1           1HE      MET   1  -3.096 -12.155  14.670
   12    H    ASN   2           H        ASN   2  -3.667  -7.949  12.472
   13    HA   ASN   2           HA       ASN   2  -3.375  -5.179  12.244
   14    HB2  ASN   2           2HB      ASN   2  -1.735  -7.153  13.838
   15    HB3  ASN   2           1HB      ASN   2  -1.673  -5.404  14.042
   16   HD21  ASN   2          1HD2      ASN   2  -4.754  -6.230  13.202
   17   HD22  ASN   2          2HD2      ASN   2  -5.457  -6.335  14.776
   18    H    ASP   3           H        ASP   3  -1.416  -7.794  11.065
   19    HA   ASP   3           HA       ASP   3   1.006  -6.575  10.623
   20    HB2  ASP   3           2HB      ASP   3   1.349  -8.184   8.806
   21    HB3  ASP   3           1HB      ASP   3   0.600  -8.955  10.202
   22    H    VAL   4           H        VAL   4  -1.970  -6.173   8.864
   23    HA   VAL   4           HA       VAL   4  -0.842  -4.861   6.608
   24    HB   VAL   4           HB       VAL   4  -3.141  -4.161   6.080
   25   HG11  VAL   4          1HG1      VAL   4  -2.598  -6.270   5.240
   26   HG12  VAL   4          2HG1      VAL   4  -4.131  -6.526   6.074
   27   HG13  VAL   4          3HG1      VAL   4  -2.618  -7.016   6.837
   28   HG21  VAL   4          3HG2      VAL   4  -4.747  -5.511   7.862
   29   HG22  VAL   4          1HG2      VAL   4  -4.496  -3.767   7.812
   30   HG23  VAL   4          2HG2      VAL   4  -3.534  -4.764   8.900
   31    H    LEU   5           H        LEU   5  -2.540  -3.643   9.492
   32    HA   LEU   5           HA       LEU   5  -2.273  -0.920   8.823
   33    HB2  LEU   5           2HB      LEU   5  -3.372  -2.471  10.956
   34    HB3  LEU   5           1HB      LEU   5  -2.446  -1.140  11.621
   35    HG   LEU   5           HG       LEU   5  -3.861   0.202   9.774
   36   HD11  LEU   5          1HD1      LEU   5  -5.008  -2.260   9.548
   37   HD12  LEU   5          2HD1      LEU   5  -5.789  -0.735   9.131
   38   HD13  LEU   5          3HD1      LEU   5  -6.072  -1.467  10.710
   39   HD21  LEU   5          3HD2      LEU   5  -4.933  -0.543  12.491
   40   HD22  LEU   5          1HD2      LEU   5  -5.301   0.913  11.567
   41   HD23  LEU   5          2HD2      LEU   5  -3.676   0.659  12.202
   42    H    THR   6           H        THR   6  -0.274  -3.134  10.622
   43    HA   THR   6           HA       THR   6   1.413  -1.278  11.860
   44    HB   THR   6           HB       THR   6   1.640  -3.385  12.750
   45    HG1  THR   6           1HG      THR   6   3.736  -2.428  11.832
   46   HG21  THR   6          3HG2      THR   6   2.403  -5.096  10.625
   47   HG22  THR   6          1HG2      THR   6   0.904  -4.282  10.179
   48   HG23  THR   6          2HG2      THR   6   0.994  -5.200  11.683
   49    H    ARG   7           H        ARG   7   2.018  -3.163   8.921
   50    HA   ARG   7           HA       ARG   7   4.354  -1.667   8.269
   51    HB2  ARG   7           2HB      ARG   7   4.792  -3.456   7.016
   52    HB3  ARG   7           1HB      ARG   7   3.245  -4.134   7.504
   53    HG2  ARG   7           2HG      ARG   7   3.051  -4.207   5.230
   54    HG3  ARG   7           1HG      ARG   7   2.318  -2.638   5.570
   55    HD2  ARG   7           2HD      ARG   7   3.738  -1.990   3.922
   56    HD3  ARG   7           1HD      ARG   7   4.843  -1.846   5.288
   57    HE   ARG   7           HE       ARG   7   4.774  -4.356   3.781
   58   HH11  ARG   7          1HH1      ARG   7   6.435  -1.434   4.689
   59   HH12  ARG   7          2HH1      ARG   7   7.975  -1.974   4.107
   60   HH21  ARG   7          1HH2      ARG   7   6.796  -5.078   3.012
   61   HH22  ARG   7          2HH2      ARG   7   8.179  -4.047   3.153
   62    H    VAL   8           H        VAL   8   1.052  -1.849   7.036
   63    HA   VAL   8           HA       VAL   8   1.408  -0.069   4.894
   64    HB   VAL   8           HB       VAL   8  -0.585  -1.686   5.492
   65   HG11  VAL   8          1HG1      VAL   8  -2.537  -0.503   6.335
   66   HG12  VAL   8          2HG1      VAL   8  -1.575   0.959   6.552
   67   HG13  VAL   8          3HG1      VAL   8  -1.233  -0.474   7.522
   68   HG21  VAL   8          3HG2      VAL   8  -1.914   0.434   4.189
   69   HG22  VAL   8          1HG2      VAL   8  -1.143  -0.977   3.464
   70   HG23  VAL   8          2HG2      VAL   8  -0.221   0.508   3.700
   71    H    LEU   9           H        LEU   9   0.094   0.453   8.157
   72    HA   LEU   9           HA       LEU   9  -0.360   3.218   7.865
   73    HB2  LEU   9           2HB      LEU   9  -0.946   3.213  10.079
   74    HB3  LEU   9           1HB      LEU   9  -1.131   1.513   9.699
   75    HG   LEU   9           HG       LEU   9   1.278   1.254  10.576
   76   HD11  LEU   9          1HD1      LEU   9   1.192   3.977  10.694
   77   HD12  LEU   9          2HD1      LEU   9   2.317   2.956  11.589
   78   HD13  LEU   9          3HD1      LEU   9   0.838   3.527  12.362
   79   HD21  LEU   9          3HD2      LEU   9   0.408   1.279  12.967
   80   HD22  LEU   9          1HD2      LEU   9  -0.469   0.280  11.808
   81   HD23  LEU   9          2HD2      LEU   9  -1.117   1.849  12.288
   82    H    GLU  10           H        GLU  10   2.388   1.402   9.167
   83    HA   GLU  10           HA       GLU  10   3.909   3.635   9.959
   84    HB2  GLU  10           2HB      GLU  10   5.727   2.122  10.234
   85    HB3  GLU  10           1HB      GLU  10   4.269   1.245  10.679
   86    HG2  GLU  10           2HG      GLU  10   4.764  -0.331   9.218
   87    HG3  GLU  10           1HG      GLU  10   4.709   0.849   7.909
   88    H    VAL  11           H        VAL  11   3.552   1.928   6.962
   89    HA   VAL  11           HA       VAL  11   5.770   2.839   5.577
   90    HB   VAL  11           HB       VAL  11   3.173   1.736   4.847
   91   HG11  VAL  11          1HG1      VAL  11   3.377   3.767   3.409
   92   HG12  VAL  11          2HG1      VAL  11   3.297   2.243   2.523
   93   HG13  VAL  11          3HG1      VAL  11   4.845   3.062   2.733
   94   HG21  VAL  11          3HG2      VAL  11   5.407   0.894   3.259
   95   HG22  VAL  11          1HG2      VAL  11   4.435  -0.031   4.404
   96   HG23  VAL  11          2HG2      VAL  11   5.828   0.889   4.973
   97    H    VAL  12           H        VAL  12   2.505   4.182   5.585
   98    HA   VAL  12           HA       VAL  12   3.166   6.445   4.003
   99    HB   VAL  12           HB       VAL  12   0.977   7.020   4.124
  100   HG11  VAL  12          1HG1      VAL  12  -0.128   5.114   3.762
  101   HG12  VAL  12          2HG1      VAL  12   0.118   4.558   5.417
  102   HG13  VAL  12          3HG1      VAL  12   1.371   4.297   4.204
  103   HG21  VAL  12          3HG2      VAL  12   0.937   6.156   7.015
  104   HG22  VAL  12          1HG2      VAL  12  -0.403   6.910   6.151
  105   HG23  VAL  12          2HG2      VAL  12   1.089   7.810   6.423
  106    H    LYS  13           H        LYS  13   2.630   6.032   7.496
  107    HA   LYS  13           HA       LYS  13   2.992   8.655   8.301
  108    HB2  LYS  13           2HB      LYS  13   3.330   7.826  10.482
  109    HB3  LYS  13           1HB      LYS  13   2.301   6.634   9.700
  110    HG2  LYS  13           2HG      LYS  13   4.283   5.239   9.268
  111    HG3  LYS  13           1HG      LYS  13   5.272   6.421  10.140
  112    HD2  LYS  13           2HD      LYS  13   2.956   4.858  11.285
  113    HD3  LYS  13           1HD      LYS  13   4.667   4.529  11.572
  114    HE2  LYS  13           2HE      LYS  13   3.836   7.288  12.126
  115    HE3  LYS  13           1HE      LYS  13   3.086   6.075  13.163
  116    HZ1  LYS  13           3HZ      LYS  13   5.173   6.936  14.075
  117    HZ2  LYS  13           1HZ      LYS  13   6.010   6.357  12.722
  118    HZ3  LYS  13           2HZ      LYS  13   5.257   5.273  13.780
  119    H    ASN  14           H        ASN  14   5.451   6.110   7.952
  120    HA   ASN  14           HA       ASN  14   7.576   7.968   8.479
  121    HB2  ASN  14           2HB      ASN  14   7.833   5.127   7.497
  122    HB3  ASN  14           1HB      ASN  14   9.056   6.091   8.320
  123   HD21  ASN  14          1HD2      ASN  14   6.877   3.683   8.711
  124   HD22  ASN  14          2HD2      ASN  14   6.635   3.778  10.419
  125    H    PHE  15           H        PHE  15   5.692   7.369   5.859
  126    HA   PHE  15           HA       PHE  15   7.564   7.250   3.752
  127    HB2  PHE  15           2HB      PHE  15   4.687   7.527   4.034
  128    HB3  PHE  15           1HB      PHE  15   5.309   8.531   2.729
  129    HD1  PHE  15           1HD      PHE  15   7.219   5.576   3.456
  130    HD2  PHE  15           2HD      PHE  15   3.911   7.081   1.240
  131    HE1  PHE  15           1HE      PHE  15   7.311   3.604   1.988
  132    HE2  PHE  15           2HE      PHE  15   3.997   5.111  -0.232
  133    HZ   PHE  15           HZ       PHE  15   5.698   3.369   0.141
  134    H    GLU  16           H        GLU  16   6.346   9.814   5.704
  135    HA   GLU  16           HA       GLU  16   7.562  11.846   5.948
  136    HB2  GLU  16           2HB      GLU  16   8.983  12.661   4.332
  137    HB3  GLU  16           1HB      GLU  16   9.033  10.945   3.962
  138    HG2  GLU  16           2HG      GLU  16   8.338  11.349   1.910
  139    HG3  GLU  16           1HG      GLU  16   6.877  12.106   2.535
  140    H    LYS  17           H        LYS  17   4.994  10.839   4.065
  141    HA   LYS  17           HA       LYS  17   4.097  13.352   3.090
  142    HB2  LYS  17           2HB      LYS  17   3.238  10.604   2.965
  143    HB3  LYS  17           1HB      LYS  17   1.874  11.657   3.315
  144    HG2  LYS  17           2HG      LYS  17   1.977  11.447   0.972
  145    HG3  LYS  17           1HG      LYS  17   2.598  13.055   1.351
  146    HD2  LYS  17           2HD      LYS  17   3.846  11.404  -0.321
  147    HD3  LYS  17           1HD      LYS  17   4.719  12.536   0.712
  148    HE2  LYS  17           2HE      LYS  17   5.801  10.437   0.926
  149    HE3  LYS  17           1HE      LYS  17   4.883  10.688   2.409
  150    HZ1  LYS  17           3HZ      LYS  17   4.757   8.511   0.722
  151    HZ2  LYS  17           1HZ      LYS  17   3.306   9.346   0.475
  152    HZ3  LYS  17           2HZ      LYS  17   3.739   8.845   2.031
  153    H    VAL  18           H        VAL  18   3.609  11.527   6.036
  154    HA   VAL  18           HA       VAL  18   2.874  13.724   7.573
  155    HB   VAL  18           HB       VAL  18   0.406  12.904   7.954
  156   HG11  VAL  18          1HG1      VAL  18   1.516  15.079   6.810
  157   HG12  VAL  18          2HG1      VAL  18  -0.223  14.836   6.977
  158   HG13  VAL  18          3HG1      VAL  18   0.579  14.452   5.453
  159   HG21  VAL  18          3HG2      VAL  18  -0.655  11.802   6.265
  160   HG22  VAL  18          1HG2      VAL  18   0.956  11.110   6.078
  161   HG23  VAL  18          2HG2      VAL  18   0.433  12.425   5.025
  162    H    ASP  19           H        ASP  19   2.754  13.211   9.730
  163    HA   ASP  19           HA       ASP  19   3.635  10.614  10.477
  164    HB2  ASP  19           2HB      ASP  19   2.661  12.780  12.337
  165    HB3  ASP  19           1HB      ASP  19   3.780  11.470  12.703
  166    H    ALA  20           H        ALA  20   2.552   8.986  11.523
  167    HA   ALA  20           HA       ALA  20  -0.215   8.734  11.060
  168    HB1  ALA  20           1HB      ALA  20   0.728   6.950  13.123
  169    HB2  ALA  20           2HB      ALA  20   1.867   7.034  11.778
  170    HB3  ALA  20           3HB      ALA  20   0.186   6.588  11.483
  171    H    SER  21           H        SER  21   1.494  10.317  13.514
  172    HA   SER  21           HA       SER  21  -0.249   9.927  15.699
  173    HB2  SER  21           2HB      SER  21   0.885  12.454  16.038
  174    HB3  SER  21           1HB      SER  21   1.526  10.927  16.645
  175    HG   SER  21           HG       SER  21   2.710  10.738  14.700
  176    H    LYS  22           H        LYS  22  -0.510  11.796  12.848
  177    HA   LYS  22           HA       LYS  22  -2.620  13.452  13.995
  178    HB2  LYS  22           2HB      LYS  22  -2.469  14.537  11.632
  179    HB3  LYS  22           1HB      LYS  22  -1.222  14.878  12.824
  180    HG2  LYS  22           2HG      LYS  22  -0.146  14.477  10.748
  181    HG3  LYS  22           1HG      LYS  22   0.157  13.078  11.780
  182    HD2  LYS  22           2HD      LYS  22  -0.393  12.332   9.547
  183    HD3  LYS  22           1HD      LYS  22  -1.695  11.890  10.652
  184    HE2  LYS  22           2HE      LYS  22  -2.502  14.350   9.806
  185    HE3  LYS  22           1HE      LYS  22  -1.697  13.728   8.366
  186    HZ1  LYS  22           3HZ      LYS  22  -4.071  13.183   8.438
  187    HZ2  LYS  22           1HZ      LYS  22  -3.829  12.303   9.862
  188    HZ3  LYS  22           2HZ      LYS  22  -3.106  11.795   8.421
  189    H    VAL  23           H        VAL  23  -2.141  10.678  12.108
  190    HA   VAL  23           HA       VAL  23  -4.534  10.855  10.548
  191    HB   VAL  23           HB       VAL  23  -3.969   8.822   9.621
  192   HG11  VAL  23          1HG1      VAL  23  -1.481   8.726   9.437
  193   HG12  VAL  23          2HG1      VAL  23  -1.394   9.970  10.684
  194   HG13  VAL  23          3HG1      VAL  23  -2.170  10.321   9.140
  195   HG21  VAL  23          3HG2      VAL  23  -4.075   7.622  11.816
  196   HG22  VAL  23          1HG2      VAL  23  -2.385   8.058  12.067
  197   HG23  VAL  23          2HG2      VAL  23  -2.837   7.025  10.711
  198    H    THR  24           H        THR  24  -6.536  10.389  11.181
  199    HA   THR  24           HA       THR  24  -6.897   8.834  13.619
  200    HB   THR  24           HB       THR  24  -7.834  11.402  12.971
  201    HG1  THR  24           1HG      THR  24  -9.129  10.177  15.032
  202   HG21  THR  24          3HG2      THR  24  -9.699   9.925  11.846
  203   HG22  THR  24          1HG2      THR  24 -10.095  11.371  12.773
  204   HG23  THR  24          2HG2      THR  24 -10.253   9.778  13.514
  205    HA   PRO  25           HA       PRO  25  -9.309   5.709  11.700
  206    HB2  PRO  25           2HB      PRO  25 -11.661   6.476  13.349
  207    HB3  PRO  25           1HB      PRO  25 -10.850   4.913  13.203
  208    HG2  PRO  25           2HG      PRO  25 -10.529   6.419  15.378
  209    HG3  PRO  25           1HG      PRO  25  -9.178   5.491  14.700
  210    HD2  PRO  25           2HD      PRO  25  -9.751   8.419  14.518
  211    HD3  PRO  25           1HD      PRO  25  -8.195   7.582  14.689
  212    H    GLU  26           H        GLU  26 -10.997   8.788  12.123
  213    HA   GLU  26           HA       GLU  26 -12.533   8.266   9.696
  214    HB2  GLU  26           2HB      GLU  26 -13.890   8.868  11.612
  215    HB3  GLU  26           1HB      GLU  26 -12.930  10.317  11.873
  216    HG2  GLU  26           2HG      GLU  26 -13.882  10.403   9.215
  217    HG3  GLU  26           1HG      GLU  26 -15.238   9.965  10.254
  218    H    SER  27           H        SER  27  -9.646   9.347  10.216
  219    HA   SER  27           HA       SER  27  -9.560  11.983   9.241
  220    HB2  SER  27           2HB      SER  27  -7.564  11.417  10.229
  221    HB3  SER  27           1HB      SER  27  -7.583   9.779   9.575
  222    HG   SER  27           HG       SER  27  -5.999  11.234   8.628
  223    H    HIS  28           H        HIS  28  -9.638  12.819   7.250
  224    HA   HIS  28           HA       HIS  28 -10.338  11.120   5.058
  225    HB2  HIS  28           2HB      HIS  28 -10.040  14.103   5.348
  226    HB3  HIS  28           1HB      HIS  28 -10.405  13.342   3.803
  227    HD1  HIS  28           1HD      HIS  28 -12.105  11.411   6.261
  228    HD2  HIS  28           2HD      HIS  28 -12.809  15.074   4.428
  229    HE1  HIS  28           1HE      HIS  28 -14.555  11.870   6.595
  230    HE2  HIS  28           2HE      HIS  28 -14.975  14.049   5.403
  231    H    PHE  29           H        PHE  29  -9.217  10.917   3.086
  232    HA   PHE  29           HA       PHE  29  -6.410  10.709   3.332
  233    HB2  PHE  29           2HB      PHE  29  -8.050   9.393   1.804
  234    HB3  PHE  29           1HB      PHE  29  -7.827  10.733   0.684
  235    HD1  PHE  29           2HD      PHE  29  -4.832  10.722   2.227
  236    HD2  PHE  29           1HD      PHE  29  -7.122   8.231  -0.353
  237    HE1  PHE  29           2HE      PHE  29  -2.762   9.680   1.401
  238    HE2  PHE  29           1HE      PHE  29  -5.055   7.185  -1.184
  239    HZ   PHE  29           HZ       PHE  29  -2.872   7.910  -0.308
  240    H    VAL  30           H        VAL  30  -6.499  11.773   0.314
  241    HA   VAL  30           HA       VAL  30  -4.832  13.823   0.370
  242    HB   VAL  30           HB       VAL  30  -5.684  14.675  -1.667
  243   HG11  VAL  30          1HG1      VAL  30  -6.776  12.218  -2.460
  244   HG12  VAL  30          2HG1      VAL  30  -5.611  11.845  -1.191
  245   HG13  VAL  30          3HG1      VAL  30  -5.103  12.752  -2.615
  246   HG21  VAL  30          3HG2      VAL  30  -8.325  13.604  -0.721
  247   HG22  VAL  30          1HG2      VAL  30  -8.033  14.009  -2.413
  248   HG23  VAL  30          2HG2      VAL  30  -7.903  15.256  -1.173
  249    H    LYS  31           H        LYS  31  -8.137  14.002   1.395
  250    HA   LYS  31           HA       LYS  31  -8.389  16.799   1.567
  251    HB2  LYS  31           2HB      LYS  31  -9.805  15.020   3.502
  252    HB3  LYS  31           1HB      LYS  31 -10.409  16.418   2.626
  253    HG2  LYS  31           2HG      LYS  31  -9.899  13.669   1.514
  254    HG3  LYS  31           1HG      LYS  31 -11.465  14.441   1.779
  255    HD2  LYS  31           2HD      LYS  31  -9.799  16.130   0.162
  256    HD3  LYS  31           1HD      LYS  31  -9.879  14.514  -0.541
  257    HE2  LYS  31           2HE      LYS  31 -11.673  16.270  -1.186
  258    HE3  LYS  31           1HE      LYS  31 -12.170  14.615  -0.839
  259    HZ1  LYS  31           3HZ      LYS  31 -13.504  15.404   0.722
  260    HZ2  LYS  31           1HZ      LYS  31 -12.978  16.985   0.430
  261    HZ3  LYS  31           2HZ      LYS  31 -12.177  16.024   1.567
  262    H    ASP  32           H        ASP  32  -7.437  14.376   3.977
  263    HA   ASP  32           HA       ASP  32  -6.865  16.417   5.923
  264    HB2  ASP  32           2HB      ASP  32  -7.846  14.068   6.387
  265    HB3  ASP  32           1HB      ASP  32  -6.182  13.511   6.242
  266    H    LEU  33           H        LEU  33  -5.315  15.709   3.286
  267    HA   LEU  33           HA       LEU  33  -3.136  16.607   2.893
  268    HB2  LEU  33           2HB      LEU  33  -2.482  15.338   5.554
  269    HB3  LEU  33           1HB      LEU  33  -1.326  16.144   4.513
  270    HG   LEU  33           HG       LEU  33  -1.867  18.158   5.307
  271   HD11  LEU  33          1HD1      LEU  33  -3.895  19.138   5.001
  272   HD12  LEU  33          2HD1      LEU  33  -4.790  17.730   5.571
  273   HD13  LEU  33          3HD1      LEU  33  -4.101  17.740   3.948
  274   HD21  LEU  33          3HD2      LEU  33  -1.949  17.814   7.496
  275   HD22  LEU  33          1HD2      LEU  33  -2.686  16.229   7.261
  276   HD23  LEU  33          2HD2      LEU  33  -3.702  17.666   7.373
  277    H    GLY  34           H        GLY  34  -4.495  14.296   2.015
  278    HA2  GLY  34           2HA      GLY  34  -3.080  11.902   2.232
  279    HA3  GLY  34           1HA      GLY  34  -4.073  12.360   0.856
  280    H    LEU  35           H        LEU  35  -1.615  10.855   0.827
  281    HA   LEU  35           HA       LEU  35   0.569  12.450   0.025
  282    HB2  LEU  35           2HB      LEU  35   0.208   9.693  -1.047
  283    HB3  LEU  35           1HB      LEU  35   1.659  10.476  -0.450
  284    HG   LEU  35           HG       LEU  35   1.368   9.128   1.327
  285   HD11  LEU  35          1HD1      LEU  35  -0.932  10.565   2.411
  286   HD12  LEU  35          2HD1      LEU  35   0.362  11.616   1.833
  287   HD13  LEU  35          3HD1      LEU  35   0.701  10.386   3.050
  288   HD21  LEU  35          3HD2      LEU  35  -1.148   8.638   0.027
  289   HD22  LEU  35          1HD2      LEU  35  -1.361   8.704   1.776
  290   HD23  LEU  35          2HD2      LEU  35  -0.201   7.578   1.071
  291    H    ASN  36           H        ASN  36   1.372  12.930  -2.036
  292    HA   ASN  36           HA       ASN  36  -0.586  13.530  -3.984
  293    HB2  ASN  36           2HB      ASN  36   1.179  14.480  -5.271
  294    HB3  ASN  36           1HB      ASN  36   1.541  14.820  -3.583
  295   HD21  ASN  36          1HD2      ASN  36   2.525  13.231  -6.443
  296   HD22  ASN  36          2HD2      ASN  36   4.024  12.613  -5.852
  297    H    SER  37           H        SER  37   0.752  12.958  -6.395
  298    HA   SER  37           HA       SER  37  -0.294  10.419  -6.971
  299    HB2  SER  37           2HB      SER  37   0.848  10.704  -9.179
  300    HB3  SER  37           1HB      SER  37  -0.160  12.072  -8.708
  301    H    LEU  38           H        LEU  38   3.108  11.411  -7.128
  302    HA   LEU  38           HA       LEU  38   4.191   8.913  -7.535
  303    HB2  LEU  38           2HB      LEU  38   6.258   9.829  -7.171
  304    HB3  LEU  38           1HB      LEU  38   5.310  11.246  -7.532
  305    HG   LEU  38           HG       LEU  38   6.774  10.558  -5.137
  306   HD11  LEU  38          1HD1      LEU  38   5.751  13.017  -6.483
  307   HD12  LEU  38          2HD1      LEU  38   7.416  12.511  -6.196
  308   HD13  LEU  38          3HD1      LEU  38   6.427  13.094  -4.856
  309   HD21  LEU  38          3HD2      LEU  38   3.884  11.175  -4.949
  310   HD22  LEU  38          1HD2      LEU  38   4.973  11.968  -3.813
  311   HD23  LEU  38          2HD2      LEU  38   4.906  10.208  -3.885
  312    H    ASP  39           H        ASP  39   2.719  10.059  -4.681
  313    HA   ASP  39           HA       ASP  39   4.118   8.242  -2.926
  314    HB2  ASP  39           2HB      ASP  39   1.632   9.218  -1.831
  315    HB3  ASP  39           1HB      ASP  39   3.279   9.505  -1.282
  316    H    VAL  40           H        VAL  40   0.624   8.550  -3.116
  317    HA   VAL  40           HA       VAL  40  -0.251   6.172  -2.404
  318    HB   VAL  40           HB       VAL  40  -1.405   8.153  -3.877
  319   HG11  VAL  40          1HG1      VAL  40  -0.467   6.721  -5.889
  320   HG12  VAL  40          2HG1      VAL  40  -2.044   7.506  -5.973
  321   HG13  VAL  40          3HG1      VAL  40  -1.934   5.787  -5.597
  322   HG21  VAL  40          3HG2      VAL  40  -3.008   7.257  -2.614
  323   HG22  VAL  40          1HG2      VAL  40  -2.224   5.676  -2.612
  324   HG23  VAL  40          2HG2      VAL  40  -3.293   6.130  -3.940
  325    H    VAL  41           H        VAL  41   1.461   6.770  -5.412
  326    HA   VAL  41           HA       VAL  41   1.077   4.172  -6.494
  327    HB   VAL  41           HB       VAL  41   3.432   5.849  -7.247
  328   HG11  VAL  41          1HG1      VAL  41   3.444   4.571  -9.072
  329   HG12  VAL  41          2HG1      VAL  41   1.718   4.809  -9.344
  330   HG13  VAL  41          3HG1      VAL  41   2.272   3.546  -8.245
  331   HG21  VAL  41          3HG2      VAL  41   1.063   6.565  -8.742
  332   HG22  VAL  41          1HG2      VAL  41   2.250   7.602  -7.951
  333   HG23  VAL  41          2HG2      VAL  41   0.889   6.958  -7.032
  334    H    GLU  42           H        GLU  42   3.729   5.728  -4.710
  335    HA   GLU  42           HA       GLU  42   5.454   3.491  -4.807
  336    HB2  GLU  42           2HB      GLU  42   5.366   6.061  -3.340
  337    HB3  GLU  42           1HB      GLU  42   6.324   4.780  -2.611
  338    HG2  GLU  42           2HG      GLU  42   7.231   4.616  -5.116
  339    HG3  GLU  42           1HG      GLU  42   6.781   6.321  -5.084
  340    H    VAL  43           H        VAL  43   3.131   4.642  -2.454
  341    HA   VAL  43           HA       VAL  43   3.627   2.665  -0.499
  342    HB   VAL  43           HB       VAL  43   2.431   4.197   0.608
  343   HG11  VAL  43          1HG1      VAL  43   1.011   5.875  -0.459
  344   HG12  VAL  43          2HG1      VAL  43   1.139   5.006  -1.987
  345   HG13  VAL  43          3HG1      VAL  43   2.571   5.743  -1.268
  346   HG21  VAL  43          3HG2      VAL  43   0.864   2.315   0.573
  347   HG22  VAL  43          1HG2      VAL  43   0.095   3.019  -0.843
  348   HG23  VAL  43          2HG2      VAL  43   0.039   3.872   0.694
  349    H    VAL  44           H        VAL  44   1.298   2.950  -3.119
  350    HA   VAL  44           HA       VAL  44  -0.214   0.656  -2.559
  351    HB   VAL  44           HB       VAL  44  -0.729   0.660  -5.034
  352   HG11  VAL  44          1HG1      VAL  44  -1.396   2.564  -3.018
  353   HG12  VAL  44          2HG1      VAL  44  -2.397   1.928  -4.321
  354   HG13  VAL  44          3HG1      VAL  44  -1.396   3.353  -4.593
  355   HG21  VAL  44          3HG2      VAL  44   1.254   2.907  -4.939
  356   HG22  VAL  44          1HG2      VAL  44   0.007   2.825  -6.183
  357   HG23  VAL  44          2HG2      VAL  44   1.197   1.531  -6.039
  358    H    PHE  45           H        PHE  45   2.822   1.146  -4.209
  359    HA   PHE  45           HA       PHE  45   3.047  -1.491  -5.254
  360    HB2  PHE  45           2HB      PHE  45   4.551   0.958  -5.331
  361    HB3  PHE  45           1HB      PHE  45   5.624  -0.382  -4.941
  362    HD1  PHE  45           1HD      PHE  45   5.261  -2.518  -6.429
  363    HD2  PHE  45           2HD      PHE  45   4.181   1.441  -7.543
  364    HE1  PHE  45           1HE      PHE  45   5.336  -3.174  -8.804
  365    HE2  PHE  45           2HE      PHE  45   4.252   0.798  -9.919
  366    HZ   PHE  45           HZ       PHE  45   4.829  -1.512 -10.552
  367    H    ALA  46           H        ALA  46   3.896   0.105  -2.308
  368    HA   ALA  46           HA       ALA  46   5.609  -1.908  -1.283
  369    HB1  ALA  46           1HB      ALA  46   4.119   0.213   0.240
  370    HB2  ALA  46           2HB      ALA  46   5.684   0.444  -0.538
  371    HB3  ALA  46           3HB      ALA  46   5.523  -0.696   0.797
  372    H    ILE  47           H        ILE  47   2.663  -0.843   0.304
  373    HA   ILE  47           HA       ILE  47   2.050  -2.940   1.832
  374    HB   ILE  47           HB       ILE  47  -0.377  -2.530   1.426
  375   HG12  ILE  47          2HG1      ILE  47   0.719  -1.280  -0.978
  376   HG13  ILE  47          1HG1      ILE  47  -0.918  -1.841  -0.649
  377   HG21  ILE  47          1HG2      ILE  47  -0.263  -0.063   2.050
  378   HG22  ILE  47          2HG2      ILE  47   1.487  -0.224   1.897
  379   HG23  ILE  47          3HG2      ILE  47   0.611  -1.195   3.082
  380   HD11  ILE  47          3HD1      ILE  47   0.226   0.845  -0.481
  381   HD12  ILE  47          1HD1      ILE  47  -0.817   0.401   0.869
  382   HD13  ILE  47          2HD1      ILE  47  -1.432   0.328  -0.782
  383    H    GLU  48           H        GLU  48   1.326  -2.768  -1.640
  384    HA   GLU  48           HA       GLU  48   0.047  -5.219  -1.919
  385    HB2  GLU  48           2HB      GLU  48   0.153  -4.827  -4.155
  386    HB3  GLU  48           1HB      GLU  48   0.665  -3.232  -3.622
  387    HG2  GLU  48           2HG      GLU  48   2.124  -3.959  -5.358
  388    HG3  GLU  48           1HG      GLU  48   3.017  -3.968  -3.837
  389    H    GLN  49           H        GLN  49   3.455  -4.412  -1.929
  390    HA   GLN  49           HA       GLN  49   4.546  -6.848  -2.686
  391    HB2  GLN  49           2HB      GLN  49   5.602  -4.482  -1.965
  392    HB3  GLN  49           1HB      GLN  49   5.905  -5.386  -0.487
  393    HG2  GLN  49           2HG      GLN  49   7.555  -6.562  -1.412
  394    HG3  GLN  49           1HG      GLN  49   6.642  -6.848  -2.893
  395   HE21  GLN  49          1HE2      GLN  49   6.202  -4.187  -3.635
  396   HE22  GLN  49          2HE2      GLN  49   7.714  -3.492  -4.100
  397    H    GLU  50           H        GLU  50   3.499  -5.739   0.507
  398    HA   GLU  50           HA       GLU  50   3.823  -8.467   1.484
  399    HB2  GLU  50           2HB      GLU  50   5.168  -7.003   2.796
  400    HB3  GLU  50           1HB      GLU  50   3.862  -5.835   2.941
  401    HG2  GLU  50           2HG      GLU  50   4.397  -7.295   4.962
  402    HG3  GLU  50           1HG      GLU  50   2.707  -7.130   4.487
  403    H    PHE  51           H        PHE  51   1.585  -7.617  -0.064
  404    HA   PHE  51           HA       PHE  51  -0.524  -8.189   1.840
  405    HB2  PHE  51           2HB      PHE  51  -0.345  -5.792   0.087
  406    HB3  PHE  51           1HB      PHE  51  -1.928  -6.523   0.323
  407    HD1  PHE  51           1HD      PHE  51   1.020  -5.535   2.396
  408    HD2  PHE  51           2HD      PHE  51  -3.215  -5.651   1.994
  409    HE1  PHE  51           1HE      PHE  51   0.788  -4.335   4.531
  410    HE2  PHE  51           2HE      PHE  51  -3.456  -4.451   4.128
  411    HZ   PHE  51           HZ       PHE  51  -1.452  -3.790   5.399
  412    H    ILE  52           H        ILE  52   1.018  -9.056  -0.903
  413    HA   ILE  52           HA       ILE  52   0.540 -10.334  -2.720
  414    HB   ILE  52           HB       ILE  52  -1.213 -12.099  -2.358
  415   HG12  ILE  52          2HG1      ILE  52  -1.976 -12.325   0.041
  416   HG13  ILE  52          1HG1      ILE  52  -1.472 -10.661   0.255
  417   HG21  ILE  52          1HG2      ILE  52   0.358 -13.351  -1.389
  418   HG22  ILE  52          2HG2      ILE  52   0.399 -12.335   0.053
  419   HG23  ILE  52          3HG2      ILE  52   1.327 -11.877  -1.376
  420   HD11  ILE  52          3HD1      ILE  52  -3.608 -11.674  -1.592
  421   HD12  ILE  52          1HD1      ILE  52  -3.042 -10.005  -1.544
  422   HD13  ILE  52          2HD1      ILE  52  -3.827 -10.709  -0.131
  423    H    LEU  53           H        LEU  53  -0.578  -7.775  -2.844
  424    HA   LEU  53           HA       LEU  53  -2.390  -8.062  -4.963
  425    HB2  LEU  53           2HB      LEU  53  -3.734  -8.539  -2.708
  426    HB3  LEU  53           1HB      LEU  53  -3.828  -6.788  -2.696
  427    HG   LEU  53           HG       LEU  53  -5.245  -6.705  -4.483
  428   HD11  LEU  53          1HD1      LEU  53  -4.102  -9.324  -5.445
  429   HD12  LEU  53          2HD1      LEU  53  -3.721  -7.721  -6.073
  430   HD13  LEU  53          3HD1      LEU  53  -5.343  -8.382  -6.270
  431   HD21  LEU  53          3HD2      LEU  53  -5.780  -9.536  -3.604
  432   HD22  LEU  53          1HD2      LEU  53  -6.930  -8.385  -4.282
  433   HD23  LEU  53          2HD2      LEU  53  -6.250  -8.111  -2.678
  434    H    ASP  54           H        ASP  54  -2.523  -6.184  -6.113
  435    HA   ASP  54           HA       ASP  54  -0.868  -4.017  -5.245
  436    HB2  ASP  54           2HB      ASP  54  -2.422  -3.481  -7.639
  437    HB3  ASP  54           1HB      ASP  54  -0.675  -3.576  -7.436
  438    H    ILE  55           H        ILE  55  -1.475  -1.941  -4.740
  439    HA   ILE  55           HA       ILE  55  -4.324  -1.558  -4.200
  440    HB   ILE  55           HB       ILE  55  -1.898  -0.452  -2.812
  441   HG12  ILE  55          2HG1      ILE  55  -3.145  -1.429  -0.819
  442   HG13  ILE  55          1HG1      ILE  55  -4.221  -2.193  -1.984
  443   HG21  ILE  55          1HG2      ILE  55  -3.491   1.368  -3.113
  444   HG22  ILE  55          2HG2      ILE  55  -3.413   0.875  -1.422
  445   HG23  ILE  55          3HG2      ILE  55  -4.774   0.371  -2.425
  446   HD11  ILE  55          3HD1      ILE  55  -2.694  -3.737  -2.578
  447   HD12  ILE  55          1HD1      ILE  55  -2.054  -3.382  -0.974
  448   HD13  ILE  55          2HD1      ILE  55  -1.336  -2.626  -2.398
  449    HA   PRO  56           HA       PRO  56  -2.484   2.265  -6.571
  450    HB2  PRO  56           2HB      PRO  56  -1.338   1.496  -8.887
  451    HB3  PRO  56           1HB      PRO  56  -0.419   1.636  -7.384
  452    HG2  PRO  56           2HG      PRO  56  -1.554  -0.808  -8.688
  453    HG3  PRO  56           1HG      PRO  56   0.037  -0.576  -7.942
  454    HD2  PRO  56           2HD      PRO  56  -2.033  -1.806  -6.676
  455    HD3  PRO  56           1HD      PRO  56  -0.773  -0.895  -5.817
  456    H    ASP  57           H        ASP  57  -2.735   2.533  -9.323
  457    HA   ASP  57           HA       ASP  57  -4.294   2.790 -10.957
  458    HB2  ASP  57           2HB      ASP  57  -5.629   0.252 -10.069
  459    HB3  ASP  57           1HB      ASP  57  -5.421   0.882 -11.700
  460    H    HIS  58           H        HIS  58  -6.899   2.451 -11.259
  461    HA   HIS  58           HA       HIS  58  -8.106   4.422  -9.768
  462    HB2  HIS  58           2HB      HIS  58 -10.243   2.833 -10.422
  463    HB3  HIS  58           1HB      HIS  58  -9.494   4.011 -11.495
  464    HD1  HIS  58           1HD      HIS  58  -9.949   0.367 -10.979
  465    HD2  HIS  58           2HD      HIS  58  -7.809   2.893 -13.491
  466    HE1  HIS  58           1HE      HIS  58  -9.137  -1.087 -12.863
  467    HE2  HIS  58           2HE      HIS  58  -7.771   0.445 -14.325
  468    H    ASP  59           H        ASP  59  -7.312   1.279  -8.775
  469    HA   ASP  59           HA       ASP  59  -9.357   0.799  -6.891
  470    HB2  ASP  59           2HB      ASP  59  -7.774  -0.929  -7.766
  471    HB3  ASP  59           1HB      ASP  59  -6.502  -0.194  -6.794
  472    H    ALA  60           H        ALA  60  -6.145   2.279  -6.603
  473    HA   ALA  60           HA       ALA  60  -6.438   2.797  -3.807
  474    HB1  ALA  60           1HB      ALA  60  -4.361   3.095  -5.814
  475    HB2  ALA  60           2HB      ALA  60  -4.224   2.793  -4.082
  476    HB3  ALA  60           3HB      ALA  60  -4.411   4.442  -4.677
  477    H    GLU  61           H        GLU  61  -7.026   4.539  -6.755
  478    HA   GLU  61           HA       GLU  61  -7.359   7.087  -5.486
  479    HB2  GLU  61           2HB      GLU  61  -7.728   7.953  -7.607
  480    HB3  GLU  61           1HB      GLU  61  -6.687   6.576  -7.941
  481    HG2  GLU  61           2HG      GLU  61  -8.785   5.256  -8.401
  482    HG3  GLU  61           1HG      GLU  61  -9.655   6.788  -8.339
  483    H    LYS  62           H        LYS  62  -9.314   4.335  -5.994
  484    HA   LYS  62           HA       LYS  62 -11.846   5.642  -6.032
  485    HB2  LYS  62           2HB      LYS  62 -10.908   3.035  -6.433
  486    HB3  LYS  62           1HB      LYS  62 -11.958   2.934  -5.026
  487    HG2  LYS  62           2HG      LYS  62 -13.817   3.275  -6.228
  488    HG3  LYS  62           1HG      LYS  62 -13.053   4.494  -7.251
  489    HD2  LYS  62           2HD      LYS  62 -11.795   2.515  -8.310
  490    HD3  LYS  62           1HD      LYS  62 -13.019   1.506  -7.533
  491    HE2  LYS  62           2HE      LYS  62 -13.671   1.999  -9.813
  492    HE3  LYS  62           1HE      LYS  62 -14.776   2.782  -8.684
  493    HZ1  LYS  62           3HZ      LYS  62 -13.000   3.951 -10.621
  494    HZ2  LYS  62           1HZ      LYS  62 -12.888   4.672  -9.093
  495    HZ3  LYS  62           2HZ      LYS  62 -14.379   4.601  -9.887
  496    H    ILE  63           H        ILE  63  -9.735   5.896  -3.722
  497    HA   ILE  63           HA       ILE  63 -11.700   5.610  -1.567
  498    HB   ILE  63           HB       ILE  63  -9.593   5.484  -0.066
  499   HG12  ILE  63          2HG1      ILE  63  -8.432   4.416  -2.645
  500   HG13  ILE  63          1HG1      ILE  63  -8.048   6.002  -1.984
  501   HG21  ILE  63          1HG2      ILE  63 -10.297   3.397   0.205
  502   HG22  ILE  63          2HG2      ILE  63  -9.608   2.920  -1.346
  503   HG23  ILE  63          3HG2      ILE  63 -11.247   3.565  -1.271
  504   HD11  ILE  63          3HD1      ILE  63  -6.667   5.157  -0.435
  505   HD12  ILE  63          1HD1      ILE  63  -6.619   3.766  -1.518
  506   HD13  ILE  63          2HD1      ILE  63  -7.699   3.761  -0.124
  507    H    GLN  64           H        GLN  64 -12.296   7.478  -0.696
  508    HA   GLN  64           HA       GLN  64 -10.726   9.851  -1.198
  509    HB2  GLN  64           2HB      GLN  64 -13.455   9.589   0.061
  510    HB3  GLN  64           1HB      GLN  64 -12.683  11.090  -0.433
  511    HG2  GLN  64           2HG      GLN  64 -14.417  10.243  -2.002
  512    HG3  GLN  64           1HG      GLN  64 -12.833  10.510  -2.729
  513   HE21  GLN  64          1HE2      GLN  64 -11.521   8.687  -3.202
  514   HE22  GLN  64          2HE2      GLN  64 -12.231   7.133  -3.458
  515    H    SER  65           H        SER  65 -11.511   7.687   1.362
  516    HA   SER  65           HA       SER  65 -10.163   9.471   3.282
  517    HB2  SER  65           2HB      SER  65 -11.506   8.579   5.045
  518    HB3  SER  65           1HB      SER  65 -12.610   8.982   3.730
  519    HG   SER  65           HG       SER  65 -13.002   6.915   3.399
  520    H    ILE  66           H        ILE  66  -8.754   8.488   4.817
  521    HA   ILE  66           HA       ILE  66  -7.130   6.453   3.733
  522    HB   ILE  66           HB       ILE  66  -6.434   6.516   6.395
  523   HG12  ILE  66          2HG1      ILE  66  -7.498   9.232   5.586
  524   HG13  ILE  66          1HG1      ILE  66  -8.057   8.238   6.927
  525   HG21  ILE  66          1HG2      ILE  66  -4.578   6.870   5.226
  526   HG22  ILE  66          2HG2      ILE  66  -5.001   8.583   5.230
  527   HG23  ILE  66          3HG2      ILE  66  -5.478   7.560   3.873
  528   HD11  ILE  66          3HD1      ILE  66  -6.607   9.238   8.252
  529   HD12  ILE  66          1HD1      ILE  66  -6.017  10.199   6.898
  530   HD13  ILE  66          2HD1      ILE  66  -5.280   8.639   7.258
  531    HA   PRO  67           HA       PRO  67  -9.503   3.951   7.329
  532    HB2  PRO  67           2HB      PRO  67 -12.166   4.731   6.251
  533    HB3  PRO  67           1HB      PRO  67 -11.669   4.438   7.921
  534    HG2  PRO  67           2HG      PRO  67 -12.065   6.918   7.036
  535    HG3  PRO  67           1HG      PRO  67 -10.739   6.549   8.155
  536    HD2  PRO  67           2HD      PRO  67 -10.651   7.059   5.213
  537    HD3  PRO  67           1HD      PRO  67  -9.497   7.529   6.475
  538    H    ASP  68           H        ASP  68 -11.580   4.382   4.462
  539    HA   ASP  68           HA       ASP  68 -11.920   1.661   3.953
  540    HB2  ASP  68           2HB      ASP  68 -12.637   4.142   2.696
  541    HB3  ASP  68           1HB      ASP  68 -12.078   3.006   1.471
  542    H    ALA  69           H        ALA  69  -9.239   3.692   3.351
  543    HA   ALA  69           HA       ALA  69  -8.110   2.311   1.153
  544    HB1  ALA  69           1HB      ALA  69  -7.305   4.474   1.443
  545    HB2  ALA  69           2HB      ALA  69  -5.971   3.459   1.988
  546    HB3  ALA  69           3HB      ALA  69  -7.026   4.237   3.168
  547    H    VAL  70           H        VAL  70  -6.561   2.547   4.295
  548    HA   VAL  70           HA       VAL  70  -5.174   0.111   4.022
  549    HB   VAL  70           HB       VAL  70  -4.149   1.649   5.449
  550   HG11  VAL  70          1HG1      VAL  70  -5.552   3.248   6.187
  551   HG12  VAL  70          2HG1      VAL  70  -5.635   2.239   7.631
  552   HG13  VAL  70          3HG1      VAL  70  -6.892   2.121   6.400
  553   HG21  VAL  70          3HG2      VAL  70  -5.378  -0.014   7.591
  554   HG22  VAL  70          1HG2      VAL  70  -3.686   0.390   7.306
  555   HG23  VAL  70          2HG2      VAL  70  -4.485  -0.821   6.302
  556    H    GLU  71           H        GLU  71  -8.368   0.778   4.954
  557    HA   GLU  71           HA       GLU  71  -8.722  -1.476   6.673
  558    HB2  GLU  71           2HB      GLU  71 -10.658   0.431   5.375
  559    HB3  GLU  71           1HB      GLU  71 -11.174  -0.903   6.396
  560    HG2  GLU  71           2HG      GLU  71  -9.119   0.813   7.582
  561    HG3  GLU  71           1HG      GLU  71 -10.659   1.611   7.264
  562    H    TYR  72           H        TYR  72  -9.409  -0.730   3.287
  563    HA   TYR  72           HA       TYR  72 -10.816  -3.120   2.752
  564    HB2  TYR  72           2HB      TYR  72 -11.244  -2.075   0.828
  565    HB3  TYR  72           1HB      TYR  72 -10.183  -0.771   1.350
  566    HD1  TYR  72           2HD      TYR  72 -10.382  -3.867  -0.637
  567    HD2  TYR  72           1HD      TYR  72  -7.995  -0.505   0.411
  568    HE1  TYR  72           2HE      TYR  72  -8.847  -4.388  -2.486
  569    HE2  TYR  72           1HE      TYR  72  -6.454  -1.015  -1.436
  570    HH   TYR  72           HH       TYR  72  -6.075  -2.298  -3.218
  571    H    ILE  73           H        ILE  73  -7.476  -2.161   2.080
  572    HA   ILE  73           HA       ILE  73  -6.747  -4.664   0.982
  573    HB   ILE  73           HB       ILE  73  -4.357  -3.830   1.530
  574   HG12  ILE  73          2HG1      ILE  73  -4.125  -1.477   1.922
  575   HG13  ILE  73          1HG1      ILE  73  -5.865  -1.262   1.844
  576   HG21  ILE  73          1HG2      ILE  73  -5.364  -1.858  -0.300
  577   HG22  ILE  73          2HG2      ILE  73  -6.118  -3.426  -0.585
  578   HG23  ILE  73          3HG2      ILE  73  -4.362  -3.274  -0.615
  579   HD11  ILE  73          3HD1      ILE  73  -6.191  -1.984   3.948
  580   HD12  ILE  73          1HD1      ILE  73  -4.529  -1.427   4.130
  581   HD13  ILE  73          2HD1      ILE  73  -4.861  -3.138   3.876
  582    H    ALA  74           H        ALA  74  -6.868  -3.418   4.209
  583    HA   ALA  74           HA       ALA  74  -5.167  -5.287   5.447
  584    HB1  ALA  74           1HB      ALA  74  -7.460  -3.677   6.540
  585    HB2  ALA  74           2HB      ALA  74  -5.741  -3.291   6.623
  586    HB3  ALA  74           3HB      ALA  74  -6.384  -4.658   7.534
  587    H    GLN  75           H        GLN  75  -8.666  -5.215   5.040
  588    HA   GLN  75           HA       GLN  75  -9.016  -7.818   6.163
  589    HB2  GLN  75           2HB      GLN  75 -10.951  -6.046   4.675
  590    HB3  GLN  75           1HB      GLN  75 -11.384  -7.532   5.509
  591    HG2  GLN  75           2HG      GLN  75 -11.103  -6.608   7.596
  592    HG3  GLN  75           1HG      GLN  75 -10.007  -5.357   7.010
  593   HE21  GLN  75          1HE2      GLN  75 -10.808  -3.400   6.693
  594   HE22  GLN  75          2HE2      GLN  75 -12.487  -2.996   6.612
  595    H    ASN  76           H        ASN  76 -10.261  -6.703   3.062
  596    HA   ASN  76           HA       ASN  76 -10.646  -8.904   1.683
  597    HB2  ASN  76           2HB      ASN  76  -9.452  -6.322   0.894
  598    HB3  ASN  76           1HB      ASN  76  -9.175  -7.645  -0.236
  599   HD21  ASN  76          1HD2      ASN  76 -11.104  -5.137   0.323
  600   HD22  ASN  76          2HD2      ASN  76 -12.582  -5.705  -0.369
  601    HA   PRO  77           HA       PRO  77  -6.039  -9.877   0.470
  602    HB2  PRO  77           2HB      PRO  77  -4.625  -7.956   2.248
  603    HB3  PRO  77           1HB      PRO  77  -4.238  -8.458   0.598
  604    HG2  PRO  77           2HG      PRO  77  -5.293  -6.061   1.070
  605    HG3  PRO  77           1HG      PRO  77  -5.782  -7.009  -0.347
  606    HD2  PRO  77           2HD      PRO  77  -7.235  -6.569   2.230
  607    HD3  PRO  77           1HD      PRO  77  -7.867  -6.670   0.575
  608    H    MET  78           H        MET  78  -6.697  -8.766   3.783
  609    HA   MET  78           HA       MET  78  -5.016 -10.445   5.197
  610    HB2  MET  78           2HB      MET  78  -6.033  -9.042   6.660
  611    HB3  MET  78           1HB      MET  78  -7.545  -9.036   5.763
  612    HG2  MET  78           2HG      MET  78  -7.824 -11.435   6.666
  613    HG3  MET  78           1HG      MET  78  -6.588 -10.967   7.832
  614    HE1  MET  78           3HE      MET  78  -8.529 -11.975   9.158
  615    HE2  MET  78           1HE      MET  78 -10.153 -11.586   8.593
  616    HE3  MET  78           2HE      MET  78  -9.554 -10.891  10.099
  617    H    ALA  79           H        ALA  79  -7.733 -11.263   3.300
  618    HA   ALA  79           HA       ALA  79  -7.495 -14.028   4.160
  619    HB1  ALA  79           1HB      ALA  79  -9.723 -12.406   4.715
  620    HB2  ALA  79           2HB      ALA  79  -9.556 -14.143   4.969
  621    HB3  ALA  79           3HB      ALA  79 -10.214 -13.534   3.451
  622    H    LYS  80           H        LYS  80  -6.924 -12.097   1.757
  623    HA   LYS  80           HA       LYS  80  -7.410 -12.096  -0.555
  624    HB2  LYS  80           2HB      LYS  80  -5.951 -14.650   0.134
  625    HB3  LYS  80           1HB      LYS  80  -6.105 -14.027  -1.503
  626    HG2  LYS  80           2HG      LYS  80  -4.051 -13.213  -0.919
  627    HG3  LYS  80           1HG      LYS  80  -5.083 -11.860  -0.453
  628    HD2  LYS  80           2HD      LYS  80  -3.835 -12.064   1.451
  629    HD3  LYS  80           1HD      LYS  80  -5.153 -13.171   1.843
  630    HE2  LYS  80           2HE      LYS  80  -3.845 -15.017   1.645
  631    HE3  LYS  80           1HE      LYS  80  -2.845 -14.305   0.378
  632    HZ1  LYS  80           3HZ      LYS  80  -2.183 -14.589   3.028
  633    HZ2  LYS  80           1HZ      LYS  80  -2.510 -12.938   2.851
  634    HZ3  LYS  80           2HZ      LYS  80  -1.348 -13.680   1.872
  635   H282  PNS 101          8H2       PNS 101   4.020  12.987  -8.535
  636   H281  PNS 101          9H2       PNS 101   3.853  14.658  -9.080
  637   H303  PNS 101          0H3       PNS 101   6.638  15.463  -8.956
  638   H302  PNS 101          1H3       PNS 101   7.286  13.953  -8.316
  639   H301  PNS 101          2H3       PNS 101   5.742  14.569  -7.727
  640   H313  PNS 101          3H3       PNS 101   7.117  12.247  -9.158
  641   H312  PNS 101          4H3       PNS 101   6.418  12.052 -10.766
  642   H311  PNS 101          5H3       PNS 101   5.477  11.621  -9.337
  643    H32  PNS 101           6H3      PNS 101   4.952  14.123 -11.489
  644    H33  PNS 101           7H3      PNS 101   4.753  16.013 -11.069
  645    H36  PNS 101           8H3      PNS 101   8.056  13.057 -10.635
  646   H372  PNS 101          9H3       PNS 101   9.316  13.971 -13.018
  647   H371  PNS 101          0H4       PNS 101  10.085  13.691 -11.457
  648   H382  PNS 101          1H4       PNS 101   8.737  15.925 -10.875
  649   H381  PNS 101          2H4       PNS 101  10.371  15.930 -11.538
  650    H41  PNS 101           3H4      PNS 101   7.015  15.738 -13.179
  651   H422  PNS 101          4H4       PNS 101   7.124  18.560 -13.074
  652   H421  PNS 101          5H4       PNS 101   5.730  17.548 -12.697
  653   H431  PNS 101          7H4       PNS 101   6.002  18.301 -10.598
  654   H432  PNS 101          6H4       PNS 101   7.339  17.144 -10.518
  655    H44  PNS 101           8H4      PNS 101   8.864  19.244 -11.363
  Start of MODEL    7
    1    H1   MET   1           1HT      MET   1  -4.954  -8.845   8.138
    2    H2   MET   1           2HT      MET   1  -4.465  -9.823   9.461
    3    H3   MET   1           3HT      MET   1  -3.553  -8.433   9.036
    4    HA   MET   1           HA       MET   1  -6.222  -7.724   9.464
    5    HB2  MET   1           2HB      MET   1  -5.971  -8.245  12.020
    6    HB3  MET   1           1HB      MET   1  -6.606  -9.471  10.932
    7    HG2  MET   1           2HG      MET   1  -3.734  -9.627  11.100
    8    HG3  MET   1           1HG      MET   1  -4.473  -9.719  12.697
    9    HE1  MET   1           2HE      MET   1  -5.941 -12.137   9.195
   10    HE2  MET   1           3HE      MET   1  -6.115 -10.417   9.544
   11    HE3  MET   1           1HE      MET   1  -7.207 -11.584  10.290
   12    H    ASN   2           H        ASN   2  -4.377  -7.568  12.290
   13    HA   ASN   2           HA       ASN   2  -3.955  -4.773  12.011
   14    HB2  ASN   2           2HB      ASN   2  -2.436  -5.460  14.172
   15    HB3  ASN   2           1HB      ASN   2  -4.160  -5.105  14.231
   16   HD21  ASN   2          1HD2      ASN   2  -2.116  -7.862  13.312
   17   HD22  ASN   2          2HD2      ASN   2  -3.003  -9.036  14.217
   18    H    ASP   3           H        ASP   3  -1.981  -7.601  11.587
   19    HA   ASP   3           HA       ASP   3   0.563  -6.564  11.731
   20    HB2  ASP   3           2HB      ASP   3   1.266  -8.506  10.758
   21    HB3  ASP   3           1HB      ASP   3  -0.392  -8.981  11.118
   22    H    VAL   4           H        VAL   4  -1.689  -6.426   9.040
   23    HA   VAL   4           HA       VAL   4   0.085  -5.272   7.172
   24    HB   VAL   4           HB       VAL   4  -2.119  -4.432   6.102
   25   HG11  VAL   4          1HG1      VAL   4  -1.533  -6.194   4.867
   26   HG12  VAL   4          2HG1      VAL   4  -2.626  -7.144   5.875
   27   HG13  VAL   4          3HG1      VAL   4  -0.910  -7.061   6.272
   28   HG21  VAL   4          3HG2      VAL   4  -4.127  -5.586   6.856
   29   HG22  VAL   4          1HG2      VAL   4  -3.467  -4.568   8.137
   30   HG23  VAL   4          2HG2      VAL   4  -3.222  -6.314   8.184
   31    H    LEU   5           H        LEU   5  -2.277  -3.844   9.388
   32    HA   LEU   5           HA       LEU   5  -1.869  -1.177   8.596
   33    HB2  LEU   5           2HB      LEU   5  -3.438  -2.589  10.516
   34    HB3  LEU   5           1HB      LEU   5  -2.680  -1.215  11.294
   35    HG   LEU   5           HG       LEU   5  -3.605   0.127   9.261
   36   HD11  LEU   5          1HD1      LEU   5  -4.777  -2.507   8.872
   37   HD12  LEU   5          2HD1      LEU   5  -4.669  -1.138   7.766
   38   HD13  LEU   5          3HD1      LEU   5  -5.980  -1.220   8.943
   39   HD21  LEU   5          3HD2      LEU   5  -4.308   0.170  11.716
   40   HD22  LEU   5          1HD2      LEU   5  -5.640  -0.878  11.225
   41   HD23  LEU   5          2HD2      LEU   5  -5.481   0.733  10.524
   42    H    THR   6           H        THR   6  -0.314  -3.223  10.952
   43    HA   THR   6           HA       THR   6   1.000  -1.277  12.441
   44    HB   THR   6           HB       THR   6   0.958  -4.068  12.350
   45    HG1  THR   6           1HG      THR   6   2.536  -2.442  14.048
   46   HG21  THR   6          3HG2      THR   6   3.473  -4.413  12.836
   47   HG22  THR   6          1HG2      THR   6   3.685  -2.999  11.803
   48   HG23  THR   6          2HG2      THR   6   2.896  -4.444  11.169
   49    H    ARG   7           H        ARG   7   2.348  -3.197   9.775
   50    HA   ARG   7           HA       ARG   7   4.646  -1.515   9.601
   51    HB2  ARG   7           2HB      ARG   7   5.362  -2.940   7.780
   52    HB3  ARG   7           1HB      ARG   7   4.792  -3.921   9.122
   53    HG2  ARG   7           2HG      ARG   7   3.887  -4.972   7.278
   54    HG3  ARG   7           1HG      ARG   7   2.555  -3.965   7.851
   55    HD2  ARG   7           2HD      ARG   7   3.900  -2.291   6.135
   56    HD3  ARG   7           1HD      ARG   7   4.039  -3.862   5.343
   57    HE   ARG   7           HE       ARG   7   1.796  -2.289   5.271
   58   HH11  ARG   7          1HH1      ARG   7   2.585  -5.531   6.251
   59   HH12  ARG   7          2HH1      ARG   7   0.989  -6.145   5.975
   60   HH21  ARG   7          1HH2      ARG   7  -0.317  -3.079   4.915
   61   HH22  ARG   7          2HH2      ARG   7  -0.658  -4.749   5.214
   62    H    VAL   8           H        VAL   8   1.736  -2.036   7.657
   63    HA   VAL   8           HA       VAL   8   2.393  -0.349   5.535
   64    HB   VAL   8           HB       VAL   8   0.268  -1.936   6.045
   65   HG11  VAL   8          1HG1      VAL   8  -0.754  -0.359   7.588
   66   HG12  VAL   8          2HG1      VAL   8  -1.748  -0.544   6.143
   67   HG13  VAL   8          3HG1      VAL   8  -0.740   0.890   6.345
   68   HG21  VAL   8          3HG2      VAL   8  -0.778  -0.538   4.039
   69   HG22  VAL   8          1HG2      VAL   8   0.626  -1.586   3.830
   70   HG23  VAL   8          2HG2      VAL   8   0.845   0.153   4.027
   71    H    LEU   9           H        LEU   9   0.540   0.338   8.492
   72    HA   LEU   9           HA       LEU   9   0.035   3.044   7.994
   73    HB2  LEU   9           2HB      LEU   9  -0.728   3.161  10.148
   74    HB3  LEU   9           1HB      LEU   9  -0.767   1.429   9.909
   75    HG   LEU   9           HG       LEU   9   1.634   1.512  10.951
   76   HD11  LEU   9          1HD1      LEU   9   1.203   4.173  10.951
   77   HD12  LEU   9          2HD1      LEU   9   2.275   3.349  12.083
   78   HD13  LEU   9          3HD1      LEU   9   0.628   3.758  12.565
   79   HD21  LEU   9          3HD2      LEU   9   0.573   1.392  13.232
   80   HD22  LEU   9          1HD2      LEU   9  -0.103   0.314  12.012
   81   HD23  LEU   9          2HD2      LEU   9  -0.956   1.795  12.450
   82    H    GLU  10           H        GLU  10   2.776   1.475   9.589
   83    HA   GLU  10           HA       GLU  10   4.129   3.830  10.327
   84    HB2  GLU  10           2HB      GLU  10   6.112   2.357  10.554
   85    HB3  GLU  10           1HB      GLU  10   4.686   1.724  11.366
   86    HG2  GLU  10           2HG      GLU  10   4.320   0.120   9.659
   87    HG3  GLU  10           1HG      GLU  10   5.527   0.865   8.613
   88    H    VAL  11           H        VAL  11   4.060   1.945   7.406
   89    HA   VAL  11           HA       VAL  11   6.316   2.908   6.120
   90    HB   VAL  11           HB       VAL  11   3.729   2.047   4.949
   91   HG11  VAL  11          1HG1      VAL  11   5.654   1.555   3.063
   92   HG12  VAL  11          2HG1      VAL  11   6.110   3.135   3.700
   93   HG13  VAL  11          3HG1      VAL  11   4.498   2.886   3.031
   94   HG21  VAL  11          3HG2      VAL  11   6.104   0.347   4.720
   95   HG22  VAL  11          1HG2      VAL  11   4.431  -0.084   5.082
   96   HG23  VAL  11          2HG2      VAL  11   5.476   0.547   6.355
   97    H    VAL  12           H        VAL  12   2.996   4.056   5.785
   98    HA   VAL  12           HA       VAL  12   3.660   6.272   4.154
   99    HB   VAL  12           HB       VAL  12   1.419   6.959   4.340
  100   HG11  VAL  12          1HG1      VAL  12   0.126   4.748   4.294
  101   HG12  VAL  12          2HG1      VAL  12   1.692   3.980   4.556
  102   HG13  VAL  12          3HG1      VAL  12   1.423   4.966   3.119
  103   HG21  VAL  12          3HG2      VAL  12  -0.092   6.120   6.134
  104   HG22  VAL  12          1HG2      VAL  12   1.212   7.149   6.723
  105   HG23  VAL  12          2HG2      VAL  12   1.313   5.400   6.918
  106    H    LYS  13           H        LYS  13   2.882   6.024   7.615
  107    HA   LYS  13           HA       LYS  13   3.063   8.701   8.293
  108    HB2  LYS  13           2HB      LYS  13   3.247   8.011  10.533
  109    HB3  LYS  13           1HB      LYS  13   2.353   6.720   9.743
  110    HG2  LYS  13           2HG      LYS  13   4.437   5.421   9.563
  111    HG3  LYS  13           1HG      LYS  13   5.283   6.704  10.442
  112    HD2  LYS  13           2HD      LYS  13   2.953   5.089  11.485
  113    HD3  LYS  13           1HD      LYS  13   4.647   4.852  11.923
  114    HE2  LYS  13           2HE      LYS  13   3.838   7.606  12.266
  115    HE3  LYS  13           1HE      LYS  13   2.801   6.515  13.182
  116    HZ1  LYS  13           3HZ      LYS  13   5.067   7.426  14.141
  117    HZ2  LYS  13           1HZ      LYS  13   5.684   6.072  13.334
  118    HZ3  LYS  13           2HZ      LYS  13   4.497   5.880  14.523
  119    H    ASN  14           H        ASN  14   5.661   6.269   8.292
  120    HA   ASN  14           HA       ASN  14   7.641   8.257   8.900
  121    HB2  ASN  14           2HB      ASN  14   8.119   5.390   8.096
  122    HB3  ASN  14           1HB      ASN  14   9.215   6.455   8.972
  123   HD21  ASN  14          1HD2      ASN  14   7.124   3.960   9.293
  124   HD22  ASN  14          2HD2      ASN  14   6.723   4.123  10.964
  125    H    PHE  15           H        PHE  15   6.045   7.441   6.146
  126    HA   PHE  15           HA       PHE  15   8.161   7.373   4.261
  127    HB2  PHE  15           2HB      PHE  15   5.240   7.389   4.203
  128    HB3  PHE  15           1HB      PHE  15   5.956   8.288   2.870
  129    HD1  PHE  15           2HD      PHE  15   8.034   5.662   4.106
  130    HD2  PHE  15           1HD      PHE  15   4.793   6.511   1.483
  131    HE1  PHE  15           2HE      PHE  15   8.455   3.553   2.911
  132    HE2  PHE  15           1HE      PHE  15   5.206   4.403   0.283
  133    HZ   PHE  15           HZ       PHE  15   7.040   2.922   0.996
  134    H    GLU  16           H        GLU  16   6.532   9.870   5.952
  135    HA   GLU  16           HA       GLU  16   7.477  12.036   6.162
  136    HB2  GLU  16           2HB      GLU  16   8.923  12.934   4.611
  137    HB3  GLU  16           1HB      GLU  16   9.199  11.218   4.352
  138    HG2  GLU  16           2HG      GLU  16   8.672  11.456   2.227
  139    HG3  GLU  16           1HG      GLU  16   7.061  12.003   2.686
  140    H    LYS  17           H        LYS  17   5.176  10.635   4.217
  141    HA   LYS  17           HA       LYS  17   4.063  12.827   2.859
  142    HB2  LYS  17           2HB      LYS  17   3.016  10.173   3.765
  143    HB3  LYS  17           1HB      LYS  17   1.900  11.369   3.121
  144    HG2  LYS  17           2HG      LYS  17   2.445  10.090   1.271
  145    HG3  LYS  17           1HG      LYS  17   3.511  11.488   1.121
  146    HD2  LYS  17           2HD      LYS  17   4.423   9.004   2.527
  147    HD3  LYS  17           1HD      LYS  17   4.494   9.123   0.768
  148    HE2  LYS  17           2HE      LYS  17   5.559  11.508   1.944
  149    HE3  LYS  17           1HE      LYS  17   6.348  10.098   2.651
  150    HZ1  LYS  17           3HZ      LYS  17   7.494   9.785   0.797
  151    HZ2  LYS  17           1HZ      LYS  17   6.898  11.258   0.215
  152    HZ3  LYS  17           2HZ      LYS  17   6.101   9.814  -0.162
  153    H    VAL  18           H        VAL  18   3.635  11.619   6.136
  154    HA   VAL  18           HA       VAL  18   2.905  14.059   7.236
  155    HB   VAL  18           HB       VAL  18   0.400  13.148   7.710
  156   HG11  VAL  18          1HG1      VAL  18   0.485  15.356   7.167
  157   HG12  VAL  18          2HG1      VAL  18  -0.149  14.731   5.644
  158   HG13  VAL  18          3HG1      VAL  18   1.570  15.093   5.802
  159   HG21  VAL  18          3HG2      VAL  18  -0.613  12.340   5.700
  160   HG22  VAL  18          1HG2      VAL  18   0.761  11.298   6.069
  161   HG23  VAL  18          2HG2      VAL  18   0.896  12.518   4.804
  162    H    ASP  19           H        ASP  19   2.741  13.951   9.454
  163    HA   ASP  19           HA       ASP  19   3.688  11.608  10.707
  164    HB2  ASP  19           2HB      ASP  19   3.510  14.270  11.397
  165    HB3  ASP  19           1HB      ASP  19   2.349  13.512  12.483
  166    H    ALA  20           H        ALA  20   2.665   9.949  11.663
  167    HA   ALA  20           HA       ALA  20  -0.025   9.400  11.135
  168    HB1  ALA  20           1HB      ALA  20   0.705   7.882  13.385
  169    HB2  ALA  20           2HB      ALA  20   2.169   8.089  12.423
  170    HB3  ALA  20           3HB      ALA  20   0.725   7.388  11.692
  171    H    SER  21           H        SER  21   1.369  11.374  13.529
  172    HA   SER  21           HA       SER  21  -0.538  11.084  15.588
  173    HB2  SER  21           2HB      SER  21   1.449  12.124  16.260
  174    HB3  SER  21           1HB      SER  21   1.456  13.215  14.875
  175    HG   SER  21           HG       SER  21   0.182  14.548  15.911
  176    H    LYS  22           H        LYS  22  -0.645  12.628  12.543
  177    HA   LYS  22           HA       LYS  22  -2.873  14.336  13.291
  178    HB2  LYS  22           2HB      LYS  22  -2.655  15.344  11.120
  179    HB3  LYS  22           1HB      LYS  22  -1.053  15.214  11.834
  180    HG2  LYS  22           2HG      LYS  22  -1.187  12.886  10.460
  181    HG3  LYS  22           1HG      LYS  22  -2.164  13.942   9.438
  182    HD2  LYS  22           2HD      LYS  22   0.723  13.946   9.941
  183    HD3  LYS  22           1HD      LYS  22  -0.187  14.544   8.552
  184    HE2  LYS  22           2HE      LYS  22  -0.887  16.478  10.063
  185    HE3  LYS  22           1HE      LYS  22   0.386  15.933  11.154
  186    HZ1  LYS  22           3HZ      LYS  22   0.677  17.618   9.010
  187    HZ2  LYS  22           1HZ      LYS  22   1.330  16.150   8.477
  188    HZ3  LYS  22           2HZ      LYS  22   1.922  16.878   9.884
  189    H    VAL  23           H        VAL  23  -2.286  11.261  11.987
  190    HA   VAL  23           HA       VAL  23  -4.642  11.075  10.372
  191    HB   VAL  23           HB       VAL  23  -4.052   8.861   9.934
  192   HG11  VAL  23          1HG1      VAL  23  -2.342   9.825   8.831
  193   HG12  VAL  23          2HG1      VAL  23  -1.358   9.036  10.064
  194   HG13  VAL  23          3HG1      VAL  23  -1.803  10.733  10.244
  195   HG21  VAL  23          3HG2      VAL  23  -3.063   8.911  12.698
  196   HG22  VAL  23          1HG2      VAL  23  -2.097   7.946  11.580
  197   HG23  VAL  23          2HG2      VAL  23  -3.815   7.604  11.783
  198    H    THR  24           H        THR  24  -6.644  10.683  11.037
  199    HA   THR  24           HA       THR  24  -7.046   9.588  13.706
  200    HB   THR  24           HB       THR  24  -7.860  12.016  12.893
  201    HG1  THR  24           1HG      THR  24  -8.227  11.620  14.953
  202   HG21  THR  24          3HG2      THR  24  -9.966  10.122  11.995
  203   HG22  THR  24          1HG2      THR  24  -9.423  11.635  11.273
  204   HG23  THR  24          2HG2      THR  24 -10.438  11.660  12.714
  205    HA   PRO  25           HA       PRO  25  -9.191   6.067  12.188
  206    HB2  PRO  25           2HB      PRO  25 -11.549   6.158  13.652
  207    HB3  PRO  25           1HB      PRO  25 -10.026   5.468  14.218
  208    HG2  PRO  25           2HG      PRO  25 -11.205   8.157  14.756
  209    HG3  PRO  25           1HG      PRO  25 -10.312   7.083  15.848
  210    HD2  PRO  25           2HD      PRO  25  -9.152   9.232  14.745
  211    HD3  PRO  25           1HD      PRO  25  -8.252   7.720  14.989
  212    H    GLU  26           H        GLU  26 -11.125   9.015  12.439
  213    HA   GLU  26           HA       GLU  26 -12.731   8.140  10.163
  214    HB2  GLU  26           2HB      GLU  26 -13.409   9.442  12.568
  215    HB3  GLU  26           1HB      GLU  26 -13.615  10.633  11.291
  216    HG2  GLU  26           2HG      GLU  26 -15.117   8.154  11.837
  217    HG3  GLU  26           1HG      GLU  26 -15.673   9.710  11.225
  218    H    SER  27           H        SER  27  -9.932   9.493  10.428
  219    HA   SER  27           HA       SER  27 -10.195  12.002   9.130
  220    HB2  SER  27           2HB      SER  27  -8.163  12.017  10.130
  221    HB3  SER  27           1HB      SER  27  -7.992  10.265  10.024
  222    HG   SER  27           HG       SER  27  -6.596  11.781   8.667
  223    H    HIS  28           H        HIS  28 -10.232  12.513   7.024
  224    HA   HIS  28           HA       HIS  28 -10.577  10.418   5.105
  225    HB2  HIS  28           2HB      HIS  28 -10.877  13.379   5.116
  226    HB3  HIS  28           1HB      HIS  28 -10.638  12.586   3.561
  227    HD1  HIS  28           1HD      HIS  28 -12.402  10.119   5.234
  228    HD2  HIS  28           2HD      HIS  28 -13.493  13.860   3.794
  229    HE1  HIS  28           1HE      HIS  28 -14.902  10.037   4.978
  230    HE2  HIS  28           2HE      HIS  28 -15.549  12.341   4.190
  231    H    PHE  29           H        PHE  29  -9.305  10.066   3.242
  232    HA   PHE  29           HA       PHE  29  -6.520  10.274   3.657
  233    HB2  PHE  29           2HB      PHE  29  -7.625   8.451   2.369
  234    HB3  PHE  29           1HB      PHE  29  -7.959   9.610   1.087
  235    HD1  PHE  29           2HD      PHE  29  -4.845  10.100   2.798
  236    HD2  PHE  29           1HD      PHE  29  -6.728   7.974  -0.371
  237    HE1  PHE  29           2HE      PHE  29  -2.641   9.631   1.809
  238    HE2  PHE  29           1HE      PHE  29  -4.528   7.500  -1.366
  239    HZ   PHE  29           HZ       PHE  29  -2.482   8.330  -0.277
  240    H    VAL  30           H        VAL  30  -7.828  11.215   0.568
  241    HA   VAL  30           HA       VAL  30  -5.976  13.245   0.124
  242    HB   VAL  30           HB       VAL  30  -6.984  13.595  -1.885
  243   HG11  VAL  30          1HG1      VAL  30  -7.989  11.571  -2.711
  244   HG12  VAL  30          2HG1      VAL  30  -8.412  11.067  -1.075
  245   HG13  VAL  30          3HG1      VAL  30  -6.719  11.151  -1.561
  246   HG21  VAL  30          3HG2      VAL  30  -9.678  13.161  -0.600
  247   HG22  VAL  30          1HG2      VAL  30  -9.393  13.654  -2.268
  248   HG23  VAL  30          2HG2      VAL  30  -8.940  14.725  -0.942
  249    H    LYS  31           H        LYS  31  -9.083  13.315   1.652
  250    HA   LYS  31           HA       LYS  31  -9.432  16.127   1.624
  251    HB2  LYS  31           2HB      LYS  31 -10.663  14.449   3.759
  252    HB3  LYS  31           1HB      LYS  31 -11.363  15.764   2.826
  253    HG2  LYS  31           2HG      LYS  31 -10.836  12.960   1.870
  254    HG3  LYS  31           1HG      LYS  31 -12.406  13.690   2.208
  255    HD2  LYS  31           2HD      LYS  31 -10.677  15.103   0.268
  256    HD3  LYS  31           1HD      LYS  31 -11.347  13.556  -0.252
  257    HE2  LYS  31           2HE      LYS  31 -13.119  14.798  -0.860
  258    HE3  LYS  31           1HE      LYS  31 -13.532  14.709   0.851
  259    HZ1  LYS  31           3HZ      LYS  31 -13.515  16.922   0.774
  260    HZ2  LYS  31           1HZ      LYS  31 -12.711  16.969  -0.715
  261    HZ3  LYS  31           2HZ      LYS  31 -11.828  16.817   0.720
  262    H    ASP  32           H        ASP  32  -7.854  13.902   3.828
  263    HA   ASP  32           HA       ASP  32  -7.483  15.932   5.834
  264    HB2  ASP  32           2HB      ASP  32  -7.897  13.540   6.423
  265    HB3  ASP  32           1HB      ASP  32  -6.318  13.149   5.749
  266    H    LEU  33           H        LEU  33  -6.051  15.383   2.968
  267    HA   LEU  33           HA       LEU  33  -4.198  16.954   2.502
  268    HB2  LEU  33           2HB      LEU  33  -3.106  15.533   4.922
  269    HB3  LEU  33           1HB      LEU  33  -2.080  16.427   3.816
  270    HG   LEU  33           HG       LEU  33  -4.437  17.786   5.063
  271   HD11  LEU  33          1HD1      LEU  33  -1.732  17.534   6.367
  272   HD12  LEU  33          2HD1      LEU  33  -3.179  16.671   6.886
  273   HD13  LEU  33          3HD1      LEU  33  -3.126  18.432   6.969
  274   HD21  LEU  33          3HD2      LEU  33  -3.577  19.537   4.010
  275   HD22  LEU  33          1HD2      LEU  33  -2.301  18.513   3.353
  276   HD23  LEU  33          2HD2      LEU  33  -2.063  19.341   4.891
  277    H    GLY  34           H        GLY  34  -5.270  14.455   1.534
  278    HA2  GLY  34           2HA      GLY  34  -4.049  12.269   1.002
  279    HA3  GLY  34           1HA      GLY  34  -4.393  13.305  -0.376
  280    H    LEU  35           H        LEU  35  -2.149  11.361   0.496
  281    HA   LEU  35           HA       LEU  35   0.229  12.870   0.674
  282    HB2  LEU  35           2HB      LEU  35  -0.146  10.065  -0.373
  283    HB3  LEU  35           1HB      LEU  35   1.371  10.778   0.137
  284    HG   LEU  35           HG       LEU  35   1.017  10.160   2.245
  285   HD11  LEU  35          1HD1      LEU  35  -1.822  11.116   2.257
  286   HD12  LEU  35          2HD1      LEU  35  -0.474  12.254   2.282
  287   HD13  LEU  35          3HD1      LEU  35  -0.656  11.072   3.580
  288   HD21  LEU  35          3HD2      LEU  35  -1.066   8.696   2.666
  289   HD22  LEU  35          1HD2      LEU  35   0.153   8.130   1.523
  290   HD23  LEU  35          2HD2      LEU  35  -1.338   8.862   0.931
  291    H    ASN  36           H        ASN  36   1.900  13.100  -0.939
  292    HA   ASN  36           HA       ASN  36   0.981  14.178  -3.355
  293    HB2  ASN  36           2HB      ASN  36   3.522  13.859  -3.982
  294    HB3  ASN  36           1HB      ASN  36   3.040  15.028  -2.757
  295   HD21  ASN  36          1HD2      ASN  36   2.779  11.698  -1.999
  296   HD22  ASN  36          2HD2      ASN  36   4.152  11.599  -0.955
  297    H    SER  37           H        SER  37   2.171  13.378  -5.504
  298    HA   SER  37           HA       SER  37   0.889  10.983  -6.239
  299    HB2  SER  37           2HB      SER  37   2.364  13.059  -7.548
  300    HB3  SER  37           1HB      SER  37   2.968  11.495  -8.095
  301    H    LEU  38           H        LEU  38   4.317  11.724  -5.859
  302    HA   LEU  38           HA       LEU  38   5.423   9.265  -6.351
  303    HB2  LEU  38           2HB      LEU  38   7.304   9.943  -4.997
  304    HB3  LEU  38           1HB      LEU  38   6.717  11.307  -5.930
  305    HG   LEU  38           HG       LEU  38   7.376  11.848  -3.578
  306   HD11  LEU  38          1HD1      LEU  38   5.630  13.066  -5.045
  307   HD12  LEU  38          2HD1      LEU  38   5.730  13.451  -3.327
  308   HD13  LEU  38          3HD1      LEU  38   4.457  12.383  -3.920
  309   HD21  LEU  38          3HD2      LEU  38   4.826  10.745  -2.575
  310   HD22  LEU  38          1HD2      LEU  38   6.365  10.982  -1.751
  311   HD23  LEU  38          2HD2      LEU  38   6.149   9.605  -2.829
  312    H    ASP  39           H        ASP  39   3.500  10.232  -3.676
  313    HA   ASP  39           HA       ASP  39   4.349   8.201  -1.869
  314    HB2  ASP  39           2HB      ASP  39   3.358  10.054  -0.828
  315    HB3  ASP  39           1HB      ASP  39   2.005  10.078  -1.954
  316    H    VAL  40           H        VAL  40   0.957   8.428  -2.452
  317    HA   VAL  40           HA       VAL  40   0.115   5.956  -2.278
  318    HB   VAL  40           HB       VAL  40  -0.950   8.170  -3.512
  319   HG11  VAL  40          1HG1      VAL  40   0.066   6.926  -5.634
  320   HG12  VAL  40          2HG1      VAL  40  -1.459   7.810  -5.698
  321   HG13  VAL  40          3HG1      VAL  40  -1.462   6.055  -5.524
  322   HG21  VAL  40          3HG2      VAL  40  -1.823   5.779  -2.341
  323   HG22  VAL  40          1HG2      VAL  40  -2.681   5.905  -3.876
  324   HG23  VAL  40          2HG2      VAL  40  -2.785   7.214  -2.698
  325    H    VAL  41           H        VAL  41   2.054   7.078  -4.982
  326    HA   VAL  41           HA       VAL  41   1.756   4.764  -6.584
  327    HB   VAL  41           HB       VAL  41   3.844   5.574  -7.722
  328   HG11  VAL  41          1HG1      VAL  41   2.699   7.873  -8.316
  329   HG12  VAL  41          2HG1      VAL  41   1.368   7.185  -7.385
  330   HG13  VAL  41          3HG1      VAL  41   1.983   6.339  -8.806
  331   HG21  VAL  41          3HG2      VAL  41   5.206   6.922  -6.606
  332   HG22  VAL  41          1HG2      VAL  41   4.019   7.121  -5.320
  333   HG23  VAL  41          2HG2      VAL  41   3.981   8.185  -6.723
  334    H    GLU  42           H        GLU  42   4.262   5.792  -4.287
  335    HA   GLU  42           HA       GLU  42   5.780   3.402  -4.610
  336    HB2  GLU  42           2HB      GLU  42   7.380   4.531  -3.524
  337    HB3  GLU  42           1HB      GLU  42   6.296   5.913  -3.593
  338    HG2  GLU  42           2HG      GLU  42   7.019   5.703  -1.353
  339    HG3  GLU  42           1HG      GLU  42   5.342   5.163  -1.407
  340    H    VAL  43           H        VAL  43   3.710   4.711  -2.085
  341    HA   VAL  43           HA       VAL  43   3.912   2.554  -0.305
  342    HB   VAL  43           HB       VAL  43   2.937   4.249   0.823
  343   HG11  VAL  43          1HG1      VAL  43   1.375   5.887  -0.175
  344   HG12  VAL  43          2HG1      VAL  43   1.493   5.014  -1.703
  345   HG13  VAL  43          3HG1      VAL  43   2.919   5.795  -1.020
  346   HG21  VAL  43          3HG2      VAL  43   1.337   2.316   0.830
  347   HG22  VAL  43          1HG2      VAL  43   0.398   3.213  -0.356
  348   HG23  VAL  43          2HG2      VAL  43   0.645   3.884   1.250
  349    H    VAL  44           H        VAL  44   1.735   3.196  -2.978
  350    HA   VAL  44           HA       VAL  44  -0.081   1.102  -2.554
  351    HB   VAL  44           HB       VAL  44  -0.513   2.894  -4.171
  352   HG11  VAL  44          1HG1      VAL  44   1.814   3.038  -5.032
  353   HG12  VAL  44          2HG1      VAL  44   0.590   2.997  -6.301
  354   HG13  VAL  44          3HG1      VAL  44   1.529   1.550  -5.934
  355   HG21  VAL  44          3HG2      VAL  44  -1.277   1.408  -6.081
  356   HG22  VAL  44          1HG2      VAL  44  -1.855   0.979  -4.471
  357   HG23  VAL  44          2HG2      VAL  44  -0.533   0.071  -5.204
  358    H    PHE  45           H        PHE  45   2.888   1.230  -4.508
  359    HA   PHE  45           HA       PHE  45   2.782  -1.423  -5.428
  360    HB2  PHE  45           2HB      PHE  45   5.186   0.355  -4.958
  361    HB3  PHE  45           1HB      PHE  45   5.208  -1.148  -5.876
  362    HD1  PHE  45           1HD      PHE  45   2.458  -0.678  -7.188
  363    HD2  PHE  45           2HD      PHE  45   5.922   1.752  -6.742
  364    HE1  PHE  45           1HE      PHE  45   1.849   0.557  -9.227
  365    HE2  PHE  45           2HE      PHE  45   5.319   2.993  -8.780
  366    HZ   PHE  45           HZ       PHE  45   3.279   2.395 -10.025
  367    H    ALA  46           H        ALA  46   3.610  -0.055  -2.396
  368    HA   ALA  46           HA       ALA  46   5.220  -2.161  -1.397
  369    HB1  ALA  46           1HB      ALA  46   3.668   0.018  -0.030
  370    HB2  ALA  46           2HB      ALA  46   5.403  -0.047  -0.339
  371    HB3  ALA  46           3HB      ALA  46   4.675  -1.143   0.836
  372    H    ILE  47           H        ILE  47   2.074  -1.212  -0.131
  373    HA   ILE  47           HA       ILE  47   1.377  -3.476   1.186
  374    HB   ILE  47           HB       ILE  47  -1.055  -2.856   0.155
  375   HG12  ILE  47          2HG1      ILE  47   0.644  -0.955  -1.002
  376   HG13  ILE  47          1HG1      ILE  47  -1.115  -0.904  -0.941
  377   HG21  ILE  47          1HG2      ILE  47   0.122  -1.025   2.194
  378   HG22  ILE  47          2HG2      ILE  47  -0.002  -2.750   2.538
  379   HG23  ILE  47          3HG2      ILE  47  -1.453  -1.819   2.171
  380   HD11  ILE  47          3HD1      ILE  47  -1.141   0.699   0.632
  381   HD12  ILE  47          1HD1      ILE  47   0.474   1.036   0.009
  382   HD13  ILE  47          2HD1      ILE  47   0.276   0.061   1.465
  383    H    GLU  48           H        GLU  48   0.923  -2.889  -2.288
  384    HA   GLU  48           HA       GLU  48  -0.468  -5.207  -2.923
  385    HB2  GLU  48           2HB      GLU  48  -0.046  -3.320  -4.488
  386    HB3  GLU  48           1HB      GLU  48   1.626  -3.846  -4.625
  387    HG2  GLU  48           2HG      GLU  48  -0.481  -5.842  -5.208
  388    HG3  GLU  48           1HG      GLU  48  -0.243  -4.540  -6.372
  389    H    GLN  49           H        GLN  49   2.934  -4.669  -2.398
  390    HA   GLN  49           HA       GLN  49   3.903  -7.133  -3.346
  391    HB2  GLN  49           2HB      GLN  49   5.207  -5.006  -2.700
  392    HB3  GLN  49           1HB      GLN  49   5.139  -5.625  -1.056
  393    HG2  GLN  49           2HG      GLN  49   6.908  -6.882  -1.459
  394    HG3  GLN  49           1HG      GLN  49   6.019  -7.734  -2.720
  395   HE21  GLN  49          1HE2      GLN  49   6.815  -4.330  -2.802
  396   HE22  GLN  49          2HE2      GLN  49   7.929  -4.424  -4.119
  397    H    GLU  50           H        GLU  50   3.049  -6.095  -0.042
  398    HA   GLU  50           HA       GLU  50   3.131  -8.875   0.795
  399    HB2  GLU  50           2HB      GLU  50   3.524  -6.291   2.150
  400    HB3  GLU  50           1HB      GLU  50   2.660  -7.503   3.086
  401    HG2  GLU  50           2HG      GLU  50   5.480  -7.392   2.274
  402    HG3  GLU  50           1HG      GLU  50   4.736  -8.077   3.718
  403    H    PHE  51           H        PHE  51   0.967  -7.945  -0.824
  404    HA   PHE  51           HA       PHE  51  -1.219  -8.504   0.999
  405    HB2  PHE  51           2HB      PHE  51  -1.000  -6.177  -0.855
  406    HB3  PHE  51           1HB      PHE  51  -2.584  -6.865  -0.523
  407    HD1  PHE  51           1HD      PHE  51   0.455  -5.838   1.394
  408    HD2  PHE  51           2HD      PHE  51  -3.793  -5.861   1.131
  409    HE1  PHE  51           1HE      PHE  51   0.327  -4.511   3.451
  410    HE2  PHE  51           2HE      PHE  51  -3.929  -4.533   3.198
  411    HZ   PHE  51           HZ       PHE  51  -1.868  -3.855   4.360
  412    H    ILE  52           H        ILE  52   0.293  -9.032  -1.998
  413    HA   ILE  52           HA       ILE  52  -0.074 -10.495  -3.688
  414    HB   ILE  52           HB       ILE  52  -0.936 -12.445  -3.074
  415   HG12  ILE  52          2HG1      ILE  52  -3.141 -12.180  -3.767
  416   HG13  ILE  52          1HG1      ILE  52  -3.318 -12.556  -2.068
  417   HG21  ILE  52          1HG2      ILE  52  -1.070 -12.818  -0.795
  418   HG22  ILE  52          2HG2      ILE  52  -1.872 -11.279  -0.486
  419   HG23  ILE  52          3HG2      ILE  52  -0.155 -11.314  -0.886
  420   HD11  ILE  52          3HD1      ILE  52  -3.134  -9.713  -2.498
  421   HD12  ILE  52          1HD1      ILE  52  -4.359 -10.656  -1.652
  422   HD13  ILE  52          2HD1      ILE  52  -4.458 -10.444  -3.400
  423    H    LEU  53           H        LEU  53  -1.509  -7.894  -3.474
  424    HA   LEU  53           HA       LEU  53  -3.063  -8.152  -5.836
  425    HB2  LEU  53           2HB      LEU  53  -4.737  -8.933  -4.263
  426    HB3  LEU  53           1HB      LEU  53  -4.495  -7.515  -3.260
  427    HG   LEU  53           HG       LEU  53  -6.552  -7.626  -4.838
  428   HD11  LEU  53          1HD1      LEU  53  -6.392  -5.632  -3.754
  429   HD12  LEU  53          2HD1      LEU  53  -6.057  -5.087  -5.397
  430   HD13  LEU  53          3HD1      LEU  53  -4.728  -5.355  -4.270
  431   HD21  LEU  53          3HD2      LEU  53  -4.633  -7.997  -6.747
  432   HD22  LEU  53          1HD2      LEU  53  -4.964  -6.269  -6.884
  433   HD23  LEU  53          2HD2      LEU  53  -6.277  -7.435  -7.051
  434    H    ASP  54           H        ASP  54  -3.088  -6.271  -6.936
  435    HA   ASP  54           HA       ASP  54  -1.780  -4.005  -5.729
  436    HB2  ASP  54           2HB      ASP  54  -1.328  -3.255  -7.875
  437    HB3  ASP  54           1HB      ASP  54  -1.372  -5.000  -8.110
  438    H    ILE  55           H        ILE  55  -2.645  -1.907  -5.638
  439    HA   ILE  55           HA       ILE  55  -5.476  -1.592  -6.224
  440    HB   ILE  55           HB       ILE  55  -4.956  -2.264  -3.743
  441   HG12  ILE  55          2HG1      ILE  55  -7.081  -1.184  -4.962
  442   HG13  ILE  55          1HG1      ILE  55  -7.029  -1.461  -3.224
  443   HG21  ILE  55          1HG2      ILE  55  -4.599   0.707  -3.502
  444   HG22  ILE  55          2HG2      ILE  55  -3.225  -0.394  -3.619
  445   HG23  ILE  55          3HG2      ILE  55  -4.359  -0.537  -2.275
  446   HD11  ILE  55          3HD1      ILE  55  -7.890   0.727  -3.639
  447   HD12  ILE  55          1HD1      ILE  55  -6.511   1.126  -4.663
  448   HD13  ILE  55          2HD1      ILE  55  -6.282   0.883  -2.931
  449    HA   PRO  56           HA       PRO  56  -2.663   2.229  -6.716
  450    HB2  PRO  56           2HB      PRO  56  -1.630   1.933  -9.184
  451    HB3  PRO  56           1HB      PRO  56  -0.843   1.265  -7.750
  452    HG2  PRO  56           2HG      PRO  56  -2.517  -0.108  -9.806
  453    HG3  PRO  56           1HG      PRO  56  -1.053  -0.677  -8.987
  454    HD2  PRO  56           2HD      PRO  56  -3.614  -1.417  -8.292
  455    HD3  PRO  56           1HD      PRO  56  -2.222  -1.460  -7.193
  456    H    ASP  57           H        ASP  57  -3.760   0.955  -9.849
  457    HA   ASP  57           HA       ASP  57  -4.772   3.241 -10.920
  458    HB2  ASP  57           2HB      ASP  57  -6.584   1.313 -11.784
  459    HB3  ASP  57           1HB      ASP  57  -5.054   1.729 -12.549
  460    H    HIS  58           H        HIS  58  -7.475   2.795 -11.535
  461    HA   HIS  58           HA       HIS  58  -8.891   4.350  -9.908
  462    HB2  HIS  58           2HB      HIS  58 -10.241   1.824 -10.790
  463    HB3  HIS  58           1HB      HIS  58 -10.852   3.475 -10.804
  464    HD1  HIS  58           1HD      HIS  58 -10.553   1.277 -13.228
  465    HD2  HIS  58           2HD      HIS  58  -8.400   4.779 -12.623
  466    HE1  HIS  58           1HE      HIS  58  -9.671   1.924 -15.493
  467    HE2  HIS  58           2HE      HIS  58  -8.440   4.089 -15.116
  468    H    ASP  59           H        ASP  59  -7.761   1.205  -9.053
  469    HA   ASP  59           HA       ASP  59  -9.545   0.541  -7.005
  470    HB2  ASP  59           2HB      ASP  59  -7.217  -0.550  -8.078
  471    HB3  ASP  59           1HB      ASP  59  -6.806  -0.229  -6.397
  472    H    ALA  60           H        ALA  60  -6.534   2.428  -6.900
  473    HA   ALA  60           HA       ALA  60  -6.911   2.991  -4.090
  474    HB1  ALA  60           1HB      ALA  60  -4.726   3.336  -6.041
  475    HB2  ALA  60           2HB      ALA  60  -4.676   2.800  -4.362
  476    HB3  ALA  60           3HB      ALA  60  -4.807   4.518  -4.735
  477    H    GLU  61           H        GLU  61  -7.587   4.449  -7.123
  478    HA   GLU  61           HA       GLU  61  -7.745   7.142  -6.173
  479    HB2  GLU  61           2HB      GLU  61  -8.268   5.728  -8.719
  480    HB3  GLU  61           1HB      GLU  61  -9.178   7.209  -8.455
  481    HG2  GLU  61           2HG      GLU  61  -6.794   8.144  -7.821
  482    HG3  GLU  61           1HG      GLU  61  -6.265   6.811  -8.847
  483    H    LYS  62           H        LYS  62  -9.915   4.441  -6.395
  484    HA   LYS  62           HA       LYS  62 -12.328   5.926  -6.145
  485    HB2  LYS  62           2HB      LYS  62 -11.598   3.031  -5.884
  486    HB3  LYS  62           1HB      LYS  62 -13.194   3.585  -5.394
  487    HG2  LYS  62           2HG      LYS  62 -12.235   4.400  -8.076
  488    HG3  LYS  62           1HG      LYS  62 -12.677   2.707  -7.842
  489    HD2  LYS  62           2HD      LYS  62 -14.669   3.692  -8.541
  490    HD3  LYS  62           1HD      LYS  62 -14.833   3.644  -6.783
  491    HE2  LYS  62           2HE      LYS  62 -15.547   5.798  -7.516
  492    HE3  LYS  62           1HE      LYS  62 -13.985   5.995  -6.723
  493    HZ1  LYS  62           3HZ      LYS  62 -14.611   6.108  -9.607
  494    HZ2  LYS  62           1HZ      LYS  62 -13.034   5.818  -9.067
  495    HZ3  LYS  62           2HZ      LYS  62 -13.820   7.257  -8.651
  496    H    ILE  63           H        ILE  63  -9.867   5.478  -4.002
  497    HA   ILE  63           HA       ILE  63 -11.633   5.477  -1.672
  498    HB   ILE  63           HB       ILE  63  -9.493   3.905  -2.047
  499   HG12  ILE  63          2HG1      ILE  63  -9.488   4.514   0.727
  500   HG13  ILE  63          1HG1      ILE  63 -11.132   4.734   0.137
  501   HG21  ILE  63          1HG2      ILE  63  -7.677   4.853  -0.560
  502   HG22  ILE  63          2HG2      ILE  63  -8.462   6.419  -0.763
  503   HG23  ILE  63          3HG2      ILE  63  -7.822   5.565  -2.168
  504   HD11  ILE  63          3HD1      ILE  63 -11.371   2.523  -0.427
  505   HD12  ILE  63          1HD1      ILE  63 -10.362   2.421   1.015
  506   HD13  ILE  63          2HD1      ILE  63  -9.634   2.265  -0.584
  507    H    GLN  64           H        GLN  64 -11.939   7.313  -0.596
  508    HA   GLN  64           HA       GLN  64 -10.023   9.476  -0.967
  509    HB2  GLN  64           2HB      GLN  64 -12.931   9.880  -0.325
  510    HB3  GLN  64           1HB      GLN  64 -11.775  11.070  -0.906
  511    HG2  GLN  64           2HG      GLN  64 -12.597  10.701  -2.930
  512    HG3  GLN  64           1HG      GLN  64 -11.770   9.145  -2.881
  513   HE21  GLN  64          1HE2      GLN  64 -12.981   7.313  -2.064
  514   HE22  GLN  64          2HE2      GLN  64 -14.691   7.256  -2.301
  515    H    SER  65           H        SER  65 -11.288   7.331   1.229
  516    HA   SER  65           HA       SER  65 -10.772   9.129   3.502
  517    HB2  SER  65           2HB      SER  65 -12.046   6.519   4.036
  518    HB3  SER  65           1HB      SER  65 -12.438   8.118   4.668
  519    HG   SER  65           HG       SER  65 -13.295   6.869   2.309
  520    H    ILE  66           H        ILE  66  -9.442   8.453   5.194
  521    HA   ILE  66           HA       ILE  66  -7.214   6.890   4.462
  522    HB   ILE  66           HB       ILE  66  -7.926   7.511   7.314
  523   HG12  ILE  66          2HG1      ILE  66  -8.037   9.445   5.407
  524   HG13  ILE  66          1HG1      ILE  66  -7.565   9.737   7.078
  525   HG21  ILE  66          1HG2      ILE  66  -5.318   7.308   5.815
  526   HG22  ILE  66          2HG2      ILE  66  -5.962   6.152   6.981
  527   HG23  ILE  66          3HG2      ILE  66  -5.477   7.762   7.512
  528   HD11  ILE  66          3HD1      ILE  66  -6.041  10.782   5.478
  529   HD12  ILE  66          1HD1      ILE  66  -5.668   9.194   4.807
  530   HD13  ILE  66          2HD1      ILE  66  -5.229   9.573   6.473
  531    HA   PRO  67           HA       PRO  67  -9.167   3.655   7.592
  532    HB2  PRO  67           2HB      PRO  67 -11.921   3.729   7.569
  533    HB3  PRO  67           1HB      PRO  67 -10.912   4.482   8.808
  534    HG2  PRO  67           2HG      PRO  67 -12.222   5.715   6.422
  535    HG3  PRO  67           1HG      PRO  67 -12.062   6.353   8.069
  536    HD2  PRO  67           2HD      PRO  67 -10.488   7.204   6.067
  537    HD3  PRO  67           1HD      PRO  67  -9.877   7.039   7.726
  538    H    ASP  68           H        ASP  68 -11.889   4.211   5.379
  539    HA   ASP  68           HA       ASP  68 -12.246   1.705   4.439
  540    HB2  ASP  68           2HB      ASP  68 -12.761   4.386   3.378
  541    HB3  ASP  68           1HB      ASP  68 -12.593   3.163   2.122
  542    H    ALA  69           H        ALA  69  -9.562   3.751   3.794
  543    HA   ALA  69           HA       ALA  69  -8.618   2.541   1.430
  544    HB1  ALA  69           1HB      ALA  69  -7.924   4.777   2.376
  545    HB2  ALA  69           2HB      ALA  69  -6.624   3.760   1.753
  546    HB3  ALA  69           3HB      ALA  69  -6.896   3.878   3.492
  547    H    VAL  70           H        VAL  70  -7.070   2.361   4.595
  548    HA   VAL  70           HA       VAL  70  -5.634   0.009   3.996
  549    HB   VAL  70           HB       VAL  70  -5.473   1.864   5.982
  550   HG11  VAL  70          1HG1      VAL  70  -5.753   0.526   8.105
  551   HG12  VAL  70          2HG1      VAL  70  -6.689  -0.626   7.154
  552   HG13  VAL  70          3HG1      VAL  70  -7.245   1.040   7.318
  553   HG21  VAL  70          3HG2      VAL  70  -3.810   0.190   7.017
  554   HG22  VAL  70          1HG2      VAL  70  -3.546   0.715   5.354
  555   HG23  VAL  70          2HG2      VAL  70  -4.267  -0.863   5.677
  556    H    GLU  71           H        GLU  71  -8.864   0.524   4.890
  557    HA   GLU  71           HA       GLU  71  -9.357  -1.889   6.289
  558    HB2  GLU  71           2HB      GLU  71 -11.050   0.201   4.993
  559    HB3  GLU  71           1HB      GLU  71 -11.789  -1.334   5.426
  560    HG2  GLU  71           2HG      GLU  71 -10.776  -0.931   7.750
  561    HG3  GLU  71           1HG      GLU  71 -10.571   0.735   7.210
  562    H    TYR  72           H        TYR  72  -9.697  -0.911   2.900
  563    HA   TYR  72           HA       TYR  72 -10.788  -3.370   2.029
  564    HB2  TYR  72           2HB      TYR  72 -10.470  -2.556  -0.208
  565    HB3  TYR  72           1HB      TYR  72 -11.008  -1.213   0.793
  566    HD1  TYR  72           2HD      TYR  72  -7.888  -2.777  -0.525
  567    HD2  TYR  72           1HD      TYR  72  -9.840   0.789   0.726
  568    HE1  TYR  72           2HE      TYR  72  -5.948  -1.460  -1.261
  569    HE2  TYR  72           1HE      TYR  72  -7.903   2.113  -0.010
  570    HH   TYR  72           HH       TYR  72  -5.484   1.774  -0.406
  571    H    ILE  73           H        ILE  73  -7.527  -2.026   1.911
  572    HA   ILE  73           HA       ILE  73  -6.331  -4.251   0.668
  573    HB   ILE  73           HB       ILE  73  -4.225  -3.303   1.980
  574   HG12  ILE  73          2HG1      ILE  73  -6.348  -1.517   2.734
  575   HG13  ILE  73          1HG1      ILE  73  -4.668  -1.522   3.246
  576   HG21  ILE  73          1HG2      ILE  73  -3.701  -2.724  -0.087
  577   HG22  ILE  73          2HG2      ILE  73  -4.805  -1.352  -0.021
  578   HG23  ILE  73          3HG2      ILE  73  -5.390  -2.929  -0.550
  579   HD11  ILE  73          3HD1      ILE  73  -5.749   0.543   2.025
  580   HD12  ILE  73          1HD1      ILE  73  -5.286  -0.374   0.592
  581   HD13  ILE  73          2HD1      ILE  73  -4.063   0.089   1.774
  582    H    ALA  74           H        ALA  74  -6.667  -3.342   4.048
  583    HA   ALA  74           HA       ALA  74  -5.191  -5.368   5.229
  584    HB1  ALA  74           1HB      ALA  74  -7.717  -4.132   6.312
  585    HB2  ALA  74           2HB      ALA  74  -6.104  -3.430   6.442
  586    HB3  ALA  74           3HB      ALA  74  -6.469  -4.957   7.245
  587    H    GLN  75           H        GLN  75  -8.499  -5.389   4.082
  588    HA   GLN  75           HA       GLN  75  -9.039  -8.017   5.066
  589    HB2  GLN  75           2HB      GLN  75 -10.551  -6.220   3.173
  590    HB3  GLN  75           1HB      GLN  75 -11.133  -7.797   3.692
  591    HG2  GLN  75           2HG      GLN  75 -11.086  -5.237   5.115
  592    HG3  GLN  75           1HG      GLN  75 -12.188  -6.604   5.265
  593   HE21  GLN  75          1HE2      GLN  75 -10.281  -4.827   7.043
  594   HE22  GLN  75          2HE2      GLN  75  -9.636  -5.991   8.143
  595    H    ASN  76           H        ASN  76  -7.593  -6.673   2.277
  596    HA   ASN  76           HA       ASN  76  -8.160  -8.636   0.362
  597    HB2  ASN  76           2HB      ASN  76  -6.198  -6.486   0.693
  598    HB3  ASN  76           1HB      ASN  76  -5.580  -7.853  -0.228
  599   HD21  ASN  76          1HD2      ASN  76  -7.629  -5.133  -0.215
  600   HD22  ASN  76          2HD2      ASN  76  -8.236  -5.289  -1.825
  601    HA   PRO  77           HA       PRO  77  -4.173 -11.009   1.671
  602    HB2  PRO  77           2HB      PRO  77  -3.212  -9.623   4.079
  603    HB3  PRO  77           1HB      PRO  77  -2.319 -10.108   2.635
  604    HG2  PRO  77           2HG      PRO  77  -2.870  -7.529   3.172
  605    HG3  PRO  77           1HG      PRO  77  -2.811  -8.156   1.514
  606    HD2  PRO  77           2HD      PRO  77  -5.188  -7.557   3.230
  607    HD3  PRO  77           1HD      PRO  77  -4.940  -7.256   1.498
  608    H    MET  78           H        MET  78  -6.183  -9.560   4.152
  609    HA   MET  78           HA       MET  78  -5.979 -11.764   5.962
  610    HB2  MET  78           2HB      MET  78  -6.461  -9.730   7.025
  611    HB3  MET  78           1HB      MET  78  -7.670  -9.286   5.828
  612    HG2  MET  78           2HG      MET  78  -8.046 -11.614   7.677
  613    HG3  MET  78           1HG      MET  78  -8.487  -9.970   8.135
  614    HE1  MET  78           3HE      MET  78  -9.815 -12.728   7.889
  615    HE2  MET  78           1HE      MET  78 -10.831 -13.038   6.481
  616    HE3  MET  78           2HE      MET  78 -11.446 -12.062   7.816
  617    H    ALA  79           H        ALA  79  -7.466 -11.316   3.046
  618    HA   ALA  79           HA       ALA  79  -8.652 -13.053   1.974
  619    HB1  ALA  79           1HB      ALA  79  -8.570 -14.104   4.450
  620    HB2  ALA  79           2HB      ALA  79  -9.514 -14.783   3.120
  621    HB3  ALA  79           3HB      ALA  79 -10.292 -13.741   4.314
  622    H    LYS  80           H        LYS  80  -9.316 -10.811   1.270
  623    HA   LYS  80           HA       LYS  80 -11.082  -9.071   1.776
  624    HB2  LYS  80           2HB      LYS  80 -11.617 -10.931  -0.547
  625    HB3  LYS  80           1HB      LYS  80 -12.251  -9.299  -0.382
  626    HG2  LYS  80           2HG      LYS  80 -10.448  -9.036  -1.809
  627    HG3  LYS  80           1HG      LYS  80  -9.787  -8.580  -0.237
  628    HD2  LYS  80           2HD      LYS  80  -8.167 -10.067  -0.604
  629    HD3  LYS  80           1HD      LYS  80  -9.387 -11.327  -0.393
  630    HE2  LYS  80           2HE      LYS  80  -9.896 -11.021  -2.867
  631    HE3  LYS  80           1HE      LYS  80  -8.402 -10.087  -2.949
  632    HZ1  LYS  80           3HZ      LYS  80  -8.615 -12.788  -3.209
  633    HZ2  LYS  80           1HZ      LYS  80  -8.062 -12.601  -1.620
  634    HZ3  LYS  80           2HZ      LYS  80  -7.186 -11.934  -2.904
  635   H282  PNS 101          8H2       PNS 101  -2.681  11.093  -7.613
  636   H281  PNS 101          9H2       PNS 101  -1.372  12.024  -8.348
  637   H303  PNS 101          0H3       PNS 101  -2.459  12.347  -4.306
  638   H302  PNS 101          1H3       PNS 101  -0.955  11.476  -4.605
  639   H301  PNS 101          2H3       PNS 101  -2.484  10.825  -5.197
  640   H313  PNS 101          3H3       PNS 101  -0.025  13.186  -5.268
  641   H312  PNS 101          4H3       PNS 101  -0.659  14.304  -6.476
  642   H311  PNS 101          5H3       PNS 101   0.233  12.871  -6.984
  643    H32  PNS 101           6H3      PNS 101  -3.642  12.729  -6.864
  644    H33  PNS 101           7H3      PNS 101  -4.512  13.881  -5.447
  645    H36  PNS 101           8H3      PNS 101  -1.892  15.616  -6.508
  646   H372  PNS 101          9H3       PNS 101  -1.019  17.064  -8.027
  647   H371  PNS 101          0H4       PNS 101  -2.300  16.578  -9.136
  648   H382  PNS 101          1H4       PNS 101   0.364  16.073  -9.473
  649   H381  PNS 101          2H4       PNS 101  -0.215  14.562  -8.772
  650    H41  PNS 101           3H4      PNS 101  -2.915  15.741 -10.789
  651   H422  PNS 101          4H4       PNS 101  -0.801  16.919 -12.423
  652   H421  PNS 101          5H4       PNS 101  -2.528  17.262 -12.525
  653   H431  PNS 101          7H4       PNS 101  -1.625  19.208 -11.596
  654   H432  PNS 101          6H4       PNS 101  -2.238  18.323 -10.193
  655    H44  PNS 101           8H4      PNS 101   0.044  18.315  -9.297
  Start of MODEL    8
    1    H1   MET   1           1HT      MET   1  -6.698  -6.449   9.046
    2    H2   MET   1           2HT      MET   1  -7.147  -8.104   8.963
    3    H3   MET   1           3HT      MET   1  -6.544  -7.304   7.568
    4    HA   MET   1           HA       MET   1  -5.170  -8.497   9.769
    5    HB2  MET   1           2HB      MET   1  -5.201  -8.611   7.014
    6    HB3  MET   1           1HB      MET   1  -3.742  -7.684   7.342
    7    HG2  MET   1           2HG      MET   1  -2.692  -9.431   8.370
    8    HG3  MET   1           1HG      MET   1  -4.202 -10.185   8.876
    9    HE1  MET   1           2HE      MET   1  -1.551 -11.256   5.558
   10    HE2  MET   1           3HE      MET   1  -1.638 -12.026   7.141
   11    HE3  MET   1           1HE      MET   1  -1.316 -10.296   7.019
   12    H    ASN   2           H        ASN   2  -3.453  -7.674  10.883
   13    HA   ASN   2           HA       ASN   2  -3.300  -4.854  11.180
   14    HB2  ASN   2           2HB      ASN   2  -1.547  -7.044  12.299
   15    HB3  ASN   2           1HB      ASN   2  -1.472  -5.353  12.786
   16   HD21  ASN   2          1HD2      ASN   2  -2.541  -8.227  13.744
   17   HD22  ASN   2          2HD2      ASN   2  -3.923  -7.765  14.672
   18    H    ASP   3           H        ASP   3  -1.455  -7.236   9.463
   19    HA   ASP   3           HA       ASP   3   0.931  -5.944   9.024
   20    HB2  ASP   3           2HB      ASP   3  -0.535  -8.106   7.794
   21    HB3  ASP   3           1HB      ASP   3   0.331  -7.168   6.580
   22    H    VAL   4           H        VAL   4  -2.171  -5.262   7.595
   23    HA   VAL   4           HA       VAL   4  -1.197  -3.706   5.429
   24    HB   VAL   4           HB       VAL   4  -3.493  -2.899   5.180
   25   HG11  VAL   4          1HG1      VAL   4  -2.885  -5.052   4.232
   26   HG12  VAL   4          2HG1      VAL   4  -4.559  -5.071   4.788
   27   HG13  VAL   4          3HG1      VAL   4  -3.302  -5.856   5.745
   28   HG21  VAL   4          3HG2      VAL   4  -5.128  -4.154   6.850
   29   HG22  VAL   4          1HG2      VAL   4  -4.461  -2.562   7.212
   30   HG23  VAL   4          2HG2      VAL   4  -3.736  -4.004   7.923
   31    H    LEU   5           H        LEU   5  -2.777  -2.681   8.480
   32    HA   LEU   5           HA       LEU   5  -2.245   0.053   8.011
   33    HB2  LEU   5           2HB      LEU   5  -2.918   0.411  10.355
   34    HB3  LEU   5           1HB      LEU   5  -4.077  -0.511   9.429
   35    HG   LEU   5           HG       LEU   5  -3.754  -1.305  11.761
   36   HD11  LEU   5          1HD1      LEU   5  -4.239  -2.701   9.527
   37   HD12  LEU   5          2HD1      LEU   5  -4.253  -3.403  11.144
   38   HD13  LEU   5          3HD1      LEU   5  -2.823  -3.562  10.125
   39   HD21  LEU   5          3HD2      LEU   5  -1.253  -2.688  11.108
   40   HD22  LEU   5          1HD2      LEU   5  -1.778  -1.935  12.611
   41   HD23  LEU   5          2HD2      LEU   5  -1.099  -0.945  11.321
   42    H    THR   6           H        THR   6  -0.498  -2.451   9.677
   43    HA   THR   6           HA       THR   6   1.317  -0.838  11.075
   44    HB   THR   6           HB       THR   6   1.264  -3.058  11.767
   45    HG1  THR   6           1HG      THR   6   3.488  -2.118  11.121
   46   HG21  THR   6          3HG2      THR   6   2.162  -4.481   9.432
   47   HG22  THR   6          1HG2      THR   6   0.627  -3.660   9.143
   48   HG23  THR   6          2HG2      THR   6   0.783  -4.793  10.487
   49    H    ARG   7           H        ARG   7   1.794  -2.539   8.005
   50    HA   ARG   7           HA       ARG   7   4.266  -1.219   7.491
   51    HB2  ARG   7           2HB      ARG   7   3.408  -3.575   6.711
   52    HB3  ARG   7           1HB      ARG   7   2.742  -2.660   5.365
   53    HG2  ARG   7           2HG      ARG   7   5.600  -2.258   6.078
   54    HG3  ARG   7           1HG      ARG   7   5.130  -3.737   5.236
   55    HD2  ARG   7           2HD      ARG   7   4.227  -2.496   3.409
   56    HD3  ARG   7           1HD      ARG   7   4.394  -0.975   4.286
   57    HE   ARG   7           HE       ARG   7   6.573  -0.879   3.611
   58   HH11  ARG   7          1HH1      ARG   7   5.431  -4.149   3.254
   59   HH12  ARG   7          2HH1      ARG   7   6.865  -4.701   2.454
   60   HH21  ARG   7          1HH2      ARG   7   8.467  -1.595   2.560
   61   HH22  ARG   7          2HH2      ARG   7   8.592  -3.249   2.061
   62    H    VAL   8           H        VAL   8   0.994  -1.030   6.170
   63    HA   VAL   8           HA       VAL   8   1.551   0.891   4.205
   64    HB   VAL   8           HB       VAL   8  -0.600  -0.604   4.669
   65   HG11  VAL   8          1HG1      VAL   8  -1.234   0.576   6.709
   66   HG12  VAL   8          2HG1      VAL   8  -2.465   0.761   5.462
   67   HG13  VAL   8          3HG1      VAL   8  -1.355   2.087   5.806
   68   HG21  VAL   8          3HG2      VAL   8  -1.537   1.817   3.421
   69   HG22  VAL   8          1HG2      VAL   8  -1.186   0.246   2.700
   70   HG23  VAL   8          2HG2      VAL   8   0.102   1.435   2.892
   71    H    LEU   9           H        LEU   9   0.187   1.247   7.467
   72    HA   LEU   9           HA       LEU   9  -0.016   4.062   7.385
   73    HB2  LEU   9           2HB      LEU   9  -0.804   3.911   9.513
   74    HB3  LEU   9           1HB      LEU   9  -1.011   2.241   9.032
   75    HG   LEU   9           HG       LEU   9   1.334   1.876  10.064
   76   HD11  LEU   9          1HD1      LEU   9   1.425   4.523  10.298
   77   HD12  LEU   9          2HD1      LEU   9   2.239   3.444  11.432
   78   HD13  LEU   9          3HD1      LEU   9   0.675   4.145  11.850
   79   HD21  LEU   9          3HD2      LEU   9   0.277   1.744  12.368
   80   HD22  LEU   9          1HD2      LEU   9  -0.530   0.857  11.077
   81   HD23  LEU   9          2HD2      LEU   9  -1.181   2.402  11.624
   82    H    GLU  10           H        GLU  10   2.473   1.889   8.671
   83    HA   GLU  10           HA       GLU  10   4.126   3.892   9.751
   84    HB2  GLU  10           2HB      GLU  10   5.736   2.214  10.068
   85    HB3  GLU  10           1HB      GLU  10   4.197   1.371  10.178
   86    HG2  GLU  10           2HG      GLU  10   4.765   0.018   8.526
   87    HG3  GLU  10           1HG      GLU  10   5.088   1.385   7.459
   88    H    VAL  11           H        VAL  11   3.904   2.452   6.587
   89    HA   VAL  11           HA       VAL  11   6.286   3.406   5.507
   90    HB   VAL  11           HB       VAL  11   3.775   2.381   4.423
   91   HG11  VAL  11          1HG1      VAL  11   5.048   2.951   2.101
   92   HG12  VAL  11          2HG1      VAL  11   5.363   4.410   3.037
   93   HG13  VAL  11          3HG1      VAL  11   3.703   3.884   2.757
   94   HG21  VAL  11          3HG2      VAL  11   5.509   1.090   3.038
   95   HG22  VAL  11          1HG2      VAL  11   5.408   0.762   4.768
   96   HG23  VAL  11          2HG2      VAL  11   6.692   1.796   4.139
   97    H    VAL  12           H        VAL  12   3.031   4.737   5.196
   98    HA   VAL  12           HA       VAL  12   3.826   7.100   3.865
   99    HB   VAL  12           HB       VAL  12   1.543   7.952   4.780
  100   HG11  VAL  12          1HG1      VAL  12   0.366   6.369   3.122
  101   HG12  VAL  12          2HG1      VAL  12   1.978   5.713   2.835
  102   HG13  VAL  12          3HG1      VAL  12   1.649   7.417   2.516
  103   HG21  VAL  12          3HG2      VAL  12   0.422   6.652   6.188
  104   HG22  VAL  12          1HG2      VAL  12   1.789   5.540   6.221
  105   HG23  VAL  12          2HG2      VAL  12   0.494   5.308   5.047
  106    H    LYS  13           H        LYS  13   2.971   6.476   7.263
  107    HA   LYS  13           HA       LYS  13   3.319   9.038   8.260
  108    HB2  LYS  13           2HB      LYS  13   3.449   8.069  10.414
  109    HB3  LYS  13           1HB      LYS  13   2.418   6.999   9.475
  110    HG2  LYS  13           2HG      LYS  13   3.753   5.474  10.518
  111    HG3  LYS  13           1HG      LYS  13   4.677   5.736   9.030
  112    HD2  LYS  13           2HD      LYS  13   6.152   5.781  10.962
  113    HD3  LYS  13           1HD      LYS  13   6.076   7.377  10.213
  114    HE2  LYS  13           2HE      LYS  13   4.118   7.688  11.978
  115    HE3  LYS  13           1HE      LYS  13   5.033   6.448  12.834
  116    HZ1  LYS  13           3HZ      LYS  13   5.908   9.159  12.051
  117    HZ2  LYS  13           1HZ      LYS  13   7.028   7.950  12.433
  118    HZ3  LYS  13           2HZ      LYS  13   5.902   8.457  13.589
  119    H    ASN  14           H        ASN  14   5.721   6.469   7.809
  120    HA   ASN  14           HA       ASN  14   7.849   8.139   8.775
  121    HB2  ASN  14           2HB      ASN  14   7.927   5.405   7.490
  122    HB3  ASN  14           1HB      ASN  14   9.301   6.217   8.232
  123   HD21  ASN  14          1HD2      ASN  14   7.032   3.938   8.719
  124   HD22  ASN  14          2HD2      ASN  14   6.949   3.955  10.445
  125    H    PHE  15           H        PHE  15   6.167   8.009   5.959
  126    HA   PHE  15           HA       PHE  15   8.246   8.185   4.039
  127    HB2  PHE  15           2HB      PHE  15   5.574   7.811   3.860
  128    HB3  PHE  15           1HB      PHE  15   5.674   9.519   3.447
  129    HD1  PHE  15           2HD      PHE  15   7.582   6.410   2.647
  130    HD2  PHE  15           1HD      PHE  15   5.730   9.959   1.210
  131    HE1  PHE  15           2HE      PHE  15   8.228   5.812   0.348
  132    HE2  PHE  15           1HE      PHE  15   6.371   9.370  -1.091
  133    HZ   PHE  15           HZ       PHE  15   7.623   7.294  -1.524
  134    H    GLU  16           H        GLU  16   6.767  10.402   6.209
  135    HA   GLU  16           HA       GLU  16   7.935  12.403   6.820
  136    HB2  GLU  16           2HB      GLU  16   9.244  13.613   5.321
  137    HB3  GLU  16           1HB      GLU  16   9.506  11.951   4.814
  138    HG2  GLU  16           2HG      GLU  16   8.857  12.474   2.776
  139    HG3  GLU  16           1HG      GLU  16   7.273  12.931   3.397
  140    H    LYS  17           H        LYS  17   5.416  11.582   4.788
  141    HA   LYS  17           HA       LYS  17   4.355  14.082   4.074
  142    HB2  LYS  17           2HB      LYS  17   3.324  11.314   4.288
  143    HB3  LYS  17           1HB      LYS  17   2.123  12.593   4.288
  144    HG2  LYS  17           2HG      LYS  17   3.831  11.595   2.120
  145    HG3  LYS  17           1HG      LYS  17   2.220  12.313   2.064
  146    HD2  LYS  17           2HD      LYS  17   4.835  13.771   2.377
  147    HD3  LYS  17           1HD      LYS  17   3.795  13.767   0.949
  148    HE2  LYS  17           2HE      LYS  17   2.584  14.594   3.524
  149    HE3  LYS  17           1HE      LYS  17   3.730  15.710   2.779
  150    HZ1  LYS  17           3HZ      LYS  17   2.170  15.017   0.698
  151    HZ2  LYS  17           1HZ      LYS  17   1.952  16.406   1.641
  152    HZ3  LYS  17           2HZ      LYS  17   1.052  15.011   1.968
  153    H    VAL  18           H        VAL  18   3.681  11.994   6.871
  154    HA   VAL  18           HA       VAL  18   3.342  14.131   8.665
  155    HB   VAL  18           HB       VAL  18   0.867  13.768   9.104
  156   HG11  VAL  18          1HG1      VAL  18   0.325  15.591   7.833
  157   HG12  VAL  18          2HG1      VAL  18   1.186  14.997   6.413
  158   HG13  VAL  18          3HG1      VAL  18   2.084  15.681   7.768
  159   HG21  VAL  18          3HG2      VAL  18  -0.425  12.530   7.747
  160   HG22  VAL  18          1HG2      VAL  18   1.093  11.763   7.283
  161   HG23  VAL  18          2HG2      VAL  18   0.421  13.059   6.294
  162    H    ASP  19           H        ASP  19   2.707  13.420  10.809
  163    HA   ASP  19           HA       ASP  19   3.740  10.875  11.453
  164    HB2  ASP  19           2HB      ASP  19   2.004  12.091  13.482
  165    HB3  ASP  19           1HB      ASP  19   3.700  11.628  13.582
  166    H    ALA  20           H        ALA  20   2.783   8.943  11.755
  167    HA   ALA  20           HA       ALA  20   0.235   8.429  10.707
  168    HB1  ALA  20           1HB      ALA  20   1.148   6.436  12.626
  169    HB2  ALA  20           2HB      ALA  20   2.388   6.902  11.461
  170    HB3  ALA  20           3HB      ALA  20   0.835   6.286  10.896
  171    H    SER  21           H        SER  21   1.240   9.414  13.848
  172    HA   SER  21           HA       SER  21  -0.985   8.471  15.317
  173    HB2  SER  21           2HB      SER  21   1.374  10.059  15.827
  174    HB3  SER  21           1HB      SER  21  -0.035  10.782  16.602
  175    HG   SER  21           HG       SER  21   0.241   8.032  16.854
  176    H    LYS  22           H        LYS  22  -0.518  11.119  13.190
  177    HA   LYS  22           HA       LYS  22  -2.630  12.760  14.198
  178    HB2  LYS  22           2HB      LYS  22  -2.278  14.112  12.220
  179    HB3  LYS  22           1HB      LYS  22  -0.723  13.677  12.916
  180    HG2  LYS  22           2HG      LYS  22  -0.109  12.958  10.915
  181    HG3  LYS  22           1HG      LYS  22  -1.294  11.659  11.075
  182    HD2  LYS  22           2HD      LYS  22  -1.921  12.644   9.080
  183    HD3  LYS  22           1HD      LYS  22  -2.981  13.451  10.237
  184    HE2  LYS  22           2HE      LYS  22  -0.725  15.028  10.249
  185    HE3  LYS  22           1HE      LYS  22  -0.859  14.540   8.560
  186    HZ1  LYS  22           3HZ      LYS  22  -2.845  15.999  10.200
  187    HZ2  LYS  22           1HZ      LYS  22  -3.259  15.258   8.736
  188    HZ3  LYS  22           2HZ      LYS  22  -2.108  16.496   8.761
  189    H    VAL  23           H        VAL  23  -2.498   9.960  12.281
  190    HA   VAL  23           HA       VAL  23  -4.839  10.451  10.717
  191    HB   VAL  23           HB       VAL  23  -3.636   7.755  11.310
  192   HG11  VAL  23          1HG1      VAL  23  -4.670   7.029   9.335
  193   HG12  VAL  23          2HG1      VAL  23  -4.973   8.677   8.785
  194   HG13  VAL  23          3HG1      VAL  23  -5.889   8.019  10.139
  195   HG21  VAL  23          3HG2      VAL  23  -1.771   8.942  10.565
  196   HG22  VAL  23          1HG2      VAL  23  -2.718   9.903   9.429
  197   HG23  VAL  23          2HG2      VAL  23  -2.405   8.199   9.097
  198    H    THR  24           H        THR  24  -6.885  10.250  11.329
  199    HA   THR  24           HA       THR  24  -7.484   8.719  13.734
  200    HB   THR  24           HB       THR  24  -8.053  11.404  13.139
  201    HG1  THR  24           1HG      THR  24  -8.385   9.629  15.176
  202   HG21  THR  24          3HG2      THR  24 -10.356  11.663  13.077
  203   HG22  THR  24          1HG2      THR  24 -10.655   9.974  13.483
  204   HG23  THR  24          2HG2      THR  24 -10.044  10.401  11.886
  205    HA   PRO  25           HA       PRO  25 -10.310   6.052  11.687
  206    HB2  PRO  25           2HB      PRO  25 -12.727   6.492  12.951
  207    HB3  PRO  25           1HB      PRO  25 -11.437   5.461  13.576
  208    HG2  PRO  25           2HG      PRO  25 -12.115   8.286  14.278
  209    HG3  PRO  25           1HG      PRO  25 -11.602   6.959  15.336
  210    HD2  PRO  25           2HD      PRO  25  -9.899   8.891  14.584
  211    HD3  PRO  25           1HD      PRO  25  -9.366   7.206  14.769
  212    H    GLU  26           H        GLU  26 -11.570   9.323  12.154
  213    HA   GLU  26           HA       GLU  26 -13.094   9.074   9.675
  214    HB2  GLU  26           2HB      GLU  26 -13.360  10.799  12.095
  215    HB3  GLU  26           1HB      GLU  26 -13.965  11.404  10.559
  216    HG2  GLU  26           2HG      GLU  26 -15.098   9.444  12.356
  217    HG3  GLU  26           1HG      GLU  26 -15.852  10.341  11.038
  218    H    SER  27           H        SER  27 -10.104   9.775  10.336
  219    HA   SER  27           HA       SER  27  -9.761  12.386   9.262
  220    HB2  SER  27           2HB      SER  27  -8.065  11.662  10.744
  221    HB3  SER  27           1HB      SER  27  -7.853  10.139   9.879
  222    HG   SER  27           HG       SER  27  -7.439  12.148   8.180
  223    H    HIS  28           H        HIS  28  -9.360  13.028   7.216
  224    HA   HIS  28           HA       HIS  28  -9.854  11.161   5.102
  225    HB2  HIS  28           2HB      HIS  28  -9.564  14.110   5.329
  226    HB3  HIS  28           1HB      HIS  28  -9.241  13.386   3.757
  227    HD1  HIS  28           1HD      HIS  28 -11.683  11.226   4.918
  228    HD2  HIS  28           2HD      HIS  28 -11.802  15.199   3.706
  229    HE1  HIS  28           1HE      HIS  28 -14.081  11.670   4.305
  230    HE2  HIS  28           2HE      HIS  28 -14.112  14.056   3.493
  231    H    PHE  29           H        PHE  29  -8.432  10.645   3.392
  232    HA   PHE  29           HA       PHE  29  -5.745  10.246   4.170
  233    HB2  PHE  29           2HB      PHE  29  -7.287   8.976   2.432
  234    HB3  PHE  29           1HB      PHE  29  -6.525  10.087   1.299
  235    HD1  PHE  29           2HD      PHE  29  -3.972  10.148   1.243
  236    HD2  PHE  29           1HD      PHE  29  -6.205   7.032   3.091
  237    HE1  PHE  29           2HE      PHE  29  -2.008   8.670   1.116
  238    HE2  PHE  29           1HE      PHE  29  -4.246   5.548   2.969
  239    HZ   PHE  29           HZ       PHE  29  -2.144   6.367   1.980
  240    H    VAL  30           H        VAL  30  -6.639  11.760   1.131
  241    HA   VAL  30           HA       VAL  30  -4.307  13.336   1.019
  242    HB   VAL  30           HB       VAL  30  -5.284  14.401  -0.938
  243   HG11  VAL  30          1HG1      VAL  30  -4.509  12.525  -1.867
  244   HG12  VAL  30          2HG1      VAL  30  -6.190  11.995  -1.911
  245   HG13  VAL  30          3HG1      VAL  30  -5.150  11.516  -0.571
  246   HG21  VAL  30          3HG2      VAL  30  -7.748  13.680   0.357
  247   HG22  VAL  30          1HG2      VAL  30  -7.718  13.062  -1.295
  248   HG23  VAL  30          2HG2      VAL  30  -7.474  14.783  -0.991
  249    H    LYS  31           H        LYS  31  -7.506  13.920   2.206
  250    HA   LYS  31           HA       LYS  31  -7.223  16.749   2.414
  251    HB2  LYS  31           2HB      LYS  31  -9.231  15.283   4.049
  252    HB3  LYS  31           1HB      LYS  31  -9.399  16.782   3.146
  253    HG2  LYS  31           2HG      LYS  31  -9.340  13.992   2.023
  254    HG3  LYS  31           1HG      LYS  31 -10.726  15.082   2.104
  255    HD2  LYS  31           2HD      LYS  31  -9.476  16.666   0.637
  256    HD3  LYS  31           1HD      LYS  31  -8.220  15.438   0.463
  257    HE2  LYS  31           2HE      LYS  31 -11.004  15.478  -0.602
  258    HE3  LYS  31           1HE      LYS  31  -9.498  15.043  -1.409
  259    HZ1  LYS  31           3HZ      LYS  31  -9.566  12.931  -0.603
  260    HZ2  LYS  31           1HZ      LYS  31 -11.229  13.233  -0.678
  261    HZ3  LYS  31           2HZ      LYS  31 -10.412  13.354   0.799
  262    H    ASP  32           H        ASP  32  -6.558  14.033   4.494
  263    HA   ASP  32           HA       ASP  32  -5.941  15.867   6.670
  264    HB2  ASP  32           2HB      ASP  32  -7.543  13.672   6.762
  265    HB3  ASP  32           1HB      ASP  32  -6.006  12.998   7.298
  266    H    LEU  33           H        LEU  33  -4.312  14.671   4.242
  267    HA   LEU  33           HA       LEU  33  -1.822  14.721   5.614
  268    HB2  LEU  33           2HB      LEU  33  -1.441  12.570   5.992
  269    HB3  LEU  33           1HB      LEU  33  -3.077  12.218   5.469
  270    HG   LEU  33           HG       LEU  33  -1.854  12.353   3.068
  271   HD11  LEU  33          1HD1      LEU  33   0.216  10.862   4.568
  272   HD12  LEU  33          2HD1      LEU  33   0.311  12.624   4.597
  273   HD13  LEU  33          3HD1      LEU  33   0.334  11.764   3.057
  274   HD21  LEU  33          3HD2      LEU  33  -3.174  10.503   3.498
  275   HD22  LEU  33          1HD2      LEU  33  -2.301  10.093   4.974
  276   HD23  LEU  33          2HD2      LEU  33  -1.562   9.797   3.400
  277    H    GLY  34           H        GLY  34  -3.622  14.034   2.708
  278    HA2  GLY  34           2HA      GLY  34  -3.190  14.485   0.499
  279    HA3  GLY  34           1HA      GLY  34  -2.078  15.709   1.084
  280    H    LEU  35           H        LEU  35  -2.415  12.456  -0.056
  281    HA   LEU  35           HA       LEU  35   0.427  11.937   0.137
  282    HB2  LEU  35           2HB      LEU  35  -0.054   9.715  -0.519
  283    HB3  LEU  35           1HB      LEU  35  -1.305  10.185   0.615
  284    HG   LEU  35           HG       LEU  35  -2.317   8.940  -1.167
  285   HD11  LEU  35          1HD1      LEU  35  -3.987  10.486  -1.917
  286   HD12  LEU  35          2HD1      LEU  35  -2.916  11.856  -1.621
  287   HD13  LEU  35          3HD1      LEU  35  -3.530  10.909  -0.267
  288   HD21  LEU  35          3HD2      LEU  35  -1.620   9.007  -3.276
  289   HD22  LEU  35          1HD2      LEU  35  -0.352  10.116  -2.756
  290   HD23  LEU  35          2HD2      LEU  35  -1.880  10.749  -3.367
  291    H    ASN  36           H        ASN  36   1.846  12.089  -1.513
  292    HA   ASN  36           HA       ASN  36   0.948  13.295  -3.947
  293    HB2  ASN  36           2HB      ASN  36   3.073  13.911  -2.687
  294    HB3  ASN  36           1HB      ASN  36   3.756  12.412  -3.296
  295   HD21  ASN  36          1HD2      ASN  36   1.564  14.040  -5.381
  296   HD22  ASN  36          2HD2      ASN  36   2.739  14.710  -6.447
  297    H    SER  37           H        SER  37   1.996  12.443  -6.068
  298    HA   SER  37           HA       SER  37   0.953   9.883  -6.582
  299    HB2  SER  37           2HB      SER  37   1.443  11.883  -8.201
  300    HB3  SER  37           1HB      SER  37   3.024  11.117  -8.360
  301    H    LEU  38           H        LEU  38   4.314  10.965  -6.715
  302    HA   LEU  38           HA       LEU  38   5.502   8.469  -6.952
  303    HB2  LEU  38           2HB      LEU  38   7.545   9.508  -6.433
  304    HB3  LEU  38           1HB      LEU  38   6.577  10.748  -7.207
  305    HG   LEU  38           HG       LEU  38   7.807  11.653  -5.307
  306   HD11  LEU  38          1HD1      LEU  38   5.795  12.784  -5.761
  307   HD12  LEU  38          2HD1      LEU  38   5.817  12.535  -4.016
  308   HD13  LEU  38          3HD1      LEU  38   4.820  11.504  -5.041
  309   HD21  LEU  38          3HD2      LEU  38   7.289   9.240  -4.094
  310   HD22  LEU  38          1HD2      LEU  38   6.234  10.360  -3.229
  311   HD23  LEU  38          2HD2      LEU  38   7.969  10.667  -3.314
  312    H    ASP  39           H        ASP  39   4.268  10.119  -4.165
  313    HA   ASP  39           HA       ASP  39   5.516   8.403  -2.247
  314    HB2  ASP  39           2HB      ASP  39   5.031  10.470  -1.319
  315    HB3  ASP  39           1HB      ASP  39   3.474  10.582  -2.135
  316    H    VAL  40           H        VAL  40   2.275   8.714  -3.588
  317    HA   VAL  40           HA       VAL  40   1.158   6.576  -2.111
  318    HB   VAL  40           HB       VAL  40   0.027   8.511  -3.557
  319   HG11  VAL  40          1HG1      VAL  40  -0.811   6.401  -5.355
  320   HG12  VAL  40          2HG1      VAL  40   0.883   6.841  -5.562
  321   HG13  VAL  40          3HG1      VAL  40  -0.373   8.071  -5.701
  322   HG21  VAL  40          3HG2      VAL  40  -0.852   5.993  -2.397
  323   HG22  VAL  40          1HG2      VAL  40  -1.926   6.575  -3.670
  324   HG23  VAL  40          2HG2      VAL  40  -1.568   7.602  -2.283
  325    H    VAL  41           H        VAL  41   2.846   6.765  -5.172
  326    HA   VAL  41           HA       VAL  41   2.120   4.224  -6.161
  327    HB   VAL  41           HB       VAL  41   3.044   5.494  -7.832
  328   HG11  VAL  41          1HG1      VAL  41   4.078   7.373  -7.249
  329   HG12  VAL  41          2HG1      VAL  41   5.554   6.432  -7.039
  330   HG13  VAL  41          3HG1      VAL  41   4.487   6.719  -5.664
  331   HG21  VAL  41          3HG2      VAL  41   4.550   4.067  -8.642
  332   HG22  VAL  41          1HG2      VAL  41   4.498   3.260  -7.074
  333   HG23  VAL  41          2HG2      VAL  41   5.724   4.487  -7.395
  334    H    GLU  42           H        GLU  42   5.025   5.327  -4.425
  335    HA   GLU  42           HA       GLU  42   6.277   2.828  -4.258
  336    HB2  GLU  42           2HB      GLU  42   7.876   3.920  -3.093
  337    HB3  GLU  42           1HB      GLU  42   6.981   5.355  -3.578
  338    HG2  GLU  42           2HG      GLU  42   7.462   5.503  -1.247
  339    HG3  GLU  42           1HG      GLU  42   5.730   5.241  -1.447
  340    H    VAL  43           H        VAL  43   4.014   4.437  -2.114
  341    HA   VAL  43           HA       VAL  43   4.074   2.541  -0.033
  342    HB   VAL  43           HB       VAL  43   3.096   4.505   0.663
  343   HG11  VAL  43          1HG1      VAL  43   2.296   6.004  -0.758
  344   HG12  VAL  43          2HG1      VAL  43   0.935   4.956  -1.150
  345   HG13  VAL  43          3HG1      VAL  43   2.445   4.813  -2.048
  346   HG21  VAL  43          3HG2      VAL  43   1.674   2.406   1.080
  347   HG22  VAL  43          1HG2      VAL  43   0.581   3.125  -0.096
  348   HG23  VAL  43          2HG2      VAL  43   0.959   3.990   1.388
  349    H    VAL  44           H        VAL  44   1.716   3.038  -2.615
  350    HA   VAL  44           HA       VAL  44   0.093   0.829  -2.090
  351    HB   VAL  44           HB       VAL  44  -0.796   1.066  -4.292
  352   HG11  VAL  44          1HG1      VAL  44  -0.379   3.306  -2.593
  353   HG12  VAL  44          2HG1      VAL  44  -1.747   2.960  -3.649
  354   HG13  VAL  44          3HG1      VAL  44  -0.360   3.856  -4.267
  355   HG21  VAL  44          3HG2      VAL  44   1.903   1.760  -4.963
  356   HG22  VAL  44          1HG2      VAL  44   0.794   2.989  -5.572
  357   HG23  VAL  44          2HG2      VAL  44   0.572   1.299  -6.024
  358    H    PHE  45           H        PHE  45   3.108   1.153  -3.781
  359    HA   PHE  45           HA       PHE  45   3.085  -1.460  -4.936
  360    HB2  PHE  45           2HB      PHE  45   4.659   0.899  -5.142
  361    HB3  PHE  45           1HB      PHE  45   5.734  -0.427  -4.712
  362    HD1  PHE  45           1HD      PHE  45   5.775  -2.458  -6.126
  363    HD2  PHE  45           2HD      PHE  45   3.778   1.102  -7.310
  364    HE1  PHE  45           1HE      PHE  45   5.793  -3.236  -8.467
  365    HE2  PHE  45           2HE      PHE  45   3.788   0.338  -9.652
  366    HZ   PHE  45           HZ       PHE  45   4.796  -1.835 -10.233
  367    H    ALA  46           H        ALA  46   4.074  -0.030  -1.968
  368    HA   ALA  46           HA       ALA  46   5.874  -2.014  -1.083
  369    HB1  ALA  46           1HB      ALA  46   4.850  -0.964   1.219
  370    HB2  ALA  46           2HB      ALA  46   4.556   0.327   0.053
  371    HB3  ALA  46           3HB      ALA  46   6.192  -0.285   0.298
  372    H    ILE  47           H        ILE  47   2.818  -1.344   0.519
  373    HA   ILE  47           HA       ILE  47   2.469  -3.766   1.741
  374    HB   ILE  47           HB       ILE  47   0.094  -3.290   1.900
  375   HG12  ILE  47          2HG1      ILE  47  -0.100  -2.547  -0.528
  376   HG13  ILE  47          1HG1      ILE  47  -1.023  -1.616   0.645
  377   HG21  ILE  47          1HG2      ILE  47   2.084  -1.129   2.305
  378   HG22  ILE  47          2HG2      ILE  47   1.115  -2.016   3.482
  379   HG23  ILE  47          3HG2      ILE  47   0.380  -0.732   2.523
  380   HD11  ILE  47          3HD1      ILE  47   1.319  -0.832  -0.982
  381   HD12  ILE  47          1HD1      ILE  47   1.161  -0.125   0.627
  382   HD13  ILE  47          2HD1      ILE  47  -0.130   0.079  -0.558
  383    H    GLU  48           H        GLU  48   1.274  -2.841  -1.486
  384    HA   GLU  48           HA       GLU  48  -0.031  -5.214  -2.116
  385    HB2  GLU  48           2HB      GLU  48  -0.429  -3.519  -3.645
  386    HB3  GLU  48           1HB      GLU  48   1.265  -3.059  -3.729
  387    HG2  GLU  48           2HG      GLU  48   0.113  -5.579  -4.902
  388    HG3  GLU  48           1HG      GLU  48   0.417  -4.093  -5.801
  389    H    GLN  49           H        GLN  49   3.342  -4.351  -2.268
  390    HA   GLN  49           HA       GLN  49   4.351  -6.461  -3.769
  391    HB2  GLN  49           2HB      GLN  49   5.605  -4.429  -2.919
  392    HB3  GLN  49           1HB      GLN  49   5.728  -5.251  -1.369
  393    HG2  GLN  49           2HG      GLN  49   7.316  -6.670  -2.091
  394    HG3  GLN  49           1HG      GLN  49   6.618  -6.801  -3.705
  395   HE21  GLN  49          1HE2      GLN  49   6.548  -4.079  -4.351
  396   HE22  GLN  49          2HE2      GLN  49   8.172  -3.523  -4.548
  397    H    GLU  50           H        GLU  50   3.999  -6.259  -0.222
  398    HA   GLU  50           HA       GLU  50   4.292  -9.151  -0.113
  399    HB2  GLU  50           2HB      GLU  50   5.222  -8.963   1.965
  400    HB3  GLU  50           1HB      GLU  50   5.677  -7.396   1.308
  401    HG2  GLU  50           2HG      GLU  50   4.621  -6.390   2.963
  402    HG3  GLU  50           1HG      GLU  50   3.104  -7.133   2.458
  403    H    PHE  51           H        PHE  51   1.842  -7.944  -0.967
  404    HA   PHE  51           HA       PHE  51   0.089  -8.937   1.128
  405    HB2  PHE  51           2HB      PHE  51  -0.065  -6.333  -0.311
  406    HB3  PHE  51           1HB      PHE  51  -1.567  -7.137   0.127
  407    HD1  PHE  51           1HD      PHE  51   0.529  -8.212   2.569
  408    HD2  PHE  51           2HD      PHE  51  -1.333  -4.618   1.254
  409    HE1  PHE  51           1HE      PHE  51   0.701  -7.296   4.844
  410    HE2  PHE  51           2HE      PHE  51  -1.161  -3.694   3.529
  411    HZ   PHE  51           HZ       PHE  51  -0.143  -5.035   5.327
  412    H    ILE  52           H        ILE  52   1.058  -9.060  -2.087
  413    HA   ILE  52           HA       ILE  52   0.360 -10.291  -3.867
  414    HB   ILE  52           HB       ILE  52  -1.904 -11.588  -2.511
  415   HG12  ILE  52          2HG1      ILE  52   0.418 -12.879  -1.498
  416   HG13  ILE  52          1HG1      ILE  52   0.519 -11.176  -1.068
  417   HG21  ILE  52          1HG2      ILE  52  -1.268 -13.400  -3.731
  418   HG22  ILE  52          2HG2      ILE  52   0.452 -13.046  -3.566
  419   HG23  ILE  52          3HG2      ILE  52  -0.531 -12.133  -4.712
  420   HD11  ILE  52          3HD1      ILE  52  -1.486 -13.216  -0.253
  421   HD12  ILE  52          1HD1      ILE  52  -1.941 -11.512  -0.296
  422   HD13  ILE  52          2HD1      ILE  52  -0.605 -12.043   0.728
  423    H    LEU  53           H        LEU  53  -0.791  -7.696  -3.347
  424    HA   LEU  53           HA       LEU  53  -2.894  -7.771  -5.253
  425    HB2  LEU  53           2HB      LEU  53  -4.758  -7.274  -4.004
  426    HB3  LEU  53           1HB      LEU  53  -3.928  -8.401  -2.948
  427    HG   LEU  53           HG       LEU  53  -2.906  -6.232  -1.895
  428   HD11  LEU  53          1HD1      LEU  53  -5.488  -5.138  -2.990
  429   HD12  LEU  53          2HD1      LEU  53  -3.900  -4.775  -3.667
  430   HD13  LEU  53          3HD1      LEU  53  -4.286  -4.294  -2.014
  431   HD21  LEU  53          3HD2      LEU  53  -4.164  -7.517  -0.462
  432   HD22  LEU  53          1HD2      LEU  53  -5.595  -7.457  -1.491
  433   HD23  LEU  53          2HD2      LEU  53  -5.134  -6.046  -0.538
  434    H    ASP  54           H        ASP  54  -3.019  -5.868  -6.307
  435    HA   ASP  54           HA       ASP  54  -1.251  -3.760  -5.459
  436    HB2  ASP  54           2HB      ASP  54  -2.910  -3.449  -7.899
  437    HB3  ASP  54           1HB      ASP  54  -1.209  -3.073  -7.640
  438    H    ILE  55           H        ILE  55  -1.841  -1.672  -4.955
  439    HA   ILE  55           HA       ILE  55  -4.669  -1.298  -4.331
  440    HB   ILE  55           HB       ILE  55  -2.288  -0.754  -2.859
  441   HG12  ILE  55          2HG1      ILE  55  -4.658  -1.664  -2.227
  442   HG13  ILE  55          1HG1      ILE  55  -3.741  -0.732  -1.048
  443   HG21  ILE  55          1HG2      ILE  55  -4.024   1.683  -3.198
  444   HG22  ILE  55          2HG2      ILE  55  -2.469   1.466  -4.001
  445   HG23  ILE  55          3HG2      ILE  55  -2.550   1.532  -2.240
  446   HD11  ILE  55          3HD1      ILE  55  -6.329  -0.234  -2.079
  447   HD12  ILE  55          1HD1      ILE  55  -5.273   1.086  -2.580
  448   HD13  ILE  55          2HD1      ILE  55  -5.426   0.681  -0.871
  449    HA   PRO  56           HA       PRO  56  -3.072   2.446  -6.990
  450    HB2  PRO  56           2HB      PRO  56  -1.945   1.597  -9.292
  451    HB3  PRO  56           1HB      PRO  56  -0.999   1.891  -7.828
  452    HG2  PRO  56           2HG      PRO  56  -2.001  -0.696  -8.947
  453    HG3  PRO  56           1HG      PRO  56  -0.418  -0.319  -8.241
  454    HD2  PRO  56           2HD      PRO  56  -2.401  -1.592  -6.875
  455    HD3  PRO  56           1HD      PRO  56  -1.183  -0.569  -6.090
  456    H    ASP  57           H        ASP  57  -3.476   2.685  -9.660
  457    HA   ASP  57           HA       ASP  57  -5.132   2.839 -11.213
  458    HB2  ASP  57           2HB      ASP  57  -6.531   0.479 -11.187
  459    HB3  ASP  57           1HB      ASP  57  -5.040   0.760 -12.081
  460    H    HIS  58           H        HIS  58  -7.701   1.924 -11.385
  461    HA   HIS  58           HA       HIS  58  -9.226   3.688 -10.027
  462    HB2  HIS  58           2HB      HIS  58 -10.748   1.273 -10.113
  463    HB3  HIS  58           1HB      HIS  58 -10.839   2.665 -11.186
  464    HD1  HIS  58           1HD      HIS  58 -10.673   1.921 -13.527
  465    HD2  HIS  58           2HD      HIS  58  -8.239  -0.335 -11.026
  466    HE1  HIS  58           1HE      HIS  58  -9.497   0.284 -15.031
  467    HE2  HIS  58           2HE      HIS  58  -8.091  -1.124 -13.485
  468    H    ASP  59           H        ASP  59  -7.860   0.758  -8.750
  469    HA   ASP  59           HA       ASP  59  -9.473   0.465  -6.468
  470    HB2  ASP  59           2HB      ASP  59  -6.552  -0.275  -6.726
  471    HB3  ASP  59           1HB      ASP  59  -7.724  -0.965  -5.607
  472    H    ALA  60           H        ALA  60  -6.428   2.216  -6.973
  473    HA   ALA  60           HA       ALA  60  -6.407   3.199  -4.269
  474    HB1  ALA  60           1HB      ALA  60  -4.570   3.215  -6.551
  475    HB2  ALA  60           2HB      ALA  60  -4.235   3.081  -4.823
  476    HB3  ALA  60           3HB      ALA  60  -4.512   4.665  -5.547
  477    H    GLU  61           H        GLU  61  -7.531   4.245  -7.352
  478    HA   GLU  61           HA       GLU  61  -7.665   7.029  -6.758
  479    HB2  GLU  61           2HB      GLU  61  -8.665   5.257  -8.934
  480    HB3  GLU  61           1HB      GLU  61  -9.409   6.840  -8.752
  481    HG2  GLU  61           2HG      GLU  61  -7.444   6.601 -10.368
  482    HG3  GLU  61           1HG      GLU  61  -7.444   7.964  -9.252
  483    H    LYS  62           H        LYS  62  -9.870   4.310  -6.472
  484    HA   LYS  62           HA       LYS  62 -12.157   5.887  -5.829
  485    HB2  LYS  62           2HB      LYS  62 -11.492   2.983  -5.831
  486    HB3  LYS  62           1HB      LYS  62 -12.880   3.510  -4.888
  487    HG2  LYS  62           2HG      LYS  62 -14.127   3.895  -6.708
  488    HG3  LYS  62           1HG      LYS  62 -12.779   4.585  -7.613
  489    HD2  LYS  62           2HD      LYS  62 -11.925   2.352  -8.075
  490    HD3  LYS  62           1HD      LYS  62 -13.229   1.641  -7.122
  491    HE2  LYS  62           2HE      LYS  62 -13.327   1.945  -9.793
  492    HE3  LYS  62           1HE      LYS  62 -14.754   1.924  -8.759
  493    HZ1  LYS  62           3HZ      LYS  62 -14.468   3.823 -10.444
  494    HZ2  LYS  62           1HZ      LYS  62 -13.368   4.461  -9.329
  495    HZ3  LYS  62           2HZ      LYS  62 -14.978   4.206  -8.878
  496    H    ILE  63           H        ILE  63  -9.481   5.865  -4.199
  497    HA   ILE  63           HA       ILE  63 -10.677   5.473  -1.559
  498    HB   ILE  63           HB       ILE  63  -8.246   4.592  -2.530
  499   HG12  ILE  63          2HG1      ILE  63  -8.204   4.852   0.353
  500   HG13  ILE  63          1HG1      ILE  63  -9.806   4.383  -0.209
  501   HG21  ILE  63          1HG2      ILE  63  -7.389   6.902  -2.391
  502   HG22  ILE  63          2HG2      ILE  63  -6.528   5.789  -1.328
  503   HG23  ILE  63          3HG2      ILE  63  -7.725   6.899  -0.661
  504   HD11  ILE  63          3HD1      ILE  63  -8.942   2.319  -0.046
  505   HD12  ILE  63          1HD1      ILE  63  -7.280   2.883  -0.219
  506   HD13  ILE  63          2HD1      ILE  63  -8.298   2.690  -1.645
  507    H    GLN  64           H        GLN  64 -11.246   7.221  -0.445
  508    HA   GLN  64           HA       GLN  64  -9.941   9.753  -1.060
  509    HB2  GLN  64           2HB      GLN  64 -12.591   9.885   0.202
  510    HB3  GLN  64           1HB      GLN  64 -11.922  10.843  -1.112
  511    HG2  GLN  64           2HG      GLN  64 -13.791   9.592  -1.925
  512    HG3  GLN  64           1HG      GLN  64 -12.315   8.950  -2.645
  513   HE21  GLN  64          1HE2      GLN  64 -14.209   8.455   0.320
  514   HE22  GLN  64          2HE2      GLN  64 -14.200   6.730   0.240
  515    H    SER  65           H        SER  65 -11.264   7.691   1.448
  516    HA   SER  65           HA       SER  65  -9.934   9.374   3.468
  517    HB2  SER  65           2HB      SER  65 -12.512   9.010   3.531
  518    HB3  SER  65           1HB      SER  65 -12.104   7.405   4.138
  519    HG   SER  65           HG       SER  65 -11.930   8.352   5.997
  520    H    ILE  66           H        ILE  66  -8.830   8.317   5.187
  521    HA   ILE  66           HA       ILE  66  -7.177   6.220   4.424
  522    HB   ILE  66           HB       ILE  66  -7.271   6.052   7.208
  523   HG12  ILE  66          2HG1      ILE  66  -7.369   8.970   6.462
  524   HG13  ILE  66          1HG1      ILE  66  -8.816   8.102   6.958
  525   HG21  ILE  66          1HG2      ILE  66  -5.276   6.069   5.808
  526   HG22  ILE  66          2HG2      ILE  66  -5.158   7.271   7.094
  527   HG23  ILE  66          3HG2      ILE  66  -5.534   7.776   5.446
  528   HD11  ILE  66          3HD1      ILE  66  -7.000   7.465   8.920
  529   HD12  ILE  66          1HD1      ILE  66  -8.270   8.684   9.027
  530   HD13  ILE  66          2HD1      ILE  66  -6.638   9.151   8.551
  531    HA   PRO  67           HA       PRO  67 -10.399   3.566   7.203
  532    HB2  PRO  67           2HB      PRO  67 -12.681   4.656   5.614
  533    HB3  PRO  67           1HB      PRO  67 -12.643   4.092   7.288
  534    HG2  PRO  67           2HG      PRO  67 -12.672   6.697   6.721
  535    HG3  PRO  67           1HG      PRO  67 -11.716   6.061   8.072
  536    HD2  PRO  67           2HD      PRO  67 -10.818   7.042   5.413
  537    HD3  PRO  67           1HD      PRO  67  -9.987   7.091   6.978
  538    H    ASP  68           H        ASP  68 -11.908   4.278   4.061
  539    HA   ASP  68           HA       ASP  68 -12.147   1.656   3.222
  540    HB2  ASP  68           2HB      ASP  68 -12.385   2.571   0.938
  541    HB3  ASP  68           1HB      ASP  68 -13.319   3.485   2.119
  542    H    ALA  69           H        ALA  69  -9.326   3.541   3.466
  543    HA   ALA  69           HA       ALA  69  -7.794   2.314   1.420
  544    HB1  ALA  69           1HB      ALA  69  -5.899   3.423   2.391
  545    HB2  ALA  69           2HB      ALA  69  -6.791   3.715   3.884
  546    HB3  ALA  69           3HB      ALA  69  -7.276   4.526   2.395
  547    H    VAL  70           H        VAL  70  -6.729   2.223   4.743
  548    HA   VAL  70           HA       VAL  70  -5.544  -0.316   4.488
  549    HB   VAL  70           HB       VAL  70  -4.627   1.171   6.098
  550   HG11  VAL  70          1HG1      VAL  70  -6.090   1.669   8.194
  551   HG12  VAL  70          2HG1      VAL  70  -7.435   1.346   7.099
  552   HG13  VAL  70          3HG1      VAL  70  -6.290   2.637   6.734
  553   HG21  VAL  70          3HG2      VAL  70  -5.724  -1.390   6.951
  554   HG22  VAL  70          1HG2      VAL  70  -5.389  -0.297   8.294
  555   HG23  VAL  70          2HG2      VAL  70  -4.105  -0.724   7.162
  556    H    GLU  71           H        GLU  71  -8.735   0.659   5.334
  557    HA   GLU  71           HA       GLU  71  -9.496  -1.631   6.809
  558    HB2  GLU  71           2HB      GLU  71 -11.642  -0.770   6.795
  559    HB3  GLU  71           1HB      GLU  71 -10.678   0.682   6.566
  560    HG2  GLU  71           2HG      GLU  71 -11.117   0.635   4.188
  561    HG3  GLU  71           1HG      GLU  71 -11.998  -0.881   4.357
  562    H    TYR  72           H        TYR  72  -9.583  -0.810   3.378
  563    HA   TYR  72           HA       TYR  72 -11.040  -3.094   2.571
  564    HB2  TYR  72           2HB      TYR  72 -11.078  -1.989   0.632
  565    HB3  TYR  72           1HB      TYR  72 -10.004  -0.784   1.333
  566    HD1  TYR  72           1HD      TYR  72  -7.603  -0.860   0.905
  567    HD2  TYR  72           2HD      TYR  72 -10.238  -3.690  -0.866
  568    HE1  TYR  72           1HE      TYR  72  -5.839  -1.496  -0.683
  569    HE2  TYR  72           2HE      TYR  72  -8.481  -4.336  -2.462
  570    HH   TYR  72           HH       TYR  72  -6.032  -2.670  -3.274
  571    H    ILE  73           H        ILE  73  -7.586  -2.340   2.529
  572    HA   ILE  73           HA       ILE  73  -6.798  -4.862   1.522
  573    HB   ILE  73           HB       ILE  73  -4.545  -4.130   2.733
  574   HG12  ILE  73          2HG1      ILE  73  -6.246  -2.037   3.450
  575   HG13  ILE  73          1HG1      ILE  73  -4.491  -2.059   3.576
  576   HG21  ILE  73          1HG2      ILE  73  -4.555  -2.419   0.557
  577   HG22  ILE  73          2HG2      ILE  73  -5.764  -3.638   0.155
  578   HG23  ILE  73          3HG2      ILE  73  -4.117  -4.127   0.553
  579   HD11  ILE  73          3HD1      ILE  73  -4.227  -0.911   1.549
  580   HD12  ILE  73          1HD1      ILE  73  -5.526  -0.081   2.403
  581   HD13  ILE  73          2HD1      ILE  73  -5.904  -1.185   1.083
  582    H    ALA  74           H        ALA  74  -7.469  -3.658   4.695
  583    HA   ALA  74           HA       ALA  74  -6.152  -5.638   6.198
  584    HB1  ALA  74           1HB      ALA  74  -7.048  -3.442   7.050
  585    HB2  ALA  74           2HB      ALA  74  -7.365  -4.845   8.070
  586    HB3  ALA  74           3HB      ALA  74  -8.645  -4.192   7.049
  587    H    GLN  75           H        GLN  75  -9.378  -5.449   4.839
  588    HA   GLN  75           HA       GLN  75 -10.232  -7.913   6.003
  589    HB2  GLN  75           2HB      GLN  75 -11.606  -6.610   3.687
  590    HB3  GLN  75           1HB      GLN  75 -12.309  -7.527   5.012
  591    HG2  GLN  75           2HG      GLN  75 -11.714  -4.681   4.805
  592    HG3  GLN  75           1HG      GLN  75 -12.882  -5.529   5.817
  593   HE21  GLN  75          1HE2      GLN  75 -11.400  -3.362   6.715
  594   HE22  GLN  75          2HE2      GLN  75 -10.311  -3.900   7.944
  595    H    ASN  76           H        ASN  76  -9.521  -6.848   2.707
  596    HA   ASN  76           HA       ASN  76  -9.900  -9.064   1.232
  597    HB2  ASN  76           2HB      ASN  76  -7.866  -6.920   1.155
  598    HB3  ASN  76           1HB      ASN  76  -7.457  -8.376   0.255
  599   HD21  ASN  76          1HD2      ASN  76  -9.107  -5.469   0.201
  600   HD22  ASN  76          2HD2      ASN  76 -10.043  -5.727  -1.229
  601    HA   PRO  77           HA       PRO  77  -5.708 -11.243   2.196
  602    HB2  PRO  77           2HB      PRO  77  -4.155  -9.933   4.089
  603    HB3  PRO  77           1HB      PRO  77  -3.906  -9.863   2.342
  604    HG2  PRO  77           2HG      PRO  77  -5.294  -7.923   4.140
  605    HG3  PRO  77           1HG      PRO  77  -4.236  -7.609   2.752
  606    HD2  PRO  77           2HD      PRO  77  -6.897  -7.376   2.546
  607    HD3  PRO  77           1HD      PRO  77  -5.925  -8.031   1.211
  608    H    MET  78           H        MET  78  -7.167  -9.389   4.852
  609    HA   MET  78           HA       MET  78  -6.615 -11.062   6.979
  610    HB2  MET  78           2HB      MET  78  -7.657  -9.112   7.628
  611    HB3  MET  78           1HB      MET  78  -8.856  -9.198   6.345
  612    HG2  MET  78           2HG      MET  78  -9.039 -11.365   8.296
  613    HG3  MET  78           1HG      MET  78  -9.308  -9.758   8.968
  614    HE1  MET  78           3HE      MET  78 -13.009 -10.224   8.685
  615    HE2  MET  78           1HE      MET  78 -11.662  -9.432   9.501
  616    HE3  MET  78           2HE      MET  78 -11.781 -11.192   9.499
  617    H    ALA  79           H        ALA  79  -8.558 -11.707   4.251
  618    HA   ALA  79           HA       ALA  79  -9.311 -14.259   5.391
  619    HB1  ALA  79           1HB      ALA  79 -11.170 -12.330   5.412
  620    HB2  ALA  79           2HB      ALA  79 -11.552 -14.040   5.211
  621    HB3  ALA  79           3HB      ALA  79 -11.441 -12.988   3.799
  622    H    LYS  80           H        LYS  80  -7.574 -12.948   3.185
  623    HA   LYS  80           HA       LYS  80  -7.888 -13.233   0.685
  624    HB2  LYS  80           2HB      LYS  80  -5.952 -14.830   2.315
  625    HB3  LYS  80           1HB      LYS  80  -6.002 -15.057   0.573
  626    HG2  LYS  80           2HG      LYS  80  -5.904 -12.354   0.740
  627    HG3  LYS  80           1HG      LYS  80  -4.960 -12.824   2.155
  628    HD2  LYS  80           2HD      LYS  80  -3.305 -12.822   0.582
  629    HD3  LYS  80           1HD      LYS  80  -3.861 -14.489   0.414
  630    HE2  LYS  80           2HE      LYS  80  -5.471 -13.517  -1.363
  631    HE3  LYS  80           1HE      LYS  80  -4.378 -12.134  -1.363
  632    HZ1  LYS  80           3HZ      LYS  80  -3.888 -13.878  -3.060
  633    HZ2  LYS  80           1HZ      LYS  80  -3.468 -14.922  -1.796
  634    HZ3  LYS  80           2HZ      LYS  80  -2.588 -13.501  -2.046
  635   H282  PNS 101          8H2       PNS 101   1.046  13.140  -9.595
  636   H281  PNS 101          9H2       PNS 101   1.176  13.678 -11.273
  637   H303  PNS 101          0H3       PNS 101   3.897  14.731  -8.402
  638   H302  PNS 101          1H3       PNS 101   3.037  13.215  -8.123
  639   H301  PNS 101          2H3       PNS 101   2.135  14.717  -8.331
  640   H313  PNS 101          3H3       PNS 101   4.231  12.236  -9.925
  641   H312  PNS 101          4H3       PNS 101   5.043  13.711 -10.451
  642   H311  PNS 101          5H3       PNS 101   4.031  12.808 -11.581
  643    H32  PNS 101           6H3      PNS 101   3.273  14.909 -11.830
  644    H33  PNS 101           7H3      PNS 101   1.725  16.663 -11.464
  645    H36  PNS 101           8H3      PNS 101   5.998  15.732 -10.439
  646   H372  PNS 101          9H3       PNS 101   5.010  14.091 -12.322
  647   H371  PNS 101          0H4       PNS 101   6.446  15.077 -12.590
  648   H382  PNS 101          1H4       PNS 101   4.651  15.274 -14.338
  649   H381  PNS 101          2H4       PNS 101   3.648  16.051 -13.113
  650    H41  PNS 101           3H4      PNS 101   5.369  18.250 -12.051
  651   H422  PNS 101          4H4       PNS 101   7.289  16.667 -11.487
  652   H421  PNS 101          5H4       PNS 101   7.799  17.007 -13.140
  653   H431  PNS 101          7H4       PNS 101   8.918  18.363 -11.304
  654   H432  PNS 101          6H4       PNS 101   8.223  19.283 -12.647
  655    H44  PNS 101           8H4      PNS 101   6.168  19.823 -11.079
  Start of MODEL    9
    1    H1   MET   1           1HT      MET   1  -3.019  -9.208   8.270
    2    H2   MET   1           2HT      MET   1  -3.443 -10.658   9.085
    3    H3   MET   1           3HT      MET   1  -2.126  -9.710   9.645
    4    HA   MET   1           HA       MET   1  -4.931  -8.825   9.559
    5    HB2  MET   1           2HB      MET   1  -3.237  -9.848  11.848
    6    HB3  MET   1           1HB      MET   1  -4.849  -9.165  12.007
    7    HG2  MET   1           2HG      MET   1  -5.556 -11.028  10.374
    8    HG3  MET   1           1HG      MET   1  -4.018 -11.773  10.808
    9    HE1  MET   1           2HE      MET   1  -5.110 -14.059  13.147
   10    HE2  MET   1           3HE      MET   1  -3.844 -12.997  13.763
   11    HE3  MET   1           1HE      MET   1  -3.903 -13.395  12.045
   12    H    ASN   2           H        ASN   2  -3.045  -8.097  12.263
   13    HA   ASN   2           HA       ASN   2  -3.192  -5.328  11.907
   14    HB2  ASN   2           2HB      ASN   2  -1.131  -5.602  13.681
   15    HB3  ASN   2           1HB      ASN   2  -2.840  -5.645  14.111
   16   HD21  ASN   2          1HD2      ASN   2  -0.116  -7.678  13.175
   17   HD22  ASN   2          2HD2      ASN   2  -0.636  -9.082  14.036
   18    H    ASP   3           H        ASP   3  -0.759  -7.633  10.994
   19    HA   ASP   3           HA       ASP   3   1.459  -6.049  10.642
   20    HB2  ASP   3           2HB      ASP   3   0.448  -8.515   9.323
   21    HB3  ASP   3           1HB      ASP   3   1.780  -7.669   8.542
   22    H    VAL   4           H        VAL   4  -1.460  -6.084   8.782
   23    HA   VAL   4           HA       VAL   4  -0.419  -4.795   6.470
   24    HB   VAL   4           HB       VAL   4  -2.763  -4.321   5.888
   25   HG11  VAL   4          1HG1      VAL   4  -1.793  -6.479   5.318
   26   HG12  VAL   4          2HG1      VAL   4  -3.507  -6.644   5.702
   27   HG13  VAL   4          3HG1      VAL   4  -2.289  -7.128   6.882
   28   HG21  VAL   4          3HG2      VAL   4  -4.357  -5.633   7.620
   29   HG22  VAL   4          1HG2      VAL   4  -4.063  -3.894   7.677
   30   HG23  VAL   4          2HG2      VAL   4  -3.155  -4.977   8.732
   31    H    LEU   5           H        LEU   5  -2.346  -3.594   9.216
   32    HA   LEU   5           HA       LEU   5  -2.214  -0.889   8.437
   33    HB2  LEU   5           2HB      LEU   5  -3.268  -2.425  10.644
   34    HB3  LEU   5           1HB      LEU   5  -2.588  -0.904  11.187
   35    HG   LEU   5           HG       LEU   5  -4.069  -0.037   9.100
   36   HD11  LEU   5          1HD1      LEU   5  -5.027  -2.702   9.727
   37   HD12  LEU   5          2HD1      LEU   5  -5.427  -1.645   8.373
   38   HD13  LEU   5          3HD1      LEU   5  -6.284  -1.477   9.904
   39   HD21  LEU   5          3HD2      LEU   5  -5.791   0.544  10.797
   40   HD22  LEU   5          1HD2      LEU   5  -4.143   0.932  11.292
   41   HD23  LEU   5          2HD2      LEU   5  -4.947  -0.495  11.946
   42    H    THR   6           H        THR   6  -0.214  -2.904  10.456
   43    HA   THR   6           HA       THR   6   1.297  -0.895  11.699
   44    HB   THR   6           HB       THR   6   2.923  -3.187  11.255
   45    HG1  THR   6           1HG      THR   6   0.904  -4.133  10.674
   46   HG21  THR   6          3HG2      THR   6   1.400  -2.180  13.632
   47   HG22  THR   6          1HG2      THR   6   3.120  -2.013  13.274
   48   HG23  THR   6          2HG2      THR   6   2.453  -3.596  13.678
   49    H    ARG   7           H        ARG   7   2.172  -2.962   8.975
   50    HA   ARG   7           HA       ARG   7   4.497  -1.458   8.388
   51    HB2  ARG   7           2HB      ARG   7   3.863  -3.985   7.894
   52    HB3  ARG   7           1HB      ARG   7   3.312  -3.300   6.370
   53    HG2  ARG   7           2HG      ARG   7   6.040  -2.624   7.351
   54    HG3  ARG   7           1HG      ARG   7   5.748  -4.210   6.633
   55    HD2  ARG   7           2HD      ARG   7   5.210  -3.314   4.563
   56    HD3  ARG   7           1HD      ARG   7   4.822  -1.734   5.237
   57    HE   ARG   7           HE       ARG   7   6.978  -1.154   4.819
   58   HH11  ARG   7          1HH1      ARG   7   6.864  -4.593   5.350
   59   HH12  ARG   7          2HH1      ARG   7   8.561  -4.820   5.087
   60   HH21  ARG   7          1HH2      ARG   7   9.213  -1.441   4.470
   61   HH22  ARG   7          2HH2      ARG   7   9.897  -3.028   4.587
   62    H    VAL   8           H        VAL   8   1.288  -1.753   6.962
   63    HA   VAL   8           HA       VAL   8   1.771  -0.094   4.743
   64    HB   VAL   8           HB       VAL   8  -0.234  -1.715   5.282
   65   HG11  VAL   8          1HG1      VAL   8  -2.260  -0.504   5.929
   66   HG12  VAL   8          2HG1      VAL   8  -1.304   0.955   6.193
   67   HG13  VAL   8          3HG1      VAL   8  -1.047  -0.463   7.209
   68   HG21  VAL   8          3HG2      VAL   8  -1.625   0.055   3.759
   69   HG22  VAL   8          1HG2      VAL   8  -0.394  -1.049   3.145
   70   HG23  VAL   8          2HG2      VAL   8   0.030   0.620   3.526
   71    H    LEU   9           H        LEU   9   0.214   0.553   7.868
   72    HA   LEU   9           HA       LEU   9  -0.193   3.316   7.405
   73    HB2  LEU   9           2HB      LEU   9  -1.125   3.366   9.483
   74    HB3  LEU   9           1HB      LEU   9  -1.195   1.641   9.190
   75    HG   LEU   9           HG       LEU   9   1.075   1.551  10.421
   76   HD11  LEU   9          1HD1      LEU   9   1.002   4.209  10.337
   77   HD12  LEU   9          2HD1      LEU   9   1.795   3.321  11.639
   78   HD13  LEU   9          3HD1      LEU   9   0.170   3.965  11.873
   79   HD21  LEU   9          3HD2      LEU   9  -0.159   1.655  12.651
   80   HD22  LEU   9          1HD2      LEU   9  -0.777   0.537  11.435
   81   HD23  LEU   9          2HD2      LEU   9  -1.585   2.081  11.706
   82    H    GLU  10           H        GLU  10   2.312   1.516   9.139
   83    HA   GLU  10           HA       GLU  10   3.760   3.743  10.057
   84    HB2  GLU  10           2HB      GLU  10   5.405   2.240  10.750
   85    HB3  GLU  10           1HB      GLU  10   3.916   1.311  10.837
   86    HG2  GLU  10           2HG      GLU  10   4.654  -0.175   9.363
   87    HG3  GLU  10           1HG      GLU  10   5.181   1.087   8.249
   88    H    VAL  11           H        VAL  11   3.802   1.940   7.099
   89    HA   VAL  11           HA       VAL  11   6.256   2.787   6.080
   90    HB   VAL  11           HB       VAL  11   3.882   1.495   5.003
   91   HG11  VAL  11          1HG1      VAL  11   3.931   3.097   3.301
   92   HG12  VAL  11          2HG1      VAL  11   4.851   1.741   2.648
   93   HG13  VAL  11          3HG1      VAL  11   5.694   3.152   3.288
   94   HG21  VAL  11          3HG2      VAL  11   6.075   0.400   3.812
   95   HG22  VAL  11          1HG2      VAL  11   5.373  -0.126   5.343
   96   HG23  VAL  11          2HG2      VAL  11   6.732   0.997   5.337
   97    H    VAL  12           H        VAL  12   3.019   3.965   5.260
   98    HA   VAL  12           HA       VAL  12   3.844   6.052   3.587
   99    HB   VAL  12           HB       VAL  12   1.570   5.578   3.429
  100   HG11  VAL  12          1HG1      VAL  12   0.036   5.587   5.396
  101   HG12  VAL  12          2HG1      VAL  12   1.450   5.764   6.434
  102   HG13  VAL  12          3HG1      VAL  12   1.260   4.319   5.440
  103   HG21  VAL  12          3HG2      VAL  12   1.888   7.963   3.364
  104   HG22  VAL  12          1HG2      VAL  12   1.798   8.063   5.122
  105   HG23  VAL  12          2HG2      VAL  12   0.370   7.613   4.190
  106    H    LYS  13           H        LYS  13   3.181   5.962   7.042
  107    HA   LYS  13           HA       LYS  13   3.598   8.688   7.579
  108    HB2  LYS  13           2HB      LYS  13   3.819   7.969   9.916
  109    HB3  LYS  13           1HB      LYS  13   2.462   7.175   9.127
  110    HG2  LYS  13           2HG      LYS  13   3.452   5.134   9.138
  111    HG3  LYS  13           1HG      LYS  13   5.088   5.802   9.163
  112    HD2  LYS  13           2HD      LYS  13   4.387   4.714  11.305
  113    HD3  LYS  13           1HD      LYS  13   4.886   6.397  11.472
  114    HE2  LYS  13           2HE      LYS  13   2.342   6.883  11.161
  115    HE3  LYS  13           1HE      LYS  13   2.155   5.199  11.647
  116    HZ1  LYS  13           3HZ      LYS  13   2.212   7.164  13.388
  117    HZ2  LYS  13           1HZ      LYS  13   3.879   6.883  13.295
  118    HZ3  LYS  13           2HZ      LYS  13   2.834   5.633  13.749
  119    H    ASN  14           H        ASN  14   5.796   5.942   7.351
  120    HA   ASN  14           HA       ASN  14   8.051   7.451   8.303
  121    HB2  ASN  14           2HB      ASN  14   8.078   4.757   6.938
  122    HB3  ASN  14           1HB      ASN  14   9.357   5.459   7.919
  123   HD21  ASN  14          1HD2      ASN  14   6.670   6.348   9.470
  124   HD22  ASN  14          2HD2      ASN  14   6.471   5.013  10.548
  125    H    PHE  15           H        PHE  15   6.371   7.409   5.481
  126    HA   PHE  15           HA       PHE  15   8.570   7.527   3.648
  127    HB2  PHE  15           2HB      PHE  15   5.640   7.530   3.473
  128    HB3  PHE  15           1HB      PHE  15   6.432   8.549   2.275
  129    HD1  PHE  15           2HD      PHE  15   8.911   6.968   1.824
  130    HD2  PHE  15           1HD      PHE  15   4.848   5.754   2.188
  131    HE1  PHE  15           2HE      PHE  15   9.386   4.985   0.449
  132    HE2  PHE  15           1HE      PHE  15   5.315   3.767   0.813
  133    HZ   PHE  15           HZ       PHE  15   7.586   3.381  -0.059
  134    H    GLU  16           H        GLU  16   6.793   9.687   5.619
  135    HA   GLU  16           HA       GLU  16   7.717  11.820   6.180
  136    HB2  GLU  16           2HB      GLU  16   9.008  13.069   4.704
  137    HB3  GLU  16           1HB      GLU  16   9.439  11.420   4.279
  138    HG2  GLU  16           2HG      GLU  16   8.861  11.812   2.190
  139    HG3  GLU  16           1HG      GLU  16   7.212  12.150   2.710
  140    H    LYS  17           H        LYS  17   5.311  10.596   4.404
  141    HA   LYS  17           HA       LYS  17   4.067  12.877   3.297
  142    HB2  LYS  17           2HB      LYS  17   2.705  10.359   4.236
  143    HB3  LYS  17           1HB      LYS  17   2.124  11.485   3.022
  144    HG2  LYS  17           2HG      LYS  17   4.059   9.291   2.804
  145    HG3  LYS  17           1HG      LYS  17   2.962   9.969   1.599
  146    HD2  LYS  17           2HD      LYS  17   5.601  11.109   2.496
  147    HD3  LYS  17           1HD      LYS  17   5.239  10.390   0.925
  148    HE2  LYS  17           2HE      LYS  17   3.457  12.579   1.713
  149    HE3  LYS  17           1HE      LYS  17   5.140  13.055   1.485
  150    HZ1  LYS  17           3HZ      LYS  17   3.289  11.854  -0.481
  151    HZ2  LYS  17           1HZ      LYS  17   4.965  11.805  -0.709
  152    HZ3  LYS  17           2HZ      LYS  17   4.169  13.294  -0.604
  153    H    VAL  18           H        VAL  18   3.543  11.122   6.354
  154    HA   VAL  18           HA       VAL  18   3.084  13.370   7.912
  155    HB   VAL  18           HB       VAL  18   0.430  12.619   8.058
  156   HG11  VAL  18          1HG1      VAL  18   1.854  14.914   7.832
  157   HG12  VAL  18          2HG1      VAL  18   0.094  14.827   7.806
  158   HG13  VAL  18          3HG1      VAL  18   0.995  14.896   6.292
  159   HG21  VAL  18          3HG2      VAL  18  -0.403  12.032   6.071
  160   HG22  VAL  18          1HG2      VAL  18   1.263  11.694   5.597
  161   HG23  VAL  18          2HG2      VAL  18   0.540  13.259   5.224
  162    H    ASP  19           H        ASP  19   2.344  12.873  10.062
  163    HA   ASP  19           HA       ASP  19   3.085  10.249  10.885
  164    HB2  ASP  19           2HB      ASP  19   1.733  12.232  12.686
  165    HB3  ASP  19           1HB      ASP  19   2.982  11.053  13.078
  166    H    ALA  20           H        ALA  20   1.825   8.535  11.324
  167    HA   ALA  20           HA       ALA  20  -0.822   8.391  10.462
  168    HB1  ALA  20           1HB      ALA  20   0.478   6.593  12.500
  169    HB2  ALA  20           2HB      ALA  20   0.708   6.457  10.757
  170    HB3  ALA  20           3HB      ALA  20  -0.892   6.207  11.458
  171    H    SER  21           H        SER  21   0.456   9.645  13.365
  172    HA   SER  21           HA       SER  21  -1.717   9.171  15.101
  173    HB2  SER  21           2HB      SER  21  -0.570  10.443  16.633
  174    HB3  SER  21           1HB      SER  21   0.752  10.081  15.522
  175    HG   SER  21           HG       SER  21  -0.710  12.463  15.837
  176    H    LYS  22           H        LYS  22  -1.332  11.270  12.450
  177    HA   LYS  22           HA       LYS  22  -3.325  13.164  13.351
  178    HB2  LYS  22           2HB      LYS  22  -2.832  14.423  11.402
  179    HB3  LYS  22           1HB      LYS  22  -1.292  13.823  12.003
  180    HG2  LYS  22           2HG      LYS  22  -1.636  11.897  10.332
  181    HG3  LYS  22           1HG      LYS  22  -2.841  12.955   9.596
  182    HD2  LYS  22           2HD      LYS  22   0.109  13.199   9.684
  183    HD3  LYS  22           1HD      LYS  22  -1.027  13.636   8.407
  184    HE2  LYS  22           2HE      LYS  22  -1.550  15.679   9.407
  185    HE3  LYS  22           1HE      LYS  22  -0.925  15.175  10.977
  186    HZ1  LYS  22           3HZ      LYS  22   1.272  15.008   9.477
  187    HZ2  LYS  22           1HZ      LYS  22   0.834  16.394  10.344
  188    HZ3  LYS  22           2HZ      LYS  22   0.479  16.281   8.694
  189    H    VAL  23           H        VAL  23  -3.216  10.217  11.672
  190    HA   VAL  23           HA       VAL  23  -5.549  10.653  10.056
  191    HB   VAL  23           HB       VAL  23  -5.179   8.601   9.135
  192   HG11  VAL  23          1HG1      VAL  23  -2.505   9.125  10.430
  193   HG12  VAL  23          2HG1      VAL  23  -3.095   9.876   8.948
  194   HG13  VAL  23          3HG1      VAL  23  -2.792   8.140   8.996
  195   HG21  VAL  23          3HG2      VAL  23  -5.698   7.322  11.136
  196   HG22  VAL  23          1HG2      VAL  23  -4.089   7.647  11.781
  197   HG23  VAL  23          2HG2      VAL  23  -4.275   6.657  10.334
  198    H    THR  24           H        THR  24  -7.595  10.454  10.690
  199    HA   THR  24           HA       THR  24  -8.152   9.019  13.164
  200    HB   THR  24           HB       THR  24  -8.769  11.666  12.441
  201    HG1  THR  24           1HG      THR  24  -9.278  11.759  14.511
  202   HG21  THR  24          3HG2      THR  24 -11.334  10.214  12.934
  203   HG22  THR  24          1HG2      THR  24 -10.775  10.566  11.301
  204   HG23  THR  24          2HG2      THR  24 -11.077  11.884  12.431
  205    HA   PRO  25           HA       PRO  25 -10.958   6.224  11.269
  206    HB2  PRO  25           2HB      PRO  25 -13.341   6.640  12.599
  207    HB3  PRO  25           1HB      PRO  25 -12.001   5.671  13.218
  208    HG2  PRO  25           2HG      PRO  25 -12.740   8.501  13.837
  209    HG3  PRO  25           1HG      PRO  25 -12.162   7.228  14.927
  210    HD2  PRO  25           2HD      PRO  25 -10.533   9.174  14.055
  211    HD3  PRO  25           1HD      PRO  25  -9.951   7.512  14.288
  212    H    GLU  26           H        GLU  26 -12.278   9.480  11.673
  213    HA   GLU  26           HA       GLU  26 -13.884   9.111   9.262
  214    HB2  GLU  26           2HB      GLU  26 -15.056   9.902  11.296
  215    HB3  GLU  26           1HB      GLU  26 -14.024  11.325  11.309
  216    HG2  GLU  26           2HG      GLU  26 -16.308  11.659  10.349
  217    HG3  GLU  26           1HG      GLU  26 -14.971  12.147   9.307
  218    H    SER  27           H        SER  27 -10.888   9.883   9.777
  219    HA   SER  27           HA       SER  27 -10.659  12.455   8.562
  220    HB2  SER  27           2HB      SER  27  -9.014  11.343  10.204
  221    HB3  SER  27           1HB      SER  27  -8.419  10.460   8.799
  222    HG   SER  27           HG       SER  27  -8.251  13.186   9.401
  223    H    HIS  28           H        HIS  28 -10.248  12.969   6.472
  224    HA   HIS  28           HA       HIS  28 -10.642  10.902   4.509
  225    HB2  HIS  28           2HB      HIS  28 -11.070  13.741   4.645
  226    HB3  HIS  28           1HB      HIS  28 -10.124  13.345   3.214
  227    HD1  HIS  28           1HD      HIS  28 -13.184  11.757   4.849
  228    HD2  HIS  28           2HD      HIS  28 -11.807  13.019   1.137
  229    HE1  HIS  28           1HE      HIS  28 -15.037  11.234   3.230
  230    HE2  HIS  28           2HE      HIS  28 -14.145  11.925   0.978
  231    H    PHE  29           H        PHE  29  -9.206  10.433   2.801
  232    HA   PHE  29           HA       PHE  29  -6.478  10.411   3.524
  233    HB2  PHE  29           2HB      PHE  29  -7.655   8.700   2.088
  234    HB3  PHE  29           1HB      PHE  29  -7.597   9.873   0.777
  235    HD1  PHE  29           2HD      PHE  29  -4.990  11.012   0.878
  236    HD2  PHE  29           1HD      PHE  29  -6.172   7.002   1.674
  237    HE1  PHE  29           2HE      PHE  29  -2.734  10.233   0.281
  238    HE2  PHE  29           1HE      PHE  29  -3.918   6.216   1.079
  239    HZ   PHE  29           HZ       PHE  29  -2.196   7.832   0.380
  240    H    VAL  30           H        VAL  30  -8.301  12.245   1.142
  241    HA   VAL  30           HA       VAL  30  -5.982  13.755   0.370
  242    HB   VAL  30           HB       VAL  30  -8.614  14.685  -0.553
  243   HG11  VAL  30          1HG1      VAL  30  -6.287  15.384  -1.357
  244   HG12  VAL  30          2HG1      VAL  30  -7.501  15.024  -2.585
  245   HG13  VAL  30          3HG1      VAL  30  -6.254  13.837  -2.202
  246   HG21  VAL  30          3HG2      VAL  30  -7.617  11.906  -1.108
  247   HG22  VAL  30          1HG2      VAL  30  -8.684  12.759  -2.223
  248   HG23  VAL  30          2HG2      VAL  30  -9.221  12.416  -0.578
  249    H    LYS  31           H        LYS  31  -8.882  14.189   2.230
  250    HA   LYS  31           HA       LYS  31  -8.551  16.993   2.614
  251    HB2  LYS  31           2HB      LYS  31 -10.208  15.223   4.385
  252    HB3  LYS  31           1HB      LYS  31 -10.479  16.906   3.951
  253    HG2  LYS  31           2HG      LYS  31 -11.005  16.222   1.657
  254    HG3  LYS  31           1HG      LYS  31 -10.761  14.535   2.114
  255    HD2  LYS  31           2HD      LYS  31 -13.024  14.664   2.374
  256    HD3  LYS  31           1HD      LYS  31 -12.524  15.177   3.987
  257    HE2  LYS  31           2HE      LYS  31 -12.534  17.479   2.359
  258    HE3  LYS  31           1HE      LYS  31 -14.030  16.609   2.021
  259    HZ1  LYS  31           3HZ      LYS  31 -14.771  16.867   4.153
  260    HZ2  LYS  31           1HZ      LYS  31 -13.885  18.299   3.983
  261    HZ3  LYS  31           2HZ      LYS  31 -13.219  16.987   4.815
  262    H    ASP  32           H        ASP  32  -7.315  14.168   4.127
  263    HA   ASP  32           HA       ASP  32  -6.655  15.498   6.591
  264    HB2  ASP  32           2HB      ASP  32  -7.311  13.112   6.578
  265    HB3  ASP  32           1HB      ASP  32  -5.877  12.743   5.625
  266    H    LEU  33           H        LEU  33  -5.415  15.649   3.596
  267    HA   LEU  33           HA       LEU  33  -3.324  17.138   3.741
  268    HB2  LEU  33           2HB      LEU  33  -2.584  14.620   5.128
  269    HB3  LEU  33           1HB      LEU  33  -1.363  15.351   4.105
  270    HG   LEU  33           HG       LEU  33  -2.646  17.255   5.922
  271   HD11  LEU  33          1HD1      LEU  33  -1.542  14.721   6.949
  272   HD12  LEU  33          2HD1      LEU  33  -2.703  15.833   7.673
  273   HD13  LEU  33          3HD1      LEU  33  -0.977  16.193   7.737
  274   HD21  LEU  33          3HD2      LEU  33  -0.660  17.737   4.559
  275   HD22  LEU  33          1HD2      LEU  33   0.231  16.494   5.436
  276   HD23  LEU  33          2HD2      LEU  33  -0.344  17.929   6.283
  277    H    GLY  34           H        GLY  34  -4.806  14.537   2.335
  278    HA2  GLY  34           2HA      GLY  34  -4.321  13.251   0.425
  279    HA3  GLY  34           1HA      GLY  34  -4.382  14.881  -0.228
  280    H    LEU  35           H        LEU  35  -2.462  12.133   0.304
  281    HA   LEU  35           HA       LEU  35   0.104  13.340   0.172
  282    HB2  LEU  35           2HB      LEU  35  -0.957  10.566  -0.125
  283    HB3  LEU  35           1HB      LEU  35   0.685  10.904  -0.640
  284    HG   LEU  35           HG       LEU  35   1.414  10.736   1.451
  285   HD11  LEU  35          1HD1      LEU  35   1.090  13.027   1.871
  286   HD12  LEU  35          2HD1      LEU  35   0.409  12.194   3.269
  287   HD13  LEU  35          3HD1      LEU  35  -0.658  12.835   2.021
  288   HD21  LEU  35          3HD2      LEU  35  -0.077   9.881   3.194
  289   HD22  LEU  35          1HD2      LEU  35  -0.317   9.038   1.664
  290   HD23  LEU  35          2HD2      LEU  35  -1.473  10.264   2.187
  291    H    ASN  36           H        ASN  36   1.614  13.206  -1.605
  292    HA   ASN  36           HA       ASN  36   0.481  14.070  -4.052
  293    HB2  ASN  36           2HB      ASN  36   2.774  14.669  -3.030
  294    HB3  ASN  36           1HB      ASN  36   3.332  13.169  -3.750
  295   HD21  ASN  36          1HD2      ASN  36   3.095  12.927  -6.018
  296   HD22  ASN  36          2HD2      ASN  36   3.175  14.309  -7.054
  297    H    SER  37           H        SER  37   1.213  13.089  -6.185
  298    HA   SER  37           HA       SER  37   0.142  10.510  -6.435
  299    HB2  SER  37           2HB      SER  37   1.974  11.384  -8.574
  300    HB3  SER  37           1HB      SER  37   0.293  10.861  -8.672
  301    H    LEU  38           H        LEU  38   3.482  11.546  -6.985
  302    HA   LEU  38           HA       LEU  38   4.666   9.094  -7.313
  303    HB2  LEU  38           2HB      LEU  38   6.731  10.102  -6.844
  304    HB3  LEU  38           1HB      LEU  38   5.733  11.389  -7.491
  305    HG   LEU  38           HG       LEU  38   7.089  12.147  -5.596
  306   HD11  LEU  38          1HD1      LEU  38   4.143  12.053  -4.980
  307   HD12  LEU  38          2HD1      LEU  38   4.943  13.216  -6.035
  308   HD13  LEU  38          3HD1      LEU  38   5.307  13.195  -4.310
  309   HD21  LEU  38          3HD2      LEU  38   6.600   9.700  -4.501
  310   HD22  LEU  38          1HD2      LEU  38   5.519  10.738  -3.569
  311   HD23  LEU  38          2HD2      LEU  38   7.246  11.090  -3.629
  312    H    ASP  39           H        ASP  39   3.423  10.499  -4.428
  313    HA   ASP  39           HA       ASP  39   4.830   8.836  -2.587
  314    HB2  ASP  39           2HB      ASP  39   3.934  10.962  -1.840
  315    HB3  ASP  39           1HB      ASP  39   2.302  10.459  -2.269
  316    H    VAL  40           H        VAL  40   1.348   8.949  -2.583
  317    HA   VAL  40           HA       VAL  40   0.774   6.476  -1.703
  318    HB   VAL  40           HB       VAL  40  -0.778   8.441  -2.640
  319   HG11  VAL  40          1HG1      VAL  40  -0.150   7.258  -4.993
  320   HG12  VAL  40          2HG1      VAL  40  -1.629   8.174  -4.705
  321   HG13  VAL  40          3HG1      VAL  40  -1.645   6.415  -4.584
  322   HG21  VAL  40          3HG2      VAL  40  -2.164   7.255  -1.372
  323   HG22  VAL  40          1HG2      VAL  40  -1.160   5.818  -1.571
  324   HG23  VAL  40          2HG2      VAL  40  -2.442   6.166  -2.732
  325    H    VAL  41           H        VAL  41   1.828   7.263  -4.948
  326    HA   VAL  41           HA       VAL  41   1.202   4.771  -6.135
  327    HB   VAL  41           HB       VAL  41   2.518   5.450  -7.997
  328   HG11  VAL  41          1HG1      VAL  41   1.838   8.101  -7.847
  329   HG12  VAL  41          2HG1      VAL  41   0.741   7.356  -6.683
  330   HG13  VAL  41          3HG1      VAL  41   0.767   6.795  -8.355
  331   HG21  VAL  41          3HG2      VAL  41   3.910   7.605  -7.751
  332   HG22  VAL  41          1HG2      VAL  41   4.575   6.098  -7.119
  333   HG23  VAL  41          2HG2      VAL  41   3.847   7.268  -6.021
  334    H    GLU  42           H        GLU  42   4.089   6.047  -4.549
  335    HA   GLU  42           HA       GLU  42   5.698   3.779  -5.132
  336    HB2  GLU  42           2HB      GLU  42   5.981   6.257  -3.551
  337    HB3  GLU  42           1HB      GLU  42   6.963   4.897  -3.026
  338    HG2  GLU  42           2HG      GLU  42   7.477   4.810  -5.645
  339    HG3  GLU  42           1HG      GLU  42   7.136   6.532  -5.475
  340    H    VAL  43           H        VAL  43   3.920   4.893  -2.320
  341    HA   VAL  43           HA       VAL  43   4.618   2.773  -0.605
  342    HB   VAL  43           HB       VAL  43   3.727   4.466   0.632
  343   HG11  VAL  43          1HG1      VAL  43   1.338   5.370  -0.389
  344   HG12  VAL  43          2HG1      VAL  43   2.305   5.060  -1.829
  345   HG13  VAL  43          3HG1      VAL  43   2.906   6.150  -0.580
  346   HG21  VAL  43          3HG2      VAL  43   2.429   2.303   0.970
  347   HG22  VAL  43          1HG2      VAL  43   1.130   3.110   0.101
  348   HG23  VAL  43          2HG2      VAL  43   1.722   3.788   1.611
  349    H    VAL  44           H        VAL  44   1.943   3.265  -2.830
  350    HA   VAL  44           HA       VAL  44   0.413   1.024  -2.145
  351    HB   VAL  44           HB       VAL  44  -0.653   2.543  -3.578
  352   HG11  VAL  44          1HG1      VAL  44   1.851   3.031  -4.601
  353   HG12  VAL  44          2HG1      VAL  44   0.342   3.742  -5.172
  354   HG13  VAL  44          3HG1      VAL  44   0.996   2.308  -5.963
  355   HG21  VAL  44          3HG2      VAL  44  -0.519   0.982  -5.872
  356   HG22  VAL  44          1HG2      VAL  44  -1.647   0.793  -4.529
  357   HG23  VAL  44          2HG2      VAL  44  -0.145  -0.131  -4.556
  358    H    PHE  45           H        PHE  45   3.139   1.388  -4.363
  359    HA   PHE  45           HA       PHE  45   3.053  -1.266  -5.359
  360    HB2  PHE  45           2HB      PHE  45   5.206   0.843  -5.301
  361    HB3  PHE  45           1HB      PHE  45   5.481  -0.753  -5.993
  362    HD1  PHE  45           1HD      PHE  45   2.400   1.299  -6.179
  363    HD2  PHE  45           2HD      PHE  45   5.764  -0.273  -8.258
  364    HE1  PHE  45           1HE      PHE  45   1.435   2.063  -8.310
  365    HE2  PHE  45           2HE      PHE  45   4.806   0.489 -10.393
  366    HZ   PHE  45           HZ       PHE  45   2.639   1.658 -10.421
  367    H    ALA  46           H        ALA  46   4.292   0.207  -2.507
  368    HA   ALA  46           HA       ALA  46   6.080  -1.893  -1.786
  369    HB1  ALA  46           1HB      ALA  46   5.016  -0.099   0.303
  370    HB2  ALA  46           2HB      ALA  46   5.919   0.650  -1.013
  371    HB3  ALA  46           3HB      ALA  46   6.675  -0.598  -0.023
  372    H    ILE  47           H        ILE  47   3.174  -0.727  -0.160
  373    HA   ILE  47           HA       ILE  47   2.712  -2.852   1.509
  374    HB   ILE  47           HB       ILE  47   0.287  -2.236   1.410
  375   HG12  ILE  47          2HG1      ILE  47   1.191  -0.975  -1.042
  376   HG13  ILE  47          1HG1      ILE  47  -0.448  -1.307  -0.497
  377   HG21  ILE  47          1HG2      ILE  47   1.380  -1.073   3.053
  378   HG22  ILE  47          2HG2      ILE  47   0.807   0.258   2.047
  379   HG23  ILE  47          3HG2      ILE  47   2.480  -0.288   1.919
  380   HD11  ILE  47          3HD1      ILE  47   1.048   1.176  -0.508
  381   HD12  ILE  47          1HD1      ILE  47   0.298   0.837   1.051
  382   HD13  ILE  47          2HD1      ILE  47  -0.689   0.898  -0.407
  383    H    GLU  48           H        GLU  48   1.563  -2.454  -1.835
  384    HA   GLU  48           HA       GLU  48   0.062  -4.784  -2.026
  385    HB2  GLU  48           2HB      GLU  48  -0.103  -3.228  -3.805
  386    HB3  GLU  48           1HB      GLU  48   1.634  -3.235  -4.073
  387    HG2  GLU  48           2HG      GLU  48  -0.175  -5.585  -4.576
  388    HG3  GLU  48           1HG      GLU  48   0.341  -4.433  -5.808
  389    H    GLN  49           H        GLN  49   3.497  -4.242  -2.331
  390    HA   GLN  49           HA       GLN  49   4.312  -6.699  -3.348
  391    HB2  GLN  49           2HB      GLN  49   5.546  -4.439  -2.059
  392    HB3  GLN  49           1HB      GLN  49   6.233  -5.929  -1.426
  393    HG2  GLN  49           2HG      GLN  49   6.773  -6.655  -3.685
  394    HG3  GLN  49           1HG      GLN  49   6.058  -5.180  -4.336
  395   HE21  GLN  49          1HE2      GLN  49   6.981  -3.222  -2.808
  396   HE22  GLN  49          2HE2      GLN  49   8.706  -3.139  -2.852
  397    H    GLU  50           H        GLU  50   3.756  -5.705   0.013
  398    HA   GLU  50           HA       GLU  50   3.907  -8.507   0.794
  399    HB2  GLU  50           2HB      GLU  50   4.244  -7.681   3.100
  400    HB3  GLU  50           1HB      GLU  50   5.498  -7.137   1.993
  401    HG2  GLU  50           2HG      GLU  50   3.200  -5.325   2.313
  402    HG3  GLU  50           1HG      GLU  50   4.224  -5.535   3.733
  403    H    PHE  51           H        PHE  51   1.610  -7.384  -0.467
  404    HA   PHE  51           HA       PHE  51  -0.341  -7.855   1.630
  405    HB2  PHE  51           2HB      PHE  51  -0.081  -5.434  -0.035
  406    HB3  PHE  51           1HB      PHE  51  -1.711  -6.073   0.128
  407    HD1  PHE  51           2HD      PHE  51   1.235  -4.992   2.113
  408    HD2  PHE  51           1HD      PHE  51  -2.975  -5.603   2.016
  409    HE1  PHE  51           2HE      PHE  51   1.029  -3.891   4.303
  410    HE2  PHE  51           1HE      PHE  51  -3.189  -4.502   4.206
  411    HZ   PHE  51           HZ       PHE  51  -1.186  -3.645   5.352
  412    H    ILE  52           H        ILE  52   0.849  -8.720  -1.318
  413    HA   ILE  52           HA       ILE  52   0.103  -9.933  -3.086
  414    HB   ILE  52           HB       ILE  52  -1.766 -11.597  -2.484
  415   HG12  ILE  52          2HG1      ILE  52  -1.763 -11.940   0.080
  416   HG13  ILE  52          1HG1      ILE  52  -1.293 -10.252   0.133
  417   HG21  ILE  52          1HG2      ILE  52  -0.125 -13.043  -2.014
  418   HG22  ILE  52          2HG2      ILE  52   0.409 -12.119  -0.610
  419   HG23  ILE  52          3HG2      ILE  52   0.942 -11.654  -2.226
  420   HD11  ILE  52          3HD1      ILE  52  -3.821 -11.411  -0.982
  421   HD12  ILE  52          1HD1      ILE  52  -3.332  -9.735  -1.221
  422   HD13  ILE  52          2HD1      ILE  52  -3.640 -10.338   0.407
  423    H    LEU  53           H        LEU  53  -0.801  -7.468  -3.391
  424    HA   LEU  53           HA       LEU  53  -2.897  -7.623  -5.143
  425    HB2  LEU  53           2HB      LEU  53  -3.905  -7.967  -2.585
  426    HB3  LEU  53           1HB      LEU  53  -4.217  -6.275  -2.924
  427    HG   LEU  53           HG       LEU  53  -6.092  -6.965  -3.918
  428   HD11  LEU  53          1HD1      LEU  53  -5.951  -7.522  -6.208
  429   HD12  LEU  53          2HD1      LEU  53  -4.370  -8.276  -6.003
  430   HD13  LEU  53          3HD1      LEU  53  -4.537  -6.527  -5.858
  431   HD21  LEU  53          3HD2      LEU  53  -4.828  -9.653  -3.662
  432   HD22  LEU  53          1HD2      LEU  53  -6.251  -9.464  -4.686
  433   HD23  LEU  53          2HD2      LEU  53  -6.335  -9.045  -2.976
  434    H    ASP  54           H        ASP  54  -3.001  -5.762  -6.276
  435    HA   ASP  54           HA       ASP  54  -1.324  -3.590  -5.455
  436    HB2  ASP  54           2HB      ASP  54  -1.951  -4.630  -7.885
  437    HB3  ASP  54           1HB      ASP  54  -3.018  -3.230  -7.842
  438    H    ILE  55           H        ILE  55  -1.938  -1.507  -4.947
  439    HA   ILE  55           HA       ILE  55  -4.794  -1.118  -4.436
  440    HB   ILE  55           HB       ILE  55  -2.412  -0.121  -2.894
  441   HG12  ILE  55          2HG1      ILE  55  -2.870  -2.085  -1.855
  442   HG13  ILE  55          1HG1      ILE  55  -4.157  -1.156  -1.093
  443   HG21  ILE  55          1HG2      ILE  55  -5.113   1.009  -3.133
  444   HG22  ILE  55          2HG2      ILE  55  -3.606   1.762  -2.611
  445   HG23  ILE  55          3HG2      ILE  55  -4.539   0.779  -1.481
  446   HD11  ILE  55          3HD1      ILE  55  -5.584  -1.921  -3.096
  447   HD12  ILE  55          1HD1      ILE  55  -5.231  -3.071  -1.807
  448   HD13  ILE  55          2HD1      ILE  55  -4.327  -3.139  -3.319
  449    HA   PRO  56           HA       PRO  56  -2.757   2.682  -6.665
  450    HB2  PRO  56           2HB      PRO  56  -1.896   1.913  -9.097
  451    HB3  PRO  56           1HB      PRO  56  -0.851   1.853  -7.672
  452    HG2  PRO  56           2HG      PRO  56  -2.395  -0.358  -8.979
  453    HG3  PRO  56           1HG      PRO  56  -0.723  -0.362  -8.388
  454    HD2  PRO  56           2HD      PRO  56  -2.790  -1.408  -6.966
  455    HD3  PRO  56           1HD      PRO  56  -1.363  -0.680  -6.202
  456    H    ASP  57           H        ASP  57  -3.358   1.006  -9.601
  457    HA   ASP  57           HA       ASP  57  -4.964   2.118 -11.093
  458    HB2  ASP  57           2HB      ASP  57  -6.038  -0.392  -9.791
  459    HB3  ASP  57           1HB      ASP  57  -6.606   0.275 -11.320
  460    H    HIS  58           H        HIS  58  -7.725   0.859 -10.109
  461    HA   HIS  58           HA       HIS  58  -8.794   3.394  -9.306
  462    HB2  HIS  58           2HB      HIS  58 -10.439   0.903  -9.331
  463    HB3  HIS  58           1HB      HIS  58 -10.879   2.537  -9.814
  464    HD1  HIS  58           1HD      HIS  58 -10.467   3.200 -12.241
  465    HD2  HIS  58           2HD      HIS  58  -9.065  -0.598 -11.307
  466    HE1  HIS  58           1HE      HIS  58  -9.891   2.136 -14.445
  467    HE2  HIS  58           2HE      HIS  58  -8.962  -0.129 -13.849
  468    H    ASP  59           H        ASP  59  -7.580   0.664  -7.710
  469    HA   ASP  59           HA       ASP  59  -9.225   0.563  -5.436
  470    HB2  ASP  59           2HB      ASP  59  -6.266  -0.036  -5.469
  471    HB3  ASP  59           1HB      ASP  59  -7.493  -0.725  -4.410
  472    H    ALA  60           H        ALA  60  -6.256   2.383  -6.088
  473    HA   ALA  60           HA       ALA  60  -6.423   3.725  -3.537
  474    HB1  ALA  60           1HB      ALA  60  -4.412   3.607  -5.723
  475    HB2  ALA  60           2HB      ALA  60  -4.214   3.321  -3.994
  476    HB3  ALA  60           3HB      ALA  60  -4.378   4.968  -4.602
  477    H    GLU  61           H        GLU  61  -6.863   4.439  -6.935
  478    HA   GLU  61           HA       GLU  61  -7.159   7.231  -6.700
  479    HB2  GLU  61           2HB      GLU  61  -7.619   5.193  -8.759
  480    HB3  GLU  61           1HB      GLU  61  -8.708   6.570  -8.870
  481    HG2  GLU  61           2HG      GLU  61  -6.901   8.089  -9.104
  482    HG3  GLU  61           1HG      GLU  61  -5.722   6.847  -8.687
  483    H    LYS  62           H        LYS  62  -9.431   4.570  -6.402
  484    HA   LYS  62           HA       LYS  62 -11.711   6.313  -6.191
  485    HB2  LYS  62           2HB      LYS  62 -11.435   3.338  -5.752
  486    HB3  LYS  62           1HB      LYS  62 -12.959   4.216  -5.733
  487    HG2  LYS  62           2HG      LYS  62 -11.162   3.599  -8.036
  488    HG3  LYS  62           1HG      LYS  62 -12.899   3.336  -7.865
  489    HD2  LYS  62           2HD      LYS  62 -13.014   5.930  -7.738
  490    HD3  LYS  62           1HD      LYS  62 -11.415   5.861  -8.482
  491    HE2  LYS  62           2HE      LYS  62 -13.728   4.344  -9.635
  492    HE3  LYS  62           1HE      LYS  62 -13.485   6.050 -10.009
  493    HZ1  LYS  62           3HZ      LYS  62 -11.109   5.284 -10.598
  494    HZ2  LYS  62           1HZ      LYS  62 -12.360   4.989 -11.698
  495    HZ3  LYS  62           2HZ      LYS  62 -11.794   3.741 -10.707
  496    H    ILE  63           H        ILE  63  -9.331   6.142  -4.198
  497    HA   ILE  63           HA       ILE  63 -10.902   5.744  -1.765
  498    HB   ILE  63           HB       ILE  63  -8.081   5.292  -2.436
  499   HG12  ILE  63          2HG1      ILE  63  -9.187   4.123   0.007
  500   HG13  ILE  63          1HG1      ILE  63 -10.192   3.837  -1.409
  501   HG21  ILE  63          1HG2      ILE  63  -7.359   6.905  -1.015
  502   HG22  ILE  63          2HG2      ILE  63  -7.665   5.639   0.174
  503   HG23  ILE  63          3HG2      ILE  63  -8.858   6.913  -0.085
  504   HD11  ILE  63          3HD1      ILE  63  -7.661   2.656  -0.655
  505   HD12  ILE  63          1HD1      ILE  63  -7.645   3.284  -2.302
  506   HD13  ILE  63          2HD1      ILE  63  -8.867   2.108  -1.819
  507    H    GLN  64           H        GLN  64 -11.567   7.482  -0.699
  508    HA   GLN  64           HA       GLN  64 -10.115   9.984  -1.051
  509    HB2  GLN  64           2HB      GLN  64 -13.050   9.708  -0.422
  510    HB3  GLN  64           1HB      GLN  64 -12.186  11.191  -0.809
  511    HG2  GLN  64           2HG      GLN  64 -12.933  10.871  -2.879
  512    HG3  GLN  64           1HG      GLN  64 -11.670   9.647  -2.998
  513   HE21  GLN  64          1HE2      GLN  64 -12.290   7.439  -2.368
  514   HE22  GLN  64          2HE2      GLN  64 -13.890   6.901  -2.733
  515    H    SER  65           H        SER  65 -10.890   7.582   1.094
  516    HA   SER  65           HA       SER  65 -10.420   9.358   3.400
  517    HB2  SER  65           2HB      SER  65 -12.704   7.825   2.947
  518    HB3  SER  65           1HB      SER  65 -11.763   6.872   4.094
  519    HG   SER  65           HG       SER  65 -13.269   8.597   4.909
  520    H    ILE  66           H        ILE  66  -8.759   8.858   4.655
  521    HA   ILE  66           HA       ILE  66  -6.798   7.040   3.930
  522    HB   ILE  66           HB       ILE  66  -6.357   7.269   6.608
  523   HG12  ILE  66          2HG1      ILE  66  -8.587   8.909   6.126
  524   HG13  ILE  66          1HG1      ILE  66  -7.592   8.870   7.571
  525   HG21  ILE  66          1HG2      ILE  66  -5.046   7.996   4.473
  526   HG22  ILE  66          2HG2      ILE  66  -4.696   8.755   6.025
  527   HG23  ILE  66          3HG2      ILE  66  -5.707   9.587   4.845
  528   HD11  ILE  66          3HD1      ILE  66  -7.944  11.123   6.508
  529   HD12  ILE  66          1HD1      ILE  66  -6.913  10.562   5.193
  530   HD13  ILE  66          2HD1      ILE  66  -6.270  10.669   6.831
  531    HA   PRO  67           HA       PRO  67  -8.626   4.053   7.300
  532    HB2  PRO  67           2HB      PRO  67 -11.258   4.391   7.881
  533    HB3  PRO  67           1HB      PRO  67  -9.964   5.189   8.781
  534    HG2  PRO  67           2HG      PRO  67 -11.698   6.271   6.594
  535    HG3  PRO  67           1HG      PRO  67 -11.193   7.044   8.108
  536    HD2  PRO  67           2HD      PRO  67 -10.008   7.579   5.733
  537    HD3  PRO  67           1HD      PRO  67  -9.124   7.619   7.272
  538    H    ASP  68           H        ASP  68 -10.713   5.227   4.709
  539    HA   ASP  68           HA       ASP  68 -12.096   2.828   4.226
  540    HB2  ASP  68           2HB      ASP  68 -13.034   3.906   2.435
  541    HB3  ASP  68           1HB      ASP  68 -12.416   5.304   3.309
  542    H    ALA  69           H        ALA  69  -8.925   3.885   3.378
  543    HA   ALA  69           HA       ALA  69  -8.539   1.933   1.319
  544    HB1  ALA  69           1HB      ALA  69  -7.314   4.308   1.953
  545    HB2  ALA  69           2HB      ALA  69  -6.748   3.139   0.762
  546    HB3  ALA  69           3HB      ALA  69  -6.115   3.097   2.407
  547    H    VAL  70           H        VAL  70  -7.216   2.459   4.548
  548    HA   VAL  70           HA       VAL  70  -5.785   0.036   4.675
  549    HB   VAL  70           HB       VAL  70  -5.352   2.013   6.134
  550   HG11  VAL  70          1HG1      VAL  70  -6.946   1.613   8.326
  551   HG12  VAL  70          2HG1      VAL  70  -8.074   1.390   6.988
  552   HG13  VAL  70          3HG1      VAL  70  -7.156   2.890   7.128
  553   HG21  VAL  70          3HG2      VAL  70  -4.206   0.602   7.409
  554   HG22  VAL  70          1HG2      VAL  70  -5.154  -0.721   6.728
  555   HG23  VAL  70          2HG2      VAL  70  -5.679   0.066   8.216
  556    H    GLU  71           H        GLU  71  -9.095   0.824   5.200
  557    HA   GLU  71           HA       GLU  71  -9.772  -1.392   6.835
  558    HB2  GLU  71           2HB      GLU  71 -12.047  -0.769   6.482
  559    HB3  GLU  71           1HB      GLU  71 -11.117   0.717   6.609
  560    HG2  GLU  71           2HG      GLU  71 -11.170   1.016   4.227
  561    HG3  GLU  71           1HG      GLU  71 -11.952  -0.549   4.011
  562    H    TYR  72           H        TYR  72 -10.277  -0.741   3.370
  563    HA   TYR  72           HA       TYR  72 -11.330  -3.267   2.751
  564    HB2  TYR  72           2HB      TYR  72 -11.310  -2.589   0.544
  565    HB3  TYR  72           1HB      TYR  72 -11.258  -1.034   1.369
  566    HD1  TYR  72           2HD      TYR  72  -9.296  -3.488  -0.545
  567    HD2  TYR  72           1HD      TYR  72  -9.314   0.371   1.244
  568    HE1  TYR  72           2HE      TYR  72  -7.238  -2.919  -1.765
  569    HE2  TYR  72           1HE      TYR  72  -7.257   0.951   0.029
  570    HH   TYR  72           HH       TYR  72  -6.191  -0.383  -2.526
  571    H    ILE  73           H        ILE  73  -8.053  -2.034   2.781
  572    HA   ILE  73           HA       ILE  73  -6.826  -4.276   1.596
  573    HB   ILE  73           HB       ILE  73  -5.633  -2.281   3.478
  574   HG12  ILE  73          2HG1      ILE  73  -5.006  -2.139   0.611
  575   HG13  ILE  73          1HG1      ILE  73  -6.684  -1.783   1.008
  576   HG21  ILE  73          1HG2      ILE  73  -4.080  -3.833   1.462
  577   HG22  ILE  73          2HG2      ILE  73  -4.466  -4.555   3.024
  578   HG23  ILE  73          3HG2      ILE  73  -3.529  -3.063   2.950
  579   HD11  ILE  73          3HD1      ILE  73  -4.280  -0.205   1.445
  580   HD12  ILE  73          1HD1      ILE  73  -5.321  -0.314   2.864
  581   HD13  ILE  73          2HD1      ILE  73  -5.968   0.296   1.341
  582    H    ALA  74           H        ALA  74  -7.768  -3.509   4.845
  583    HA   ALA  74           HA       ALA  74  -6.276  -5.490   6.178
  584    HB1  ALA  74           1HB      ALA  74  -7.689  -3.425   7.052
  585    HB2  ALA  74           2HB      ALA  74  -7.341  -4.820   8.073
  586    HB3  ALA  74           3HB      ALA  74  -8.906  -4.682   7.274
  587    H    GLN  75           H        GLN  75  -9.564  -5.459   4.921
  588    HA   GLN  75           HA       GLN  75 -10.086  -8.147   5.724
  589    HB2  GLN  75           2HB      GLN  75 -11.739  -6.703   3.694
  590    HB3  GLN  75           1HB      GLN  75 -12.251  -7.838   4.936
  591    HG2  GLN  75           2HG      GLN  75 -12.368  -6.246   6.545
  592    HG3  GLN  75           1HG      GLN  75 -11.059  -5.289   5.849
  593   HE21  GLN  75          1HE2      GLN  75 -11.905  -3.339   5.561
  594   HE22  GLN  75          2HE2      GLN  75 -13.362  -2.993   4.701
  595    H    ASN  76           H        ASN  76  -9.080  -6.550   2.788
  596    HA   ASN  76           HA       ASN  76  -9.546  -8.556   0.927
  597    HB2  ASN  76           2HB      ASN  76  -7.794  -6.219   1.119
  598    HB3  ASN  76           1HB      ASN  76  -7.105  -7.513   0.143
  599   HD21  ASN  76          1HD2      ASN  76  -9.401  -5.009   0.311
  600   HD22  ASN  76          2HD2      ASN  76 -10.112  -5.238  -1.246
  601    HA   PRO  77           HA       PRO  77  -5.132 -10.479   1.513
  602    HB2  PRO  77           2HB      PRO  77  -3.811  -9.364   3.719
  603    HB3  PRO  77           1HB      PRO  77  -3.449  -9.047   2.021
  604    HG2  PRO  77           2HG      PRO  77  -5.079  -7.453   3.943
  605    HG3  PRO  77           1HG      PRO  77  -4.005  -6.897   2.646
  606    HD2  PRO  77           2HD      PRO  77  -6.664  -6.840   2.352
  607    HD3  PRO  77           1HD      PRO  77  -5.602  -7.274   0.995
  608    H    MET  78           H        MET  78  -6.836  -9.299   4.411
  609    HA   MET  78           HA       MET  78  -6.171 -11.468   6.080
  610    HB2  MET  78           2HB      MET  78  -8.294  -9.372   6.087
  611    HB3  MET  78           1HB      MET  78  -8.482 -10.751   7.159
  612    HG2  MET  78           2HG      MET  78  -7.128  -8.457   7.745
  613    HG3  MET  78           1HG      MET  78  -6.947  -9.998   8.579
  614    HE1  MET  78           3HE      MET  78  -4.138  -8.248   5.399
  615    HE2  MET  78           1HE      MET  78  -5.004  -7.249   6.566
  616    HE3  MET  78           2HE      MET  78  -5.899  -8.175   5.363
  617    H    ALA  79           H        ALA  79  -8.291 -11.211   3.424
  618    HA   ALA  79           HA       ALA  79  -9.858 -13.515   4.185
  619    HB1  ALA  79           1HB      ALA  79 -10.951 -11.545   3.155
  620    HB2  ALA  79           2HB      ALA  79 -11.228 -13.047   2.272
  621    HB3  ALA  79           3HB      ALA  79 -10.052 -11.876   1.675
  622    H    LYS  80           H        LYS  80  -8.550 -12.666   1.039
  623    HA   LYS  80           HA       LYS  80  -8.276 -14.813  -0.342
  624    HB2  LYS  80           2HB      LYS  80  -5.573 -14.125  -0.340
  625    HB3  LYS  80           1HB      LYS  80  -6.820 -13.494  -1.405
  626    HG2  LYS  80           2HG      LYS  80  -6.773 -12.159   1.175
  627    HG3  LYS  80           1HG      LYS  80  -5.244 -12.028   0.302
  628    HD2  LYS  80           2HD      LYS  80  -6.688 -10.167  -0.271
  629    HD3  LYS  80           1HD      LYS  80  -6.468 -11.214  -1.674
  630    HE2  LYS  80           2HE      LYS  80  -8.634 -12.281  -1.188
  631    HE3  LYS  80           1HE      LYS  80  -8.853 -11.181   0.172
  632    HZ1  LYS  80           3HZ      LYS  80  -8.559  -9.355  -1.574
  633    HZ2  LYS  80           1HZ      LYS  80 -10.029 -10.192  -1.546
  634    HZ3  LYS  80           2HZ      LYS  80  -8.865 -10.566  -2.714
  635   H282  PNS 101          8H2       PNS 101   2.449  13.617  -9.055
  636   H281  PNS 101          9H2       PNS 101   2.417  15.384  -9.023
  637   H303  PNS 101          0H3       PNS 101   4.514  16.005 -11.769
  638   H302  PNS 101          1H3       PNS 101   4.159  16.408 -10.090
  639   H301  PNS 101          2H3       PNS 101   2.899  16.543 -11.314
  640   H313  PNS 101          3H3       PNS 101   5.461  14.282 -10.590
  641   H312  PNS 101          4H3       PNS 101   4.547  12.786 -10.776
  642   H311  PNS 101          5H3       PNS 101   4.545  13.634  -9.230
  643    H32  PNS 101           6H3      PNS 101   2.010  13.337 -11.573
  644    H33  PNS 101           7H3      PNS 101   1.083  14.465 -12.845
  645    H36  PNS 101           8H3      PNS 101   5.423  12.938 -13.365
  646   H372  PNS 101          9H3       PNS 101   4.422  15.439 -13.593
  647   H371  PNS 101          0H4       PNS 101   3.491  14.525 -14.778
  648   H382  PNS 101          1H4       PNS 101   6.228  13.854 -15.102
  649   H381  PNS 101          2H4       PNS 101   5.157  14.686 -16.228
  650    H41  PNS 101           3H4      PNS 101   6.113  15.616 -13.094
  651   H422  PNS 101          4H4       PNS 101   8.313  17.315 -13.983
  652   H421  PNS 101          5H4       PNS 101   7.030  18.065 -13.035
  653   H431  PNS 101          7H4       PNS 101   7.497  16.655 -11.157
  654   H432  PNS 101          6H4       PNS 101   8.629  15.682 -12.107
  655    H44  PNS 101           8H4      PNS 101  10.379  17.260 -11.441
  Start of MODEL   10
    1    H1   MET   1           1HT      MET   1  -2.914  -9.205   9.567
    2    H2   MET   1           2HT      MET   1  -3.724 -10.359  10.545
    3    H3   MET   1           3HT      MET   1  -2.520  -9.347  11.229
    4    HA   MET   1           HA       MET   1  -4.971  -8.304  10.002
    5    HB2  MET   1           2HB      MET   1  -5.493  -8.068  12.601
    6    HB3  MET   1           1HB      MET   1  -5.951  -9.501  11.689
    7    HG2  MET   1           2HG      MET   1  -3.294  -9.412  13.032
    8    HG3  MET   1           1HG      MET   1  -4.743  -9.710  13.989
    9    HE1  MET   1           2HE      MET   1  -1.932 -11.923  12.591
   10    HE2  MET   1           3HE      MET   1  -2.833 -13.103  13.543
   11    HE3  MET   1           1HE      MET   1  -2.572 -11.476  14.172
   12    H    ASN   2           H        ASN   2  -3.293  -7.649  13.040
   13    HA   ASN   2           HA       ASN   2  -3.315  -4.874  12.712
   14    HB2  ASN   2           2HB      ASN   2  -1.615  -6.640  14.472
   15    HB3  ASN   2           1HB      ASN   2  -1.596  -4.881  14.564
   16   HD21  ASN   2          1HD2      ASN   2  -4.628  -5.769  13.673
   17   HD22  ASN   2          2HD2      ASN   2  -5.386  -5.811  15.224
   18    H    ASP   3           H        ASP   3  -1.017  -7.288  11.748
   19    HA   ASP   3           HA       ASP   3   1.267  -5.808  11.334
   20    HB2  ASP   3           2HB      ASP   3   1.264  -7.510   9.169
   21    HB3  ASP   3           1HB      ASP   3   1.824  -7.917  10.789
   22    H    VAL   4           H        VAL   4  -1.693  -5.733   9.538
   23    HA   VAL   4           HA       VAL   4  -0.682  -4.591   7.158
   24    HB   VAL   4           HB       VAL   4  -3.250  -5.281   8.201
   25   HG11  VAL   4          1HG1      VAL   4  -3.097  -2.608   6.818
   26   HG12  VAL   4          2HG1      VAL   4  -3.643  -2.908   8.467
   27   HG13  VAL   4          3HG1      VAL   4  -4.580  -3.518   7.103
   28   HG21  VAL   4          3HG2      VAL   4  -2.872  -6.348   6.255
   29   HG22  VAL   4          1HG2      VAL   4  -1.866  -5.047   5.617
   30   HG23  VAL   4          2HG2      VAL   4  -3.625  -4.915   5.555
   31    H    LEU   5           H        LEU   5  -2.420  -3.082   9.881
   32    HA   LEU   5           HA       LEU   5  -1.975  -0.439   8.994
   33    HB2  LEU   5           2HB      LEU   5  -2.357  -0.704  11.853
   34    HB3  LEU   5           1HB      LEU   5  -3.320   0.155  10.672
   35    HG   LEU   5           HG       LEU   5  -4.038  -2.373  10.078
   36   HD11  LEU   5          1HD1      LEU   5  -3.149  -2.360  12.934
   37   HD12  LEU   5          2HD1      LEU   5  -2.888  -3.579  11.687
   38   HD13  LEU   5          3HD1      LEU   5  -4.485  -3.383  12.408
   39   HD21  LEU   5          3HD2      LEU   5  -5.135  -0.154  11.563
   40   HD22  LEU   5          1HD2      LEU   5  -5.746  -1.693  12.168
   41   HD23  LEU   5          2HD2      LEU   5  -5.934  -1.278  10.465
   42    H    THR   6           H        THR   6  -0.252  -2.609  11.092
   43    HA   THR   6           HA       THR   6   1.469  -0.786  12.317
   44    HB   THR   6           HB       THR   6   1.112  -3.550  12.336
   45    HG1  THR   6           1HG      THR   6   3.139  -2.100  13.677
   46   HG21  THR   6          3HG2      THR   6   3.623  -4.176  12.398
   47   HG22  THR   6          1HG2      THR   6   3.800  -2.820  11.284
   48   HG23  THR   6          2HG2      THR   6   2.758  -4.179  10.860
   49    H    ARG   7           H        ARG   7   2.093  -2.832   9.494
   50    HA   ARG   7           HA       ARG   7   4.557  -1.525   8.910
   51    HB2  ARG   7           2HB      ARG   7   4.915  -3.426   7.805
   52    HB3  ARG   7           1HB      ARG   7   3.259  -3.923   8.128
   53    HG2  ARG   7           2HG      ARG   7   3.391  -4.052   5.829
   54    HG3  ARG   7           1HG      ARG   7   2.667  -2.462   6.082
   55    HD2  ARG   7           2HD      ARG   7   4.292  -1.654   4.790
   56    HD3  ARG   7           1HD      ARG   7   5.383  -1.961   6.140
   57    HE   ARG   7           HE       ARG   7   5.129  -3.520   3.704
   58   HH11  ARG   7          1HH1      ARG   7   6.422  -3.287   6.928
   59   HH12  ARG   7          2HH1      ARG   7   7.655  -4.472   6.660
   60   HH21  ARG   7          1HH2      ARG   7   6.749  -5.084   3.338
   61   HH22  ARG   7          2HH2      ARG   7   7.842  -5.495   4.618
   62    H    VAL   8           H        VAL   8   1.343  -1.606   7.427
   63    HA   VAL   8           HA       VAL   8   1.894   0.079   5.276
   64    HB   VAL   8           HB       VAL   8  -0.274  -1.325   5.965
   65   HG11  VAL   8          1HG1      VAL   8  -0.912   0.173   7.777
   66   HG12  VAL   8          2HG1      VAL   8  -2.127   0.183   6.499
   67   HG13  VAL   8          3HG1      VAL   8  -0.992   1.524   6.647
   68   HG21  VAL   8          3HG2      VAL   8  -1.245   0.791   4.326
   69   HG22  VAL   8          1HG2      VAL   8  -0.733  -0.830   3.854
   70   HG23  VAL   8          2HG2      VAL   8   0.443   0.484   3.913
   71    H    LEU   9           H        LEU   9   0.531   0.834   8.468
   72    HA   LEU   9           HA       LEU   9   0.213   3.583   8.139
   73    HB2  LEU   9           2HB      LEU   9  -0.053   3.709  10.448
   74    HB3  LEU   9           1HB      LEU   9  -0.513   2.062  10.080
   75    HG   LEU   9           HG       LEU   9   1.915   1.453  10.685
   76   HD11  LEU   9          1HD1      LEU   9   1.893   4.306  11.196
   77   HD12  LEU   9          2HD1      LEU   9   3.250   3.183  11.102
   78   HD13  LEU   9          3HD1      LEU   9   2.370   3.377  12.618
   79   HD21  LEU   9          3HD2      LEU   9   1.306   1.632  13.180
   80   HD22  LEU   9          1HD2      LEU   9   0.266   0.680  12.123
   81   HD23  LEU   9          2HD2      LEU   9  -0.220   2.304  12.604
   82    H    GLU  10           H        GLU  10   3.025   1.760   9.304
   83    HA   GLU  10           HA       GLU  10   4.651   3.932   9.945
   84    HB2  GLU  10           2HB      GLU  10   6.532   2.374   9.769
   85    HB3  GLU  10           1HB      GLU  10   5.178   1.647  10.623
   86    HG2  GLU  10           2HG      GLU  10   4.709   0.184   8.918
   87    HG3  GLU  10           1HG      GLU  10   5.460   1.203   7.692
   88    H    VAL  11           H        VAL  11   3.995   2.395   6.888
   89    HA   VAL  11           HA       VAL  11   6.087   3.523   5.401
   90    HB   VAL  11           HB       VAL  11   3.473   2.990   4.150
   91   HG11  VAL  11          1HG1      VAL  11   5.979   3.606   3.203
   92   HG12  VAL  11          2HG1      VAL  11   4.646   2.942   2.259
   93   HG13  VAL  11          3HG1      VAL  11   5.856   1.863   2.955
   94   HG21  VAL  11          3HG2      VAL  11   4.853   0.569   4.115
   95   HG22  VAL  11          1HG2      VAL  11   3.365   0.931   4.991
   96   HG23  VAL  11          2HG2      VAL  11   4.926   1.125   5.788
   97    H    VAL  12           H        VAL  12   2.815   4.633   6.010
   98    HA   VAL  12           HA       VAL  12   3.001   6.932   4.340
   99    HB   VAL  12           HB       VAL  12   1.141   7.270   6.539
  100   HG11  VAL  12          1HG1      VAL  12   0.580   6.752   3.626
  101   HG12  VAL  12          2HG1      VAL  12   1.096   8.318   4.254
  102   HG13  VAL  12          3HG1      VAL  12  -0.429   7.613   4.789
  103   HG21  VAL  12          3HG2      VAL  12   1.232   4.617   5.156
  104   HG22  VAL  12          1HG2      VAL  12  -0.307   5.300   5.680
  105   HG23  VAL  12          2HG2      VAL  12   0.962   4.980   6.862
  106    H    LYS  13           H        LYS  13   3.252   6.438   7.843
  107    HA   LYS  13           HA       LYS  13   3.700   9.065   8.615
  108    HB2  LYS  13           2HB      LYS  13   4.415   8.212  10.670
  109    HB3  LYS  13           1HB      LYS  13   3.362   6.948  10.050
  110    HG2  LYS  13           2HG      LYS  13   5.178   5.570   9.473
  111    HG3  LYS  13           1HG      LYS  13   6.340   6.890   9.672
  112    HD2  LYS  13           2HD      LYS  13   6.024   5.047  11.534
  113    HD3  LYS  13           1HD      LYS  13   6.330   6.734  11.957
  114    HE2  LYS  13           2HE      LYS  13   4.052   7.124  12.448
  115    HE3  LYS  13           1HE      LYS  13   3.553   5.613  11.689
  116    HZ1  LYS  13           3HZ      LYS  13   4.240   4.382  13.474
  117    HZ2  LYS  13           1HZ      LYS  13   3.751   5.797  14.264
  118    HZ3  LYS  13           2HZ      LYS  13   5.393   5.514  13.974
  119    H    ASN  14           H        ASN  14   6.081   6.574   7.721
  120    HA   ASN  14           HA       ASN  14   8.240   8.461   7.865
  121    HB2  ASN  14           2HB      ASN  14   8.279   5.621   6.840
  122    HB3  ASN  14           1HB      ASN  14   9.677   6.595   7.286
  123   HD21  ASN  14          1HD2      ASN  14   7.500   4.305   8.319
  124   HD22  ASN  14          2HD2      ASN  14   7.790   4.402  10.018
  125    H    PHE  15           H        PHE  15   5.901   7.878   5.621
  126    HA   PHE  15           HA       PHE  15   7.259   7.787   3.180
  127    HB2  PHE  15           2HB      PHE  15   4.554   8.531   4.082
  128    HB3  PHE  15           1HB      PHE  15   5.049   9.253   2.560
  129    HD1  PHE  15           1HD      PHE  15   6.819   6.337   2.659
  130    HD2  PHE  15           2HD      PHE  15   2.815   7.704   2.245
  131    HE1  PHE  15           1HE      PHE  15   6.235   4.252   1.490
  132    HE2  PHE  15           2HE      PHE  15   2.219   5.622   1.080
  133    HZ   PHE  15           HZ       PHE  15   3.930   3.892   0.700
  134    H    GLU  16           H        GLU  16   6.257  10.483   5.174
  135    HA   GLU  16           HA       GLU  16   7.878  12.334   5.329
  136    HB2  GLU  16           2HB      GLU  16   8.697  13.370   3.330
  137    HB3  GLU  16           1HB      GLU  16   9.006  11.648   3.213
  138    HG2  GLU  16           2HG      GLU  16   7.373  13.375   1.548
  139    HG3  GLU  16           1HG      GLU  16   8.159  11.849   1.169
  140    H    LYS  17           H        LYS  17   4.856  11.630   4.698
  141    HA   LYS  17           HA       LYS  17   3.928  14.253   3.929
  142    HB2  LYS  17           2HB      LYS  17   2.896  11.611   3.731
  143    HB3  LYS  17           1HB      LYS  17   1.772  12.569   4.683
  144    HG2  LYS  17           2HG      LYS  17   1.045  12.780   2.470
  145    HG3  LYS  17           1HG      LYS  17   1.885  14.290   2.826
  146    HD2  LYS  17           2HD      LYS  17   3.428  12.043   1.623
  147    HD3  LYS  17           1HD      LYS  17   2.338  12.970   0.590
  148    HE2  LYS  17           2HE      LYS  17   4.533  14.135   2.299
  149    HE3  LYS  17           1HE      LYS  17   4.641  13.844   0.563
  150    HZ1  LYS  17           3HZ      LYS  17   3.220  15.930   2.012
  151    HZ2  LYS  17           1HZ      LYS  17   2.433  15.300   0.653
  152    HZ3  LYS  17           2HZ      LYS  17   3.973  15.983   0.498
  153    H    VAL  18           H        VAL  18   3.580  12.018   6.668
  154    HA   VAL  18           HA       VAL  18   3.819  13.928   8.663
  155    HB   VAL  18           HB       VAL  18   1.215  13.708   9.308
  156   HG11  VAL  18          1HG1      VAL  18   2.968  15.727   8.477
  157   HG12  VAL  18          2HG1      VAL  18   1.430  15.918   9.316
  158   HG13  VAL  18          3HG1      VAL  18   1.486  15.966   7.554
  159   HG21  VAL  18          3HG2      VAL  18  -0.151  13.263   7.612
  160   HG22  VAL  18          1HG2      VAL  18   1.264  12.856   6.641
  161   HG23  VAL  18          2HG2      VAL  18   0.615  14.495   6.610
  162    H    ASP  19           H        ASP  19   2.777  13.121  10.801
  163    HA   ASP  19           HA       ASP  19   3.644  10.469  11.217
  164    HB2  ASP  19           2HB      ASP  19   2.522  12.641  12.843
  165    HB3  ASP  19           1HB      ASP  19   2.099  11.030  13.417
  166    H    ALA  20           H        ALA  20   2.621   8.630  10.800
  167    HA   ALA  20           HA       ALA  20   0.037   8.469   9.755
  168    HB1  ALA  20           1HB      ALA  20   1.625   6.280  11.088
  169    HB2  ALA  20           2HB      ALA  20   1.752   6.756   9.395
  170    HB3  ALA  20           3HB      ALA  20   0.252   6.057  10.004
  171    H    SER  21           H        SER  21   1.123   8.623  13.009
  172    HA   SER  21           HA       SER  21  -1.085   7.380  14.264
  173    HB2  SER  21           2HB      SER  21   1.016   9.314  15.225
  174    HB3  SER  21           1HB      SER  21  -0.278   8.749  16.282
  175    HG   SER  21           HG       SER  21   0.958   6.722  14.932
  176    H    LYS  22           H        LYS  22  -0.695  10.394  12.728
  177    HA   LYS  22           HA       LYS  22  -2.674  11.836  14.201
  178    HB2  LYS  22           2HB      LYS  22  -2.329  13.594  12.675
  179    HB3  LYS  22           1HB      LYS  22  -0.757  12.822  12.833
  180    HG2  LYS  22           2HG      LYS  22  -1.348  11.515  10.743
  181    HG3  LYS  22           1HG      LYS  22  -2.698  12.637  10.552
  182    HD2  LYS  22           2HD      LYS  22   0.224  13.375  10.700
  183    HD3  LYS  22           1HD      LYS  22  -0.773  13.361   9.243
  184    HE2  LYS  22           2HE      LYS  22  -1.697  14.974  11.563
  185    HE3  LYS  22           1HE      LYS  22  -0.336  15.580  10.621
  186    HZ1  LYS  22           3HZ      LYS  22  -2.070  16.492   9.488
  187    HZ2  LYS  22           1HZ      LYS  22  -3.132  15.217   9.826
  188    HZ3  LYS  22           2HZ      LYS  22  -1.937  15.032   8.643
  189    H    VAL  23           H        VAL  23  -2.778   9.460  11.777
  190    HA   VAL  23           HA       VAL  23  -5.255  10.284  10.585
  191    HB   VAL  23           HB       VAL  23  -5.060   8.493   9.155
  192   HG11  VAL  23          1HG1      VAL  23  -2.511   9.616  10.006
  193   HG12  VAL  23          2HG1      VAL  23  -3.153   9.363   8.382
  194   HG13  VAL  23          3HG1      VAL  23  -2.348   8.041   9.229
  195   HG21  VAL  23          3HG2      VAL  23  -5.143   6.815  11.014
  196   HG22  VAL  23          1HG2      VAL  23  -3.391   6.971  11.149
  197   HG23  VAL  23          2HG2      VAL  23  -4.110   6.362   9.658
  198    H    THR  24           H        THR  24  -7.232   9.901  11.345
  199    HA   THR  24           HA       THR  24  -7.561   7.853  13.389
  200    HB   THR  24           HB       THR  24  -8.198  10.589  13.474
  201    HG1  THR  24           1HG      THR  24  -9.436   9.239  15.407
  202   HG21  THR  24          3HG2      THR  24 -10.307  10.015  12.298
  203   HG22  THR  24          1HG2      THR  24 -10.537  10.679  13.915
  204   HG23  THR  24          2HG2      THR  24 -10.707   8.946  13.641
  205    HA   PRO  25           HA       PRO  25 -10.608   5.586  11.196
  206    HB2  PRO  25           2HB      PRO  25 -12.901   5.856  12.745
  207    HB3  PRO  25           1HB      PRO  25 -11.620   4.670  13.009
  208    HG2  PRO  25           2HG      PRO  25 -12.073   7.301  14.345
  209    HG3  PRO  25           1HG      PRO  25 -11.507   5.771  15.039
  210    HD2  PRO  25           2HD      PRO  25  -9.809   7.775  14.523
  211    HD3  PRO  25           1HD      PRO  25  -9.337   6.081  14.266
  212    H    GLU  26           H        GLU  26 -11.756   8.743  12.310
  213    HA   GLU  26           HA       GLU  26 -13.533   8.900  10.003
  214    HB2  GLU  26           2HB      GLU  26 -14.034   9.530  12.589
  215    HB3  GLU  26           1HB      GLU  26 -13.537  11.099  11.968
  216    HG2  GLU  26           2HG      GLU  26 -15.962   9.526  11.428
  217    HG3  GLU  26           1HG      GLU  26 -15.725  11.273  11.493
  218    H    SER  27           H        SER  27 -10.440   9.613  10.673
  219    HA   SER  27           HA       SER  27 -10.313  12.259   9.575
  220    HB2  SER  27           2HB      SER  27  -7.875  10.567   9.853
  221    HB3  SER  27           1HB      SER  27  -8.097  12.280  10.204
  222    HG   SER  27           HG       SER  27  -8.691  11.801  12.171
  223    H    HIS  28           H        HIS  28  -9.933  12.816   7.511
  224    HA   HIS  28           HA       HIS  28  -9.964  10.771   5.508
  225    HB2  HIS  28           2HB      HIS  28 -10.496  13.610   5.637
  226    HB3  HIS  28           1HB      HIS  28  -9.472  13.228   4.256
  227    HD1  HIS  28           1HD      HIS  28 -12.725  11.953   5.773
  228    HD2  HIS  28           2HD      HIS  28 -10.888  12.472   2.082
  229    HE1  HIS  28           1HE      HIS  28 -14.444  11.280   4.066
  230    HE2  HIS  28           2HE      HIS  28 -13.340  11.686   1.839
  231    H    PHE  29           H        PHE  29  -8.348  10.279   4.031
  232    HA   PHE  29           HA       PHE  29  -5.691  10.497   4.961
  233    HB2  PHE  29           2HB      PHE  29  -6.647   8.624   3.556
  234    HB3  PHE  29           1HB      PHE  29  -6.536   9.711   2.177
  235    HD1  PHE  29           2HD      PHE  29  -3.987  11.031   2.550
  236    HD2  PHE  29           1HD      PHE  29  -5.070   6.976   3.260
  237    HE1  PHE  29           2HE      PHE  29  -1.648  10.350   2.204
  238    HE2  PHE  29           1HE      PHE  29  -2.733   6.288   2.915
  239    HZ   PHE  29           HZ       PHE  29  -1.019   7.976   2.387
  240    H    VAL  30           H        VAL  30  -6.449  11.280   1.644
  241    HA   VAL  30           HA       VAL  30  -4.484  13.123   1.225
  242    HB   VAL  30           HB       VAL  30  -6.562  14.120  -0.322
  243   HG11  VAL  30          1HG1      VAL  30  -4.893  13.724  -1.735
  244   HG12  VAL  30          2HG1      VAL  30  -5.407  12.038  -1.780
  245   HG13  VAL  30          3HG1      VAL  30  -4.166  12.551  -0.636
  246   HG21  VAL  30          3HG2      VAL  30  -7.988  12.304   0.604
  247   HG22  VAL  30          1HG2      VAL  30  -6.877  11.129  -0.099
  248   HG23  VAL  30          2HG2      VAL  30  -7.782  12.222  -1.146
  249    H    LYS  31           H        LYS  31  -7.547  13.615   2.762
  250    HA   LYS  31           HA       LYS  31  -7.364  16.470   2.766
  251    HB2  LYS  31           2HB      LYS  31  -9.200  15.023   4.609
  252    HB3  LYS  31           1HB      LYS  31  -9.477  16.487   3.675
  253    HG2  LYS  31           2HG      LYS  31  -9.321  13.706   2.530
  254    HG3  LYS  31           1HG      LYS  31 -10.809  14.588   2.879
  255    HD2  LYS  31           2HD      LYS  31  -8.709  15.192   0.817
  256    HD3  LYS  31           1HD      LYS  31 -10.434  14.906   0.579
  257    HE2  LYS  31           2HE      LYS  31 -10.491  17.162   0.441
  258    HE3  LYS  31           1HE      LYS  31 -10.556  17.039   2.198
  259    HZ1  LYS  31           3HZ      LYS  31  -7.886  17.044   1.103
  260    HZ2  LYS  31           1HZ      LYS  31  -8.523  17.911   2.410
  261    HZ3  LYS  31           2HZ      LYS  31  -8.744  18.476   0.831
  262    H    ASP  32           H        ASP  32  -6.219  13.935   4.774
  263    HA   ASP  32           HA       ASP  32  -5.695  15.825   6.926
  264    HB2  ASP  32           2HB      ASP  32  -7.049  13.745   7.433
  265    HB3  ASP  32           1HB      ASP  32  -5.571  12.828   7.161
  266    H    LEU  33           H        LEU  33  -4.138  14.917   4.332
  267    HA   LEU  33           HA       LEU  33  -1.580  15.469   5.344
  268    HB2  LEU  33           2HB      LEU  33  -0.580  13.179   4.789
  269    HB3  LEU  33           1HB      LEU  33  -1.418  13.364   6.318
  270    HG   LEU  33           HG       LEU  33  -2.941  12.333   3.966
  271   HD11  LEU  33          1HD1      LEU  33  -1.016  10.722   5.632
  272   HD12  LEU  33          2HD1      LEU  33  -0.951  10.989   3.890
  273   HD13  LEU  33          3HD1      LEU  33  -2.259  10.034   4.588
  274   HD21  LEU  33          3HD2      LEU  33  -4.327  12.617   5.791
  275   HD22  LEU  33          1HD2      LEU  33  -3.076  12.160   6.946
  276   HD23  LEU  33          2HD2      LEU  33  -3.853  10.926   5.953
  277    H    GLY  34           H        GLY  34  -3.560  14.113   2.829
  278    HA2  GLY  34           2HA      GLY  34  -3.378  14.143   0.534
  279    HA3  GLY  34           1HA      GLY  34  -2.606  15.699   0.785
  280    H    LEU  35           H        LEU  35  -2.151  12.369   0.045
  281    HA   LEU  35           HA       LEU  35   0.736  12.571   0.092
  282    HB2  LEU  35           2HB      LEU  35   0.434  10.167  -0.905
  283    HB3  LEU  35           1HB      LEU  35   0.184  10.469   0.803
  284    HG   LEU  35           HG       LEU  35  -2.232  10.534   0.465
  285   HD11  LEU  35          1HD1      LEU  35  -1.437  10.339  -2.401
  286   HD12  LEU  35          2HD1      LEU  35  -2.664  11.349  -1.638
  287   HD13  LEU  35          3HD1      LEU  35  -2.962   9.628  -1.875
  288   HD21  LEU  35          3HD2      LEU  35  -2.511   8.266   0.401
  289   HD22  LEU  35          1HD2      LEU  35  -0.770   8.352   0.664
  290   HD23  LEU  35          2HD2      LEU  35  -1.404   8.055  -0.954
  291    H    ASN  36           H        ASN  36   1.937  13.105  -1.614
  292    HA   ASN  36           HA       ASN  36   0.814  13.922  -4.051
  293    HB2  ASN  36           2HB      ASN  36   3.419  13.529  -4.718
  294    HB3  ASN  36           1HB      ASN  36   2.819  14.951  -3.877
  295   HD21  ASN  36          1HD2      ASN  36   2.995  11.792  -2.446
  296   HD22  ASN  36          2HD2      ASN  36   4.250  12.150  -1.314
  297    H    SER  37           H        SER  37   1.735  13.039  -6.212
  298    HA   SER  37           HA       SER  37   0.621  10.523  -6.662
  299    HB2  SER  37           2HB      SER  37   2.619  12.065  -8.325
  300    HB3  SER  37           1HB      SER  37   1.739  10.644  -8.889
  301    H    LEU  38           H        LEU  38   4.040  11.425  -6.624
  302    HA   LEU  38           HA       LEU  38   5.194   8.971  -7.011
  303    HB2  LEU  38           2HB      LEU  38   7.171   9.832  -6.117
  304    HB3  LEU  38           1HB      LEU  38   6.318  11.243  -6.716
  305    HG   LEU  38           HG       LEU  38   7.298  11.756  -4.576
  306   HD11  LEU  38          1HD1      LEU  38   5.523  12.919  -3.875
  307   HD12  LEU  38          2HD1      LEU  38   4.540  11.476  -3.650
  308   HD13  LEU  38          3HD1      LEU  38   4.697  12.196  -5.251
  309   HD21  LEU  38          3HD2      LEU  38   6.734   9.102  -3.966
  310   HD22  LEU  38          1HD2      LEU  38   5.686  10.042  -2.902
  311   HD23  LEU  38          2HD2      LEU  38   7.429  10.313  -2.888
  312    H    ASP  39           H        ASP  39   3.475  10.100  -4.258
  313    HA   ASP  39           HA       ASP  39   4.502   8.223  -2.378
  314    HB2  ASP  39           2HB      ASP  39   2.333  10.227  -2.445
  315    HB3  ASP  39           1HB      ASP  39   2.072   8.865  -1.360
  316    H    VAL  40           H        VAL  40   1.086   8.389  -3.058
  317    HA   VAL  40           HA       VAL  40   0.206   5.971  -2.560
  318    HB   VAL  40           HB       VAL  40  -0.697   7.983  -4.281
  319   HG11  VAL  40          1HG1      VAL  40   0.218   6.380  -6.077
  320   HG12  VAL  40          2HG1      VAL  40  -1.424   6.997  -6.262
  321   HG13  VAL  40          3HG1      VAL  40  -1.159   5.362  -5.658
  322   HG21  VAL  40          3HG2      VAL  40  -2.775   7.232  -3.664
  323   HG22  VAL  40          1HG2      VAL  40  -1.782   6.474  -2.420
  324   HG23  VAL  40          2HG2      VAL  40  -2.325   5.534  -3.810
  325    H    VAL  41           H        VAL  41   2.252   6.679  -5.340
  326    HA   VAL  41           HA       VAL  41   2.023   4.156  -6.583
  327    HB   VAL  41           HB       VAL  41   2.945   5.622  -8.061
  328   HG11  VAL  41          1HG1      VAL  41   3.512   7.620  -7.270
  329   HG12  VAL  41          2HG1      VAL  41   5.106   6.955  -6.911
  330   HG13  VAL  41          3HG1      VAL  41   3.852   6.954  -5.672
  331   HG21  VAL  41          3HG2      VAL  41   5.433   5.213  -8.237
  332   HG22  VAL  41          1HG2      VAL  41   4.414   3.775  -8.182
  333   HG23  VAL  41          2HG2      VAL  41   5.295   4.288  -6.742
  334    H    GLU  42           H        GLU  42   4.545   5.475  -4.435
  335    HA   GLU  42           HA       GLU  42   6.029   3.077  -4.314
  336    HB2  GLU  42           2HB      GLU  42   5.976   5.573  -2.650
  337    HB3  GLU  42           1HB      GLU  42   6.969   4.200  -2.178
  338    HG2  GLU  42           2HG      GLU  42   7.732   4.425  -4.728
  339    HG3  GLU  42           1HG      GLU  42   7.293   6.103  -4.409
  340    H    VAL  43           H        VAL  43   3.466   4.416  -2.364
  341    HA   VAL  43           HA       VAL  43   3.598   2.523  -0.270
  342    HB   VAL  43           HB       VAL  43   2.150   3.931   0.651
  343   HG11  VAL  43          1HG1      VAL  43   1.294   5.881  -0.612
  344   HG12  VAL  43          2HG1      VAL  43   1.912   5.150  -2.091
  345   HG13  VAL  43          3HG1      VAL  43   3.027   5.630  -0.812
  346   HG21  VAL  43          3HG2      VAL  43   0.296   2.640   0.286
  347   HG22  VAL  43          1HG2      VAL  43   0.397   2.817  -1.460
  348   HG23  VAL  43          2HG2      VAL  43  -0.191   4.153  -0.480
  349    H    VAL  44           H        VAL  44   1.803   2.704  -3.269
  350    HA   VAL  44           HA       VAL  44   0.147   0.464  -2.857
  351    HB   VAL  44           HB       VAL  44  -0.112   0.433  -5.327
  352   HG11  VAL  44          1HG1      VAL  44  -0.515   3.207  -5.148
  353   HG12  VAL  44          2HG1      VAL  44  -0.752   2.565  -3.523
  354   HG13  VAL  44          3HG1      VAL  44  -1.692   1.924  -4.870
  355   HG21  VAL  44          3HG2      VAL  44   1.710   2.821  -5.402
  356   HG22  VAL  44          1HG2      VAL  44   1.059   1.889  -6.751
  357   HG23  VAL  44          2HG2      VAL  44   2.294   1.185  -5.708
  358    H    PHE  45           H        PHE  45   3.330   0.848  -4.353
  359    HA   PHE  45           HA       PHE  45   3.588  -1.884  -5.098
  360    HB2  PHE  45           2HB      PHE  45   5.447   0.460  -4.944
  361    HB3  PHE  45           1HB      PHE  45   6.113  -1.156  -5.152
  362    HD1  PHE  45           2HD      PHE  45   5.303  -2.534  -7.123
  363    HD2  PHE  45           1HD      PHE  45   4.603   1.650  -6.768
  364    HE1  PHE  45           2HE      PHE  45   4.882  -2.402  -9.543
  365    HE2  PHE  45           1HE      PHE  45   4.179   1.789  -9.186
  366    HZ   PHE  45           HZ       PHE  45   4.319  -0.239 -10.578
  367    H    ALA  46           H        ALA  46   4.180  -0.052  -2.239
  368    HA   ALA  46           HA       ALA  46   5.896  -1.913  -0.952
  369    HB1  ALA  46           1HB      ALA  46   4.420   0.527  -0.116
  370    HB2  ALA  46           2HB      ALA  46   6.149   0.183  -0.058
  371    HB3  ALA  46           3HB      ALA  46   5.063  -0.552   1.121
  372    H    ILE  47           H        ILE  47   2.724  -0.872   0.162
  373    HA   ILE  47           HA       ILE  47   2.135  -3.010   1.774
  374    HB   ILE  47           HB       ILE  47  -0.290  -2.499   1.333
  375   HG12  ILE  47          2HG1      ILE  47   0.979  -0.951  -0.841
  376   HG13  ILE  47          1HG1      ILE  47  -0.626  -1.661  -0.755
  377   HG21  ILE  47          1HG2      ILE  47   0.756  -1.387   3.135
  378   HG22  ILE  47          2HG2      ILE  47  -0.106  -0.142   2.231
  379   HG23  ILE  47          3HG2      ILE  47   1.641  -0.309   2.055
  380   HD11  ILE  47          3HD1      ILE  47  -1.465   0.347  -0.420
  381   HD12  ILE  47          1HD1      ILE  47   0.154   1.039  -0.397
  382   HD13  ILE  47          2HD1      ILE  47  -0.572   0.454   1.097
  383    H    GLU  48           H        GLU  48   1.573  -2.698  -1.712
  384    HA   GLU  48           HA       GLU  48   0.109  -5.024  -2.125
  385    HB2  GLU  48           2HB      GLU  48   1.966  -3.414  -3.829
  386    HB3  GLU  48           1HB      GLU  48   1.405  -4.972  -4.421
  387    HG2  GLU  48           2HG      GLU  48   0.098  -2.492  -4.558
  388    HG3  GLU  48           1HG      GLU  48  -0.498  -4.068  -5.077
  389    H    GLN  49           H        GLN  49   3.534  -4.518  -1.728
  390    HA   GLN  49           HA       GLN  49   4.441  -7.067  -2.483
  391    HB2  GLN  49           2HB      GLN  49   5.561  -4.707  -1.363
  392    HB3  GLN  49           1HB      GLN  49   6.035  -6.050  -0.332
  393    HG2  GLN  49           2HG      GLN  49   7.496  -5.345  -2.380
  394    HG3  GLN  49           1HG      GLN  49   7.287  -7.045  -1.959
  395   HE21  GLN  49          1HE2      GLN  49   5.612  -4.549  -3.853
  396   HE22  GLN  49          2HE2      GLN  49   5.293  -5.560  -5.218
  397    H    GLU  50           H        GLU  50   3.349  -5.769   0.623
  398    HA   GLU  50           HA       GLU  50   3.422  -8.468   1.718
  399    HB2  GLU  50           2HB      GLU  50   4.034  -7.623   3.712
  400    HB3  GLU  50           1HB      GLU  50   4.461  -6.190   2.787
  401    HG2  GLU  50           2HG      GLU  50   3.146  -5.132   4.250
  402    HG3  GLU  50           1HG      GLU  50   1.833  -5.735   3.239
  403    H    PHE  51           H        PHE  51   1.347  -7.607  -0.044
  404    HA   PHE  51           HA       PHE  51  -0.927  -7.924   1.734
  405    HB2  PHE  51           2HB      PHE  51  -0.408  -5.678  -0.068
  406    HB3  PHE  51           1HB      PHE  51  -1.998  -6.400  -0.281
  407    HD1  PHE  51           2HD      PHE  51  -3.530  -6.568   1.695
  408    HD2  PHE  51           1HD      PHE  51   0.060  -4.285   1.764
  409    HE1  PHE  51           2HE      PHE  51  -4.365  -5.322   3.645
  410    HE2  PHE  51           1HE      PHE  51  -0.767  -3.036   3.715
  411    HZ   PHE  51           HZ       PHE  51  -2.982  -3.553   4.657
  412    H    ILE  52           H        ILE  52   0.707  -8.857  -1.084
  413    HA   ILE  52           HA       ILE  52   0.234 -10.260  -2.808
  414    HB   ILE  52           HB       ILE  52  -1.319 -12.172  -2.233
  415   HG12  ILE  52          2HG1      ILE  52  -1.744 -12.373   0.270
  416   HG13  ILE  52          1HG1      ILE  52  -1.442 -10.647   0.337
  417   HG21  ILE  52          1HG2      ILE  52   0.322 -13.280  -1.015
  418   HG22  ILE  52          2HG2      ILE  52   0.788 -11.820  -0.142
  419   HG23  ILE  52          3HG2      ILE  52   1.211 -12.002  -1.844
  420   HD11  ILE  52          3HD1      ILE  52  -3.624 -12.041  -1.175
  421   HD12  ILE  52          1HD1      ILE  52  -3.278 -10.317  -1.297
  422   HD13  ILE  52          2HD1      ILE  52  -3.796 -11.005   0.241
  423    H    LEU  53           H        LEU  53  -1.102  -7.870  -3.038
  424    HA   LEU  53           HA       LEU  53  -3.122  -8.509  -4.893
  425    HB2  LEU  53           2HB      LEU  53  -4.491  -8.948  -2.952
  426    HB3  LEU  53           1HB      LEU  53  -4.043  -7.411  -2.238
  427    HG   LEU  53           HG       LEU  53  -6.364  -7.644  -3.348
  428   HD11  LEU  53          1HD1      LEU  53  -4.474  -5.369  -3.905
  429   HD12  LEU  53          2HD1      LEU  53  -5.601  -5.534  -2.558
  430   HD13  LEU  53          3HD1      LEU  53  -6.212  -5.292  -4.195
  431   HD21  LEU  53          3HD2      LEU  53  -4.722  -8.262  -5.550
  432   HD22  LEU  53          1HD2      LEU  53  -5.437  -6.683  -5.873
  433   HD23  LEU  53          2HD2      LEU  53  -6.474  -8.066  -5.522
  434    H    ASP  54           H        ASP  54  -3.709  -6.728  -6.147
  435    HA   ASP  54           HA       ASP  54  -1.933  -4.494  -5.951
  436    HB2  ASP  54           2HB      ASP  54  -3.437  -5.751  -8.005
  437    HB3  ASP  54           1HB      ASP  54  -3.938  -4.063  -7.937
  438    H    ILE  55           H        ILE  55  -2.436  -2.370  -5.534
  439    HA   ILE  55           HA       ILE  55  -5.071  -1.900  -4.350
  440    HB   ILE  55           HB       ILE  55  -2.371  -0.788  -3.682
  441   HG12  ILE  55          2HG1      ILE  55  -2.614  -2.278  -2.024
  442   HG13  ILE  55          1HG1      ILE  55  -3.896  -1.253  -1.388
  443   HG21  ILE  55          1HG2      ILE  55  -4.148   1.034  -4.033
  444   HG22  ILE  55          2HG2      ILE  55  -3.247   1.031  -2.517
  445   HG23  ILE  55          3HG2      ILE  55  -4.890   0.392  -2.567
  446   HD11  ILE  55          3HD1      ILE  55  -5.569  -2.568  -2.292
  447   HD12  ILE  55          1HD1      ILE  55  -4.364  -3.750  -1.782
  448   HD13  ILE  55          2HD1      ILE  55  -4.490  -3.297  -3.481
  449    HA   PRO  56           HA       PRO  56  -3.596   2.128  -6.923
  450    HB2  PRO  56           2HB      PRO  56  -2.404   0.413  -9.063
  451    HB3  PRO  56           1HB      PRO  56  -1.959   2.047  -8.554
  452    HG2  PRO  56           2HG      PRO  56  -0.490  -0.036  -7.805
  453    HG3  PRO  56           1HG      PRO  56  -0.817   1.292  -6.676
  454    HD2  PRO  56           2HD      PRO  56  -1.982  -1.447  -6.771
  455    HD3  PRO  56           1HD      PRO  56  -1.633  -0.416  -5.368
  456    H    ASP  57           H        ASP  57  -3.942   2.147  -9.699
  457    HA   ASP  57           HA       ASP  57  -5.499   1.943 -11.353
  458    HB2  ASP  57           2HB      ASP  57  -6.305  -0.448  -9.697
  459    HB3  ASP  57           1HB      ASP  57  -7.151   0.006 -11.173
  460    H    HIS  58           H        HIS  58  -7.833   2.306 -11.751
  461    HA   HIS  58           HA       HIS  58  -8.945   4.383 -10.553
  462    HB2  HIS  58           2HB      HIS  58 -11.177   2.697 -10.853
  463    HB3  HIS  58           1HB      HIS  58 -10.544   3.850 -12.023
  464    HD1  HIS  58           1HD      HIS  58 -10.891   0.237 -11.360
  465    HD2  HIS  58           2HD      HIS  58  -8.842   2.693 -14.012
  466    HE1  HIS  58           1HE      HIS  58 -10.104  -1.277 -13.207
  467    HE2  HIS  58           2HE      HIS  58  -8.792   0.216 -14.755
  468    H    ASP  59           H        ASP  59  -8.768   1.211  -9.136
  469    HA   ASP  59           HA       ASP  59 -10.655   1.580  -7.071
  470    HB2  ASP  59           2HB      ASP  59  -8.456  -0.336  -7.641
  471    HB3  ASP  59           1HB      ASP  59  -9.010  -0.227  -5.973
  472    H    ALA  60           H        ALA  60  -7.142   2.061  -7.202
  473    HA   ALA  60           HA       ALA  60  -6.877   2.848  -4.496
  474    HB1  ALA  60           1HB      ALA  60  -5.036   3.555  -6.770
  475    HB2  ALA  60           2HB      ALA  60  -5.022   2.004  -5.934
  476    HB3  ALA  60           3HB      ALA  60  -4.640   3.482  -5.053
  477    H    GLU  61           H        GLU  61  -7.675   4.530  -7.420
  478    HA   GLU  61           HA       GLU  61  -7.256   7.156  -6.361
  479    HB2  GLU  61           2HB      GLU  61  -8.755   6.240  -8.820
  480    HB3  GLU  61           1HB      GLU  61  -8.382   7.914  -8.432
  481    HG2  GLU  61           2HG      GLU  61  -6.505   5.710  -9.199
  482    HG3  GLU  61           1HG      GLU  61  -6.765   7.266  -9.989
  483    H    LYS  62           H        LYS  62  -9.899   4.898  -6.522
  484    HA   LYS  62           HA       LYS  62 -11.964   6.771  -5.944
  485    HB2  LYS  62           2HB      LYS  62 -12.014   3.794  -5.450
  486    HB3  LYS  62           1HB      LYS  62 -13.394   4.862  -5.669
  487    HG2  LYS  62           2HG      LYS  62 -11.732   5.118  -7.949
  488    HG3  LYS  62           1HG      LYS  62 -11.956   3.398  -7.623
  489    HD2  LYS  62           2HD      LYS  62 -14.410   4.954  -7.354
  490    HD3  LYS  62           1HD      LYS  62 -13.715   5.022  -8.975
  491    HE2  LYS  62           2HE      LYS  62 -13.843   2.698  -9.248
  492    HE3  LYS  62           1HE      LYS  62 -14.064   2.421  -7.521
  493    HZ1  LYS  62           3HZ      LYS  62 -16.027   2.751  -9.487
  494    HZ2  LYS  62           1HZ      LYS  62 -16.146   4.058  -8.421
  495    HZ3  LYS  62           2HZ      LYS  62 -16.240   2.475  -7.831
  496    H    ILE  63           H        ILE  63  -9.436   5.926  -4.107
  497    HA   ILE  63           HA       ILE  63 -10.943   5.884  -1.602
  498    HB   ILE  63           HB       ILE  63  -8.867   4.269  -2.387
  499   HG12  ILE  63          2HG1      ILE  63  -8.935   4.539   0.497
  500   HG13  ILE  63          1HG1      ILE  63 -10.560   4.608  -0.179
  501   HG21  ILE  63          1HG2      ILE  63  -7.723   6.238  -0.416
  502   HG22  ILE  63          2HG2      ILE  63  -7.345   6.234  -2.139
  503   HG23  ILE  63          3HG2      ILE  63  -6.915   4.846  -1.138
  504   HD11  ILE  63          3HD1      ILE  63  -9.726   2.333   0.492
  505   HD12  ILE  63          1HD1      ILE  63  -8.606   2.437  -0.866
  506   HD13  ILE  63          2HD1      ILE  63 -10.345   2.474  -1.153
  507    H    GLN  64           H        GLN  64 -11.040   7.701  -0.460
  508    HA   GLN  64           HA       GLN  64  -8.949   9.696  -0.835
  509    HB2  GLN  64           2HB      GLN  64 -11.855  10.170  -0.185
  510    HB3  GLN  64           1HB      GLN  64 -10.632  11.421  -0.350
  511    HG2  GLN  64           2HG      GLN  64 -11.362  11.568  -2.450
  512    HG3  GLN  64           1HG      GLN  64 -10.388  10.123  -2.722
  513   HE21  GLN  64          1HE2      GLN  64 -11.507   8.040  -2.396
  514   HE22  GLN  64          2HE2      GLN  64 -13.163   7.923  -2.874
  515    H    SER  65           H        SER  65 -11.061   8.080   1.439
  516    HA   SER  65           HA       SER  65  -9.858   9.477   3.696
  517    HB2  SER  65           2HB      SER  65 -11.557   8.498   5.044
  518    HB3  SER  65           1HB      SER  65 -12.347   8.957   3.535
  519    HG   SER  65           HG       SER  65 -11.357   6.465   3.342
  520    H    ILE  66           H        ILE  66  -8.535   8.554   5.201
  521    HA   ILE  66           HA       ILE  66  -6.798   6.530   4.447
  522    HB   ILE  66           HB       ILE  66  -6.528   6.372   7.108
  523   HG12  ILE  66          2HG1      ILE  66  -7.243   9.218   7.056
  524   HG13  ILE  66          1HG1      ILE  66  -8.627   8.139   6.933
  525   HG21  ILE  66          1HG2      ILE  66  -5.131   7.453   5.095
  526   HG22  ILE  66          2HG2      ILE  66  -4.672   7.624   6.790
  527   HG23  ILE  66          3HG2      ILE  66  -5.552   8.919   5.978
  528   HD11  ILE  66          3HD1      ILE  66  -6.586   7.648   9.041
  529   HD12  ILE  66          1HD1      ILE  66  -8.309   7.273   9.028
  530   HD13  ILE  66          2HD1      ILE  66  -7.772   8.936   9.255
  531    HA   PRO  67           HA       PRO  67  -9.633   3.696   7.384
  532    HB2  PRO  67           2HB      PRO  67 -12.277   4.166   6.617
  533    HB3  PRO  67           1HB      PRO  67 -11.537   4.673   8.136
  534    HG2  PRO  67           2HG      PRO  67 -11.997   6.232   5.636
  535    HG3  PRO  67           1HG      PRO  67 -12.100   6.758   7.326
  536    HD2  PRO  67           2HD      PRO  67 -10.006   7.405   5.794
  537    HD3  PRO  67           1HD      PRO  67  -9.799   7.017   7.515
  538    H    ASP  68           H        ASP  68 -11.971   4.221   4.836
  539    HA   ASP  68           HA       ASP  68 -12.124   1.726   3.840
  540    HB2  ASP  68           2HB      ASP  68 -12.746   4.359   2.843
  541    HB3  ASP  68           1HB      ASP  68 -12.192   3.329   1.526
  542    H    ALA  69           H        ALA  69  -9.437   3.835   3.527
  543    HA   ALA  69           HA       ALA  69  -8.205   2.768   1.240
  544    HB1  ALA  69           1HB      ALA  69  -7.548   4.645   3.301
  545    HB2  ALA  69           2HB      ALA  69  -6.910   4.516   1.662
  546    HB3  ALA  69           3HB      ALA  69  -6.168   3.596   2.972
  547    H    VAL  70           H        VAL  70  -6.505   2.459   4.259
  548    HA   VAL  70           HA       VAL  70  -5.428  -0.060   3.597
  549    HB   VAL  70           HB       VAL  70  -4.273   1.496   5.097
  550   HG11  VAL  70          1HG1      VAL  70  -5.797   2.548   6.443
  551   HG12  VAL  70          2HG1      VAL  70  -5.166   1.345   7.568
  552   HG13  VAL  70          3HG1      VAL  70  -6.707   1.071   6.755
  553   HG21  VAL  70          3HG2      VAL  70  -4.932  -1.244   6.129
  554   HG22  VAL  70          1HG2      VAL  70  -3.772  -0.200   6.951
  555   HG23  VAL  70          2HG2      VAL  70  -3.484  -0.699   5.284
  556    H    GLU  71           H        GLU  71  -8.409   0.828   4.977
  557    HA   GLU  71           HA       GLU  71  -8.896  -1.440   6.590
  558    HB2  GLU  71           2HB      GLU  71 -10.727   0.550   5.260
  559    HB3  GLU  71           1HB      GLU  71 -11.331  -0.764   6.259
  560    HG2  GLU  71           2HG      GLU  71  -9.249   1.060   7.357
  561    HG3  GLU  71           1HG      GLU  71 -10.924   1.605   7.269
  562    H    TYR  72           H        TYR  72  -9.976  -0.619   3.296
  563    HA   TYR  72           HA       TYR  72 -11.226  -3.083   2.785
  564    HB2  TYR  72           2HB      TYR  72 -11.714  -2.211   0.746
  565    HB3  TYR  72           1HB      TYR  72 -11.157  -0.716   1.490
  566    HD1  TYR  72           2HD      TYR  72  -9.787  -3.654  -0.370
  567    HD2  TYR  72           1HD      TYR  72  -9.574   0.530   0.363
  568    HE1  TYR  72           2HE      TYR  72  -8.059  -3.444  -2.109
  569    HE2  TYR  72           1HE      TYR  72  -7.847   0.753  -1.374
  570    HH   TYR  72           HH       TYR  72  -6.067  -0.896  -2.423
  571    H    ILE  73           H        ILE  73  -7.959  -1.941   2.254
  572    HA   ILE  73           HA       ILE  73  -7.056  -4.163   0.774
  573    HB   ILE  73           HB       ILE  73  -5.491  -2.232   2.432
  574   HG12  ILE  73          2HG1      ILE  73  -5.185  -1.992  -0.426
  575   HG13  ILE  73          1HG1      ILE  73  -6.883  -1.871   0.023
  576   HG21  ILE  73          1HG2      ILE  73  -4.081  -3.468   0.232
  577   HG22  ILE  73          2HG2      ILE  73  -4.634  -4.653   1.416
  578   HG23  ILE  73          3HG2      ILE  73  -3.611  -3.309   1.924
  579   HD11  ILE  73          3HD1      ILE  73  -4.646  -0.033   0.548
  580   HD12  ILE  73          1HD1      ILE  73  -5.818  -0.229   1.852
  581   HD13  ILE  73          2HD1      ILE  73  -6.354   0.301   0.257
  582    H    ALA  74           H        ALA  74  -6.936  -3.362   4.187
  583    HA   ALA  74           HA       ALA  74  -5.389  -5.462   5.118
  584    HB1  ALA  74           1HB      ALA  74  -6.694  -3.380   6.282
  585    HB2  ALA  74           2HB      ALA  74  -5.887  -4.680   7.160
  586    HB3  ALA  74           3HB      ALA  74  -7.625  -4.757   6.872
  587    H    GLN  75           H        GLN  75  -8.814  -5.357   4.399
  588    HA   GLN  75           HA       GLN  75  -9.299  -8.012   5.349
  589    HB2  GLN  75           2HB      GLN  75 -11.553  -7.672   4.274
  590    HB3  GLN  75           1HB      GLN  75 -11.128  -6.495   5.508
  591    HG2  GLN  75           2HG      GLN  75 -10.326  -5.027   3.582
  592    HG3  GLN  75           1HG      GLN  75 -11.203  -6.143   2.535
  593   HE21  GLN  75          1HE2      GLN  75 -11.419  -3.490   4.650
  594   HE22  GLN  75          2HE2      GLN  75 -13.135  -3.303   4.621
  595    H    ASN  76           H        ASN  76  -8.235  -6.568   2.438
  596    HA   ASN  76           HA       ASN  76  -9.117  -8.365   0.508
  597    HB2  ASN  76           2HB      ASN  76  -7.003  -6.360   0.735
  598    HB3  ASN  76           1HB      ASN  76  -6.564  -7.695  -0.324
  599   HD21  ASN  76          1HD2      ASN  76  -8.535  -4.934   0.114
  600   HD22  ASN  76          2HD2      ASN  76  -9.282  -4.939  -1.444
  601    HA   PRO  77           HA       PRO  77  -5.303 -11.115   1.323
  602    HB2  PRO  77           2HB      PRO  77  -3.510 -10.460   3.202
  603    HB3  PRO  77           1HB      PRO  77  -3.478  -9.715   1.599
  604    HG2  PRO  77           2HG      PRO  77  -4.550  -8.628   4.171
  605    HG3  PRO  77           1HG      PRO  77  -3.605  -7.807   2.917
  606    HD2  PRO  77           2HD      PRO  77  -6.339  -7.621   3.164
  607    HD3  PRO  77           1HD      PRO  77  -5.455  -7.369   1.645
  608    H    MET  78           H        MET  78  -6.650  -9.625   4.216
  609    HA   MET  78           HA       MET  78  -6.314 -11.912   5.883
  610    HB2  MET  78           2HB      MET  78  -6.760  -9.325   6.415
  611    HB3  MET  78           1HB      MET  78  -8.414  -9.913   6.516
  612    HG2  MET  78           2HG      MET  78  -7.946 -11.301   8.317
  613    HG3  MET  78           1HG      MET  78  -6.211 -11.282   8.004
  614    HE1  MET  78           3HE      MET  78  -8.333  -7.443   8.931
  615    HE2  MET  78           1HE      MET  78  -9.105  -8.713   9.881
  616    HE3  MET  78           2HE      MET  78  -8.997  -8.866   8.127
  617    H    ALA  79           H        ALA  79  -8.334 -11.371   3.314
  618    HA   ALA  79           HA       ALA  79 -10.129 -13.466   4.206
  619    HB1  ALA  79           1HB      ALA  79 -10.903 -10.757   3.942
  620    HB2  ALA  79           2HB      ALA  79 -11.908 -12.151   4.333
  621    HB3  ALA  79           3HB      ALA  79 -11.680 -11.675   2.651
  622    H    LYS  80           H        LYS  80  -7.941 -12.564   2.035
  623    HA   LYS  80           HA       LYS  80  -8.576 -12.695  -0.495
  624    HB2  LYS  80           2HB      LYS  80  -6.866 -14.991  -0.092
  625    HB3  LYS  80           1HB      LYS  80  -6.485 -13.427  -0.799
  626    HG2  LYS  80           2HG      LYS  80  -6.263 -12.551   1.556
  627    HG3  LYS  80           1HG      LYS  80  -6.348 -14.229   2.092
  628    HD2  LYS  80           2HD      LYS  80  -4.155 -12.767   0.811
  629    HD3  LYS  80           1HD      LYS  80  -4.114 -14.190   1.854
  630    HE2  LYS  80           2HE      LYS  80  -4.979 -14.282  -1.028
  631    HE3  LYS  80           1HE      LYS  80  -3.310 -14.531  -0.516
  632    HZ1  LYS  80           3HZ      LYS  80  -5.640 -16.157   0.353
  633    HZ2  LYS  80           1HZ      LYS  80  -4.033 -16.402   0.824
  634    HZ3  LYS  80           2HZ      LYS  80  -4.485 -16.626  -0.790
  635   H282  PNS 101          8H2       PNS 101   1.555  14.000  -7.658
  636   H281  PNS 101          9H2       PNS 101   1.536  15.619  -8.365
  637   H303  PNS 101          0H3       PNS 101   4.129  16.581  -6.491
  638   H302  PNS 101          1H3       PNS 101   3.286  15.310  -5.605
  639   H301  PNS 101          2H3       PNS 101   2.374  16.442  -6.604
  640   H313  PNS 101          3H3       PNS 101   4.694  13.854  -6.383
  641   H312  PNS 101          4H3       PNS 101   4.676  13.267  -8.047
  642   H311  PNS 101          5H3       PNS 101   3.295  12.968  -6.992
  643    H32  PNS 101           6H3      PNS 101   3.594  15.792  -9.508
  644    H33  PNS 101           7H3      PNS 101   5.619  17.055  -8.330
  645    H36  PNS 101           8H3      PNS 101   6.295  14.628  -7.842
  646   H372  PNS 101          9H3       PNS 101   7.256  13.285 -10.263
  647   H371  PNS 101          0H4       PNS 101   7.817  12.998  -8.616
  648   H382  PNS 101          1H4       PNS 101   9.037  15.034  -8.586
  649   H381  PNS 101          2H4       PNS 101   9.436  14.208 -10.093
  650    H41  PNS 101           3H4      PNS 101   7.238  14.637 -11.449
  651   H422  PNS 101          4H4       PNS 101   7.626  17.041 -12.803
  652   H421  PNS 101          5H4       PNS 101   6.222  15.988 -12.963
  653   H431  PNS 101          7H4       PNS 101   4.992  17.166 -11.403
  654   H432  PNS 101          6H4       PNS 101   6.433  17.816 -10.607
  655    H44  PNS 101           8H4      PNS 101   6.398  18.979 -13.317
  Start of MODEL   11
    1    H1   MET   1           1HT      MET   1  -4.450 -10.404  10.035
    2    H2   MET   1           2HT      MET   1  -3.115  -9.327  10.089
    3    H3   MET   1           3HT      MET   1  -3.821  -9.746   8.582
    4    HA   MET   1           HA       MET   1  -5.351  -8.228   8.740
    5    HB2  MET   1           2HB      MET   1  -6.642  -9.593  10.239
    6    HB3  MET   1           1HB      MET   1  -5.607  -9.175  11.598
    7    HG2  MET   1           2HG      MET   1  -6.595  -7.162  11.916
    8    HG3  MET   1           1HG      MET   1  -6.969  -6.949  10.207
    9    HE1  MET   1           2HE      MET   1  -8.271  -7.719  13.637
   10    HE2  MET   1           3HE      MET   1  -7.869  -9.386  13.226
   11    HE3  MET   1           1HE      MET   1  -9.556  -8.908  13.419
   12    H    ASN   2           H        ASN   2  -3.719  -8.099  11.914
   13    HA   ASN   2           HA       ASN   2  -3.530  -5.265  11.868
   14    HB2  ASN   2           2HB      ASN   2  -1.705  -6.020  13.752
   15    HB3  ASN   2           1HB      ASN   2  -3.430  -5.815  14.052
   16   HD21  ASN   2          1HD2      ASN   2  -1.190  -8.262  12.788
   17   HD22  ASN   2          2HD2      ASN   2  -1.921  -9.597  13.604
   18    H    ASP   3           H        ASP   3  -1.436  -7.871  10.928
   19    HA   ASP   3           HA       ASP   3   1.029  -6.655  10.874
   20    HB2  ASP   3           2HB      ASP   3   0.298  -8.376   8.555
   21    HB3  ASP   3           1HB      ASP   3   1.740  -8.408   9.568
   22    H    VAL   4           H        VAL   4  -1.591  -6.334   8.572
   23    HA   VAL   4           HA       VAL   4  -0.092  -4.924   6.613
   24    HB   VAL   4           HB       VAL   4  -2.363  -4.235   5.740
   25   HG11  VAL   4          1HG1      VAL   4  -0.988  -6.403   5.251
   26   HG12  VAL   4          2HG1      VAL   4  -2.643  -6.251   4.665
   27   HG13  VAL   4          3HG1      VAL   4  -2.306  -7.195   6.115
   28   HG21  VAL   4          3HG2      VAL   4  -4.331  -5.096   6.689
   29   HG22  VAL   4          1HG2      VAL   4  -3.415  -4.452   8.051
   30   HG23  VAL   4          2HG2      VAL   4  -3.442  -6.189   7.750
   31    H    LEU   5           H        LEU   5  -2.332  -3.852   9.156
   32    HA   LEU   5           HA       LEU   5  -2.129  -1.110   8.559
   33    HB2  LEU   5           2HB      LEU   5  -2.774  -2.181  11.259
   34    HB3  LEU   5           1HB      LEU   5  -3.350  -0.709  10.515
   35    HG   LEU   5           HG       LEU   5  -5.233  -1.935  10.253
   36   HD11  LEU   5          1HD1      LEU   5  -3.483  -2.309   7.939
   37   HD12  LEU   5          2HD1      LEU   5  -5.147  -1.732   8.028
   38   HD13  LEU   5          3HD1      LEU   5  -4.812  -3.463   8.039
   39   HD21  LEU   5          3HD2      LEU   5  -4.757  -3.849  11.466
   40   HD22  LEU   5          1HD2      LEU   5  -3.420  -4.309  10.411
   41   HD23  LEU   5          2HD2      LEU   5  -5.085  -4.483   9.854
   42    H    THR   6           H        THR   6  -0.314  -3.236  10.636
   43    HA   THR   6           HA       THR   6   1.040  -1.303  12.138
   44    HB   THR   6           HB       THR   6   1.012  -4.088  11.982
   45    HG1  THR   6           1HG      THR   6   2.685  -2.496  13.619
   46   HG21  THR   6          3HG2      THR   6   3.549  -4.439  12.301
   47   HG22  THR   6          1HG2      THR   6   3.700  -2.989  11.306
   48   HG23  THR   6          2HG2      THR   6   2.878  -4.415  10.669
   49    H    ARG   7           H        ARG   7   2.229  -3.134   9.351
   50    HA   ARG   7           HA       ARG   7   4.537  -1.482   9.080
   51    HB2  ARG   7           2HB      ARG   7   5.269  -2.986   7.503
   52    HB3  ARG   7           1HB      ARG   7   4.169  -4.000   8.427
   53    HG2  ARG   7           2HG      ARG   7   3.596  -4.494   6.251
   54    HG3  ARG   7           1HG      ARG   7   2.409  -3.261   6.681
   55    HD2  ARG   7           2HD      ARG   7   3.511  -2.994   4.425
   56    HD3  ARG   7           1HD      ARG   7   3.570  -1.587   5.485
   57    HE   ARG   7           HE       ARG   7   5.872  -1.948   5.799
   58   HH11  ARG   7          1HH1      ARG   7   4.434  -4.273   3.643
   59   HH12  ARG   7          2HH1      ARG   7   5.950  -4.797   2.989
   60   HH21  ARG   7          1HH2      ARG   7   7.874  -2.629   4.945
   61   HH22  ARG   7          2HH2      ARG   7   7.906  -3.862   3.729
   62    H    VAL   8           H        VAL   8   1.454  -1.819   7.435
   63    HA   VAL   8           HA       VAL   8   2.006  -0.092   5.287
   64    HB   VAL   8           HB       VAL   8   0.051  -1.770   5.601
   65   HG11  VAL   8          1HG1      VAL   8  -2.014  -0.856   6.388
   66   HG12  VAL   8          2HG1      VAL   8  -1.282   0.731   6.624
   67   HG13  VAL   8          3HG1      VAL   8  -0.801  -0.624   7.645
   68   HG21  VAL   8          3HG2      VAL   8  -0.922   0.746   4.366
   69   HG22  VAL   8          1HG2      VAL   8  -0.909  -0.901   3.733
   70   HG23  VAL   8          2HG2      VAL   8   0.576   0.052   3.744
   71    H    LEU   9           H        LEU   9   0.270   0.489   8.358
   72    HA   LEU   9           HA       LEU   9  -0.233   3.219   7.872
   73    HB2  LEU   9           2HB      LEU   9  -1.317   3.100   9.811
   74    HB3  LEU   9           1HB      LEU   9  -0.844   1.420   9.880
   75    HG   LEU   9           HG       LEU   9   1.355   2.735  10.923
   76   HD11  LEU   9          1HD1      LEU   9  -0.298   4.745  10.925
   77   HD12  LEU   9          2HD1      LEU   9   0.700   4.423  12.344
   78   HD13  LEU   9          3HD1      LEU   9  -0.993   3.928  12.325
   79   HD21  LEU   9          3HD2      LEU   9   0.729   1.705  12.982
   80   HD22  LEU   9          1HD2      LEU   9   0.234   0.634  11.671
   81   HD23  LEU   9          2HD2      LEU   9  -0.965   1.632  12.495
   82    H    GLU  10           H        GLU  10   2.420   1.601   9.575
   83    HA   GLU  10           HA       GLU  10   3.759   3.948  10.364
   84    HB2  GLU  10           2HB      GLU  10   5.598   2.542  10.936
   85    HB3  GLU  10           1HB      GLU  10   4.129   1.650  11.308
   86    HG2  GLU  10           2HG      GLU  10   4.541   0.066   9.774
   87    HG3  GLU  10           1HG      GLU  10   5.212   1.211   8.614
   88    H    VAL  11           H        VAL  11   3.816   2.028   7.473
   89    HA   VAL  11           HA       VAL  11   6.140   2.965   6.289
   90    HB   VAL  11           HB       VAL  11   3.690   1.700   5.324
   91   HG11  VAL  11          1HG1      VAL  11   5.614   2.924   3.366
   92   HG12  VAL  11          2HG1      VAL  11   4.043   3.617   3.763
   93   HG13  VAL  11          3HG1      VAL  11   4.139   2.029   3.001
   94   HG21  VAL  11          3HG2      VAL  11   6.269   0.916   4.214
   95   HG22  VAL  11          1HG2      VAL  11   5.035  -0.058   5.017
   96   HG23  VAL  11          2HG2      VAL  11   6.200   0.857   5.976
   97    H    VAL  12           H        VAL  12   2.839   4.098   5.761
   98    HA   VAL  12           HA       VAL  12   3.541   6.263   4.098
   99    HB   VAL  12           HB       VAL  12   1.296   7.012   4.289
  100   HG11  VAL  12          1HG1      VAL  12   0.253   5.201   3.405
  101   HG12  VAL  12          2HG1      VAL  12   0.768   4.129   4.707
  102   HG13  VAL  12          3HG1      VAL  12   1.896   4.560   3.422
  103   HG21  VAL  12          3HG2      VAL  12   1.072   5.301   6.765
  104   HG22  VAL  12          1HG2      VAL  12  -0.243   6.208   6.019
  105   HG23  VAL  12          2HG2      VAL  12   1.132   7.063   6.719
  106    H    LYS  13           H        LYS  13   2.629   6.202   7.546
  107    HA   LYS  13           HA       LYS  13   2.913   8.918   8.049
  108    HB2  LYS  13           2HB      LYS  13   2.619   8.397  10.251
  109    HB3  LYS  13           1HB      LYS  13   2.087   6.882   9.537
  110    HG2  LYS  13           2HG      LYS  13   3.798   5.725  10.397
  111    HG3  LYS  13           1HG      LYS  13   4.961   7.026  10.104
  112    HD2  LYS  13           2HD      LYS  13   2.912   7.030  12.318
  113    HD3  LYS  13           1HD      LYS  13   4.594   6.531  12.515
  114    HE2  LYS  13           2HE      LYS  13   4.047   9.189  11.299
  115    HE3  LYS  13           1HE      LYS  13   3.795   9.003  13.034
  116    HZ1  LYS  13           3HZ      LYS  13   6.075   9.752  12.278
  117    HZ2  LYS  13           1HZ      LYS  13   6.314   8.171  11.725
  118    HZ3  LYS  13           2HZ      LYS  13   6.031   8.459  13.368
  119    H    ASN  14           H        ASN  14   5.346   6.344   8.218
  120    HA   ASN  14           HA       ASN  14   7.406   8.193   8.984
  121    HB2  ASN  14           2HB      ASN  14   7.655   5.293   8.176
  122    HB3  ASN  14           1HB      ASN  14   8.888   6.262   8.976
  123   HD21  ASN  14          1HD2      ASN  14   6.670   3.952   9.477
  124   HD22  ASN  14          2HD2      ASN  14   6.325   4.212  11.149
  125    H    PHE  15           H        PHE  15   5.908   7.537   6.137
  126    HA   PHE  15           HA       PHE  15   8.151   7.448   4.382
  127    HB2  PHE  15           2HB      PHE  15   5.293   7.238   4.156
  128    HB3  PHE  15           1HB      PHE  15   5.902   8.375   2.958
  129    HD1  PHE  15           2HD      PHE  15   7.712   5.430   4.258
  130    HD2  PHE  15           1HD      PHE  15   5.552   7.114   1.002
  131    HE1  PHE  15           2HE      PHE  15   8.403   3.547   2.832
  132    HE2  PHE  15           1HE      PHE  15   6.239   5.236  -0.431
  133    HZ   PHE  15           HZ       PHE  15   7.666   3.449   0.484
  134    H    GLU  16           H        GLU  16   6.400   9.909   5.990
  135    HA   GLU  16           HA       GLU  16   7.295  12.094   6.236
  136    HB2  GLU  16           2HB      GLU  16   8.763  13.035   4.723
  137    HB3  GLU  16           1HB      GLU  16   9.111  11.326   4.514
  138    HG2  GLU  16           2HG      GLU  16   8.670  11.501   2.363
  139    HG3  GLU  16           1HG      GLU  16   7.022  11.995   2.741
  140    H    LYS  17           H        LYS  17   5.115  10.644   4.179
  141    HA   LYS  17           HA       LYS  17   4.005  12.828   2.802
  142    HB2  LYS  17           2HB      LYS  17   2.726  10.253   3.728
  143    HB3  LYS  17           1HB      LYS  17   1.979  11.388   2.613
  144    HG2  LYS  17           2HG      LYS  17   3.037  10.465   0.905
  145    HG3  LYS  17           1HG      LYS  17   4.599  10.737   1.680
  146    HD2  LYS  17           2HD      LYS  17   4.731   8.493   1.697
  147    HD3  LYS  17           1HD      LYS  17   3.664   8.614   3.098
  148    HE2  LYS  17           2HE      LYS  17   1.765   8.575   1.330
  149    HE3  LYS  17           1HE      LYS  17   3.003   7.909   0.265
  150    HZ1  LYS  17           3HZ      LYS  17   2.353   6.756   2.918
  151    HZ2  LYS  17           1HZ      LYS  17   3.299   6.066   1.696
  152    HZ3  LYS  17           2HZ      LYS  17   1.630   6.236   1.480
  153    H    VAL  18           H        VAL  18   3.485  11.565   6.040
  154    HA   VAL  18           HA       VAL  18   2.596  13.959   7.124
  155    HB   VAL  18           HB       VAL  18   0.118  12.904   7.483
  156   HG11  VAL  18          1HG1      VAL  18  -0.470  14.529   5.501
  157   HG12  VAL  18          2HG1      VAL  18   1.240  14.942   5.625
  158   HG13  VAL  18          3HG1      VAL  18   0.180  15.146   7.020
  159   HG21  VAL  18          3HG2      VAL  18  -0.756  11.937   5.564
  160   HG22  VAL  18          1HG2      VAL  18   0.835  11.186   5.685
  161   HG23  VAL  18          2HG2      VAL  18   0.569  12.510   4.551
  162    H    ASP  19           H        ASP  19   2.364  13.824   9.330
  163    HA   ASP  19           HA       ASP  19   3.331  11.485  10.591
  164    HB2  ASP  19           2HB      ASP  19   2.797  14.208  11.323
  165    HB3  ASP  19           1HB      ASP  19   2.107  13.135  12.537
  166    H    ALA  20           H        ALA  20   2.284   9.776  11.393
  167    HA   ALA  20           HA       ALA  20  -0.443   9.337  10.900
  168    HB1  ALA  20           1HB      ALA  20   1.099   7.833  12.985
  169    HB2  ALA  20           2HB      ALA  20   1.433   7.628  11.265
  170    HB3  ALA  20           3HB      ALA  20  -0.166   7.247  11.905
  171    H    SER  21           H        SER  21   1.163  10.909  13.488
  172    HA   SER  21           HA       SER  21  -0.752  10.523  15.526
  173    HB2  SER  21           2HB      SER  21   0.338  12.425  16.641
  174    HB3  SER  21           1HB      SER  21   1.532  11.296  16.001
  175    HG   SER  21           HG       SER  21   0.723  13.771  14.877
  176    H    LYS  22           H        LYS  22  -0.697  12.499  12.730
  177    HA   LYS  22           HA       LYS  22  -2.782  14.259  13.732
  178    HB2  LYS  22           2HB      LYS  22  -1.426  15.629  12.526
  179    HB3  LYS  22           1HB      LYS  22  -0.866  14.328  11.483
  180    HG2  LYS  22           2HG      LYS  22  -3.660  15.354  11.227
  181    HG3  LYS  22           1HG      LYS  22  -2.314  16.232  10.496
  182    HD2  LYS  22           2HD      LYS  22  -2.560  13.296  10.026
  183    HD3  LYS  22           1HD      LYS  22  -3.617  14.398   9.142
  184    HE2  LYS  22           2HE      LYS  22  -0.667  14.883   9.243
  185    HE3  LYS  22           1HE      LYS  22  -1.337  13.708   8.111
  186    HZ1  LYS  22           3HZ      LYS  22  -1.143  16.422   7.740
  187    HZ2  LYS  22           1HZ      LYS  22  -2.787  16.154   8.041
  188    HZ3  LYS  22           2HZ      LYS  22  -2.011  15.332   6.782
  189    H    VAL  23           H        VAL  23  -2.432  11.385  11.966
  190    HA   VAL  23           HA       VAL  23  -4.806  11.660  10.374
  191    HB   VAL  23           HB       VAL  23  -4.418   9.427   9.628
  192   HG11  VAL  23          1HG1      VAL  23  -1.980  11.129   9.940
  193   HG12  VAL  23          2HG1      VAL  23  -2.938  10.796   8.496
  194   HG13  VAL  23          3HG1      VAL  23  -1.870   9.556   9.151
  195   HG21  VAL  23          3HG2      VAL  23  -3.285   9.095  12.237
  196   HG22  VAL  23          1HG2      VAL  23  -2.129   8.563  11.015
  197   HG23  VAL  23          2HG2      VAL  23  -3.748   7.867  11.060
  198    H    THR  24           H        THR  24  -6.822  11.264  11.010
  199    HA   THR  24           HA       THR  24  -7.234   9.722  13.447
  200    HB   THR  24           HB       THR  24  -8.078  12.323  12.808
  201    HG1  THR  24           1HG      THR  24  -8.362  10.516  14.884
  202   HG21  THR  24          3HG2      THR  24 -10.558  10.795  13.344
  203   HG22  THR  24          1HG2      THR  24  -9.995  10.912  11.678
  204   HG23  THR  24          2HG2      THR  24 -10.335  12.377  12.598
  205    HA   PRO  25           HA       PRO  25  -9.763   6.686  11.540
  206    HB2  PRO  25           2HB      PRO  25 -12.096   7.559  13.163
  207    HB3  PRO  25           1HB      PRO  25 -11.348   5.963  13.032
  208    HG2  PRO  25           2HG      PRO  25 -10.982   7.467  15.202
  209    HG3  PRO  25           1HG      PRO  25  -9.664   6.484  14.538
  210    HD2  PRO  25           2HD      PRO  25 -10.120   9.430  14.336
  211    HD3  PRO  25           1HD      PRO  25  -8.599   8.533  14.523
  212    H    GLU  26           H        GLU  26 -11.333   9.832  11.919
  213    HA   GLU  26           HA       GLU  26 -12.871   9.344   9.485
  214    HB2  GLU  26           2HB      GLU  26 -14.441  10.891  10.208
  215    HB3  GLU  26           1HB      GLU  26 -13.926  10.150  11.717
  216    HG2  GLU  26           2HG      GLU  26 -12.248  12.093  11.853
  217    HG3  GLU  26           1HG      GLU  26 -13.261  12.854  10.627
  218    H    SER  27           H        SER  27  -9.950  10.361  10.066
  219    HA   SER  27           HA       SER  27  -9.822  12.959   8.955
  220    HB2  SER  27           2HB      SER  27  -7.775  10.792   9.387
  221    HB3  SER  27           1HB      SER  27  -7.358  12.315   8.602
  222    HG   SER  27           HG       SER  27  -8.648  12.213  11.116
  223    H    HIS  28           H        HIS  28  -9.645  13.647   6.894
  224    HA   HIS  28           HA       HIS  28 -10.208  11.781   4.795
  225    HB2  HIS  28           2HB      HIS  28  -9.835  14.773   4.826
  226    HB3  HIS  28           1HB      HIS  28 -10.161  13.863   3.355
  227    HD1  HIS  28           1HD      HIS  28 -12.226  11.935   5.032
  228    HD2  HIS  28           2HD      HIS  28 -12.335  16.063   4.565
  229    HE1  HIS  28           1HE      HIS  28 -14.621  12.592   5.420
  230    HE2  HIS  28           2HE      HIS  28 -14.647  15.104   5.217
  231    H    PHE  29           H        PHE  29  -8.899  11.267   3.043
  232    HA   PHE  29           HA       PHE  29  -6.121  11.162   3.553
  233    HB2  PHE  29           2HB      PHE  29  -7.759   9.702   2.006
  234    HB3  PHE  29           1HB      PHE  29  -7.083  10.763   0.773
  235    HD1  PHE  29           1HD      PHE  29  -4.503  10.772   2.880
  236    HD2  PHE  29           2HD      PHE  29  -6.614   7.973   0.466
  237    HE1  PHE  29           1HE      PHE  29  -2.494   9.356   2.769
  238    HE2  PHE  29           2HE      PHE  29  -4.608   6.552   0.352
  239    HZ   PHE  29           HZ       PHE  29  -2.544   7.244   1.504
  240    H    VAL  30           H        VAL  30  -5.613  11.665   0.559
  241    HA   VAL  30           HA       VAL  30  -4.119  13.824   0.498
  242    HB   VAL  30           HB       VAL  30  -4.307  13.916  -1.764
  243   HG11  VAL  30          1HG1      VAL  30  -4.743  11.800  -2.628
  244   HG12  VAL  30          2HG1      VAL  30  -6.069  11.508  -1.504
  245   HG13  VAL  30          3HG1      VAL  30  -4.403  11.483  -0.928
  246   HG21  VAL  30          3HG2      VAL  30  -6.815  13.374  -2.691
  247   HG22  VAL  30          1HG2      VAL  30  -6.168  14.991  -2.408
  248   HG23  VAL  30          2HG2      VAL  30  -7.161  14.209  -1.177
  249    H    LYS  31           H        LYS  31  -7.572  13.929   0.763
  250    HA   LYS  31           HA       LYS  31  -7.961  16.670   0.265
  251    HB2  LYS  31           2HB      LYS  31  -9.596  14.832   2.021
  252    HB3  LYS  31           1HB      LYS  31 -10.124  16.382   1.379
  253    HG2  LYS  31           2HG      LYS  31 -11.081  15.034  -0.162
  254    HG3  LYS  31           1HG      LYS  31  -9.495  15.200  -0.917
  255    HD2  LYS  31           2HD      LYS  31  -9.462  13.062   1.003
  256    HD3  LYS  31           1HD      LYS  31 -10.785  12.831  -0.143
  257    HE2  LYS  31           2HE      LYS  31  -8.697  13.607  -1.755
  258    HE3  LYS  31           1HE      LYS  31  -7.902  12.613  -0.535
  259    HZ1  LYS  31           3HZ      LYS  31  -9.209  11.698  -2.740
  260    HZ2  LYS  31           1HZ      LYS  31 -10.327  11.437  -1.497
  261    HZ3  LYS  31           2HZ      LYS  31  -8.776  10.772  -1.393
  262    H    ASP  32           H        ASP  32  -7.583  14.898   3.327
  263    HA   ASP  32           HA       ASP  32  -7.442  17.360   4.809
  264    HB2  ASP  32           2HB      ASP  32  -8.197  14.732   5.418
  265    HB3  ASP  32           1HB      ASP  32  -6.727  15.021   6.344
  266    H    LEU  33           H        LEU  33  -5.333  16.110   2.847
  267    HA   LEU  33           HA       LEU  33  -3.105  17.027   2.812
  268    HB2  LEU  33           2HB      LEU  33  -3.089  16.229   5.725
  269    HB3  LEU  33           1HB      LEU  33  -1.732  16.915   4.853
  270    HG   LEU  33           HG       LEU  33  -3.817  18.268   6.236
  271   HD11  LEU  33          1HD1      LEU  33  -2.402  20.262   5.408
  272   HD12  LEU  33          2HD1      LEU  33  -1.336  19.022   4.745
  273   HD13  LEU  33          3HD1      LEU  33  -1.659  19.074   6.478
  274   HD21  LEU  33          3HD2      LEU  33  -5.231  18.615   4.489
  275   HD22  LEU  33          1HD2      LEU  33  -3.959  18.438   3.279
  276   HD23  LEU  33          2HD2      LEU  33  -4.106  19.940   4.191
  277    H    GLY  34           H        GLY  34  -4.266  14.586   2.040
  278    HA2  GLY  34           2HA      GLY  34  -2.857  12.332   3.010
  279    HA3  GLY  34           1HA      GLY  34  -3.722  12.426   1.484
  280    H    LEU  35           H        LEU  35  -1.621  10.936   1.297
  281    HA   LEU  35           HA       LEU  35   0.842  12.261   0.827
  282    HB2  LEU  35           2HB      LEU  35   1.629  10.166  -0.007
  283    HB3  LEU  35           1HB      LEU  35   0.611   9.851   1.386
  284    HG   LEU  35           HG       LEU  35   0.096   9.257  -1.498
  285   HD11  LEU  35          1HD1      LEU  35  -0.724   7.126  -0.436
  286   HD12  LEU  35          2HD1      LEU  35  -0.095   7.743   1.092
  287   HD13  LEU  35          3HD1      LEU  35   0.999   7.455  -0.261
  288   HD21  LEU  35          3HD2      LEU  35  -2.090   9.282   0.562
  289   HD22  LEU  35          1HD2      LEU  35  -2.226   9.041  -1.179
  290   HD23  LEU  35          2HD2      LEU  35  -1.808  10.630  -0.539
  291    H    ASN  36           H        ASN  36   1.922  12.564  -1.191
  292    HA   ASN  36           HA       ASN  36   0.295  13.741  -3.181
  293    HB2  ASN  36           2HB      ASN  36   2.737  13.401  -4.396
  294    HB3  ASN  36           1HB      ASN  36   2.288  14.769  -3.387
  295   HD21  ASN  36          1HD2      ASN  36   3.766  11.602  -3.348
  296   HD22  ASN  36          2HD2      ASN  36   4.794  11.884  -1.989
  297    H    SER  37           H        SER  37   1.058  13.096  -5.614
  298    HA   SER  37           HA       SER  37  -0.282  10.683  -6.163
  299    HB2  SER  37           2HB      SER  37   1.342  11.364  -8.390
  300    HB3  SER  37           1HB      SER  37  -0.385  11.648  -8.178
  301    H    LEU  38           H        LEU  38   3.103  11.498  -6.770
  302    HA   LEU  38           HA       LEU  38   4.007   8.966  -7.414
  303    HB2  LEU  38           2HB      LEU  38   6.192   9.773  -7.112
  304    HB3  LEU  38           1HB      LEU  38   5.244  11.170  -7.588
  305    HG   LEU  38           HG       LEU  38   6.837  11.717  -5.813
  306   HD11  LEU  38          1HD1      LEU  38   3.929  11.819  -5.044
  307   HD12  LEU  38          2HD1      LEU  38   4.859  13.046  -5.903
  308   HD13  LEU  38          3HD1      LEU  38   5.203  12.706  -4.207
  309   HD21  LEU  38          3HD2      LEU  38   6.287   9.252  -4.804
  310   HD22  LEU  38          1HD2      LEU  38   5.375  10.295  -3.712
  311   HD23  LEU  38          2HD2      LEU  38   7.107  10.542  -3.925
  312    H    ASP  39           H        ASP  39   3.168  10.273  -4.345
  313    HA   ASP  39           HA       ASP  39   4.620   8.457  -2.719
  314    HB2  ASP  39           2HB      ASP  39   2.758  10.620  -2.331
  315    HB3  ASP  39           1HB      ASP  39   2.323   9.254  -1.307
  316    H    VAL  40           H        VAL  40   1.122   8.647  -2.676
  317    HA   VAL  40           HA       VAL  40   0.420   6.239  -1.793
  318    HB   VAL  40           HB       VAL  40  -0.958   8.208  -3.106
  319   HG11  VAL  40          1HG1      VAL  40  -0.355   6.762  -5.209
  320   HG12  VAL  40          2HG1      VAL  40  -1.963   7.464  -5.033
  321   HG13  VAL  40          3HG1      VAL  40  -1.695   5.764  -4.646
  322   HG21  VAL  40          3HG2      VAL  40  -1.541   5.779  -1.639
  323   HG22  VAL  40          1HG2      VAL  40  -2.811   6.168  -2.800
  324   HG23  VAL  40          2HG2      VAL  40  -2.338   7.351  -1.580
  325    H    VAL  41           H        VAL  41   1.598   6.866  -5.055
  326    HA   VAL  41           HA       VAL  41   1.078   4.297  -6.101
  327    HB   VAL  41           HB       VAL  41   2.649   4.864  -7.883
  328   HG11  VAL  41          1HG1      VAL  41   0.320   6.265  -7.204
  329   HG12  VAL  41          2HG1      VAL  41   1.057   6.112  -8.800
  330   HG13  VAL  41          3HG1      VAL  41   1.468   7.481  -7.766
  331   HG21  VAL  41          3HG2      VAL  41   3.237   7.519  -6.690
  332   HG22  VAL  41          1HG2      VAL  41   4.190   6.544  -7.807
  333   HG23  VAL  41          2HG2      VAL  41   4.140   6.127  -6.094
  334    H    GLU  42           H        GLU  42   3.872   5.690  -4.447
  335    HA   GLU  42           HA       GLU  42   5.540   3.422  -4.803
  336    HB2  GLU  42           2HB      GLU  42   5.661   5.939  -3.235
  337    HB3  GLU  42           1HB      GLU  42   6.677   4.609  -2.694
  338    HG2  GLU  42           2HG      GLU  42   7.344   4.539  -5.242
  339    HG3  GLU  42           1HG      GLU  42   6.821   6.221  -5.180
  340    H    VAL  43           H        VAL  43   3.439   4.557  -2.244
  341    HA   VAL  43           HA       VAL  43   4.080   2.546  -0.366
  342    HB   VAL  43           HB       VAL  43   3.004   4.132   0.808
  343   HG11  VAL  43          1HG1      VAL  43   1.296   5.650  -0.130
  344   HG12  VAL  43          2HG1      VAL  43   1.391   4.765  -1.651
  345   HG13  VAL  43          3HG1      VAL  43   2.797   5.646  -1.054
  346   HG21  VAL  43          3HG2      VAL  43   1.563   2.187   1.078
  347   HG22  VAL  43          1HG2      VAL  43   0.586   2.742  -0.274
  348   HG23  VAL  43          2HG2      VAL  43   0.650   3.692   1.205
  349    H    VAL  44           H        VAL  44   1.674   2.820  -2.893
  350    HA   VAL  44           HA       VAL  44   0.128   0.567  -2.237
  351    HB   VAL  44           HB       VAL  44  -0.543   0.560  -4.637
  352   HG11  VAL  44          1HG1      VAL  44  -1.014   2.515  -2.678
  353   HG12  VAL  44          2HG1      VAL  44  -2.037   2.094  -4.052
  354   HG13  VAL  44          3HG1      VAL  44  -0.837   3.377  -4.205
  355   HG21  VAL  44          3HG2      VAL  44   0.339   2.103  -6.196
  356   HG22  VAL  44          1HG2      VAL  44   1.730   1.331  -5.436
  357   HG23  VAL  44          2HG2      VAL  44   1.248   2.956  -4.948
  358    H    PHE  45           H        PHE  45   3.078   0.977  -4.092
  359    HA   PHE  45           HA       PHE  45   3.227  -1.660  -5.104
  360    HB2  PHE  45           2HB      PHE  45   4.773   0.728  -5.242
  361    HB3  PHE  45           1HB      PHE  45   5.842  -0.581  -4.748
  362    HD1  PHE  45           1HD      PHE  45   5.942  -2.648  -6.161
  363    HD2  PHE  45           2HD      PHE  45   4.065   0.940  -7.457
  364    HE1  PHE  45           1HE      PHE  45   6.094  -3.421  -8.497
  365    HE2  PHE  45           2HE      PHE  45   4.210   0.179  -9.796
  366    HZ   PHE  45           HZ       PHE  45   5.226  -2.005 -10.317
  367    H    ALA  46           H        ALA  46   4.190  -0.131  -2.148
  368    HA   ALA  46           HA       ALA  46   5.909  -2.101  -1.132
  369    HB1  ALA  46           1HB      ALA  46   4.487  -0.869   1.002
  370    HB2  ALA  46           2HB      ALA  46   4.818   0.342  -0.237
  371    HB3  ALA  46           3HB      ALA  46   6.143  -0.585   0.467
  372    H    ILE  47           H        ILE  47   2.787  -1.419   0.327
  373    HA   ILE  47           HA       ILE  47   2.394  -3.858   1.532
  374    HB   ILE  47           HB       ILE  47  -0.151  -3.279   1.127
  375   HG12  ILE  47          2HG1      ILE  47   1.190  -1.235  -0.343
  376   HG13  ILE  47          1HG1      ILE  47  -0.539  -1.451  -0.101
  377   HG21  ILE  47          1HG2      ILE  47  -0.120  -2.312   3.185
  378   HG22  ILE  47          2HG2      ILE  47   1.238  -1.257   2.794
  379   HG23  ILE  47          3HG2      ILE  47   1.520  -2.959   3.163
  380   HD11  ILE  47          3HD1      ILE  47  -0.637   0.098   1.562
  381   HD12  ILE  47          1HD1      ILE  47   0.695   0.756   0.612
  382   HD13  ILE  47          2HD1      ILE  47   1.029  -0.176   2.070
  383    H    GLU  48           H        GLU  48   1.487  -2.867  -1.743
  384    HA   GLU  48           HA       GLU  48   0.011  -5.101  -2.483
  385    HB2  GLU  48           2HB      GLU  48  -0.011  -3.279  -3.979
  386    HB3  GLU  48           1HB      GLU  48   1.745  -3.211  -4.051
  387    HG2  GLU  48           2HG      GLU  48   0.066  -5.440  -5.176
  388    HG3  GLU  48           1HG      GLU  48   0.709  -4.088  -6.107
  389    H    GLN  49           H        GLN  49   3.458  -4.595  -2.332
  390    HA   GLN  49           HA       GLN  49   4.298  -6.897  -3.703
  391    HB2  GLN  49           2HB      GLN  49   5.537  -5.079  -1.679
  392    HB3  GLN  49           1HB      GLN  49   6.338  -6.600  -2.047
  393    HG2  GLN  49           2HG      GLN  49   5.603  -4.497  -4.071
  394    HG3  GLN  49           1HG      GLN  49   7.203  -4.715  -3.363
  395   HE21  GLN  49          1HE2      GLN  49   6.544  -4.829  -6.130
  396   HE22  GLN  49          2HE2      GLN  49   6.919  -6.422  -6.687
  397    H    GLU  50           H        GLU  50   3.783  -6.324  -0.230
  398    HA   GLU  50           HA       GLU  50   3.900  -9.193   0.216
  399    HB2  GLU  50           2HB      GLU  50   3.565  -7.646   2.623
  400    HB3  GLU  50           1HB      GLU  50   4.871  -8.734   2.175
  401    HG2  GLU  50           2HG      GLU  50   5.342  -6.486   0.646
  402    HG3  GLU  50           1HG      GLU  50   4.780  -5.839   2.187
  403    H    PHE  51           H        PHE  51   1.636  -8.023  -1.064
  404    HA   PHE  51           HA       PHE  51  -0.417  -8.722   0.870
  405    HB2  PHE  51           2HB      PHE  51  -0.246  -6.265  -0.811
  406    HB3  PHE  51           1HB      PHE  51  -1.833  -6.950  -0.481
  407    HD1  PHE  51           1HD      PHE  51   1.243  -6.483   1.583
  408    HD2  PHE  51           2HD      PHE  51  -2.919  -5.731   1.122
  409    HE1  PHE  51           1HE      PHE  51   1.212  -5.347   3.765
  410    HE2  PHE  51           2HE      PHE  51  -2.959  -4.593   3.302
  411    HZ   PHE  51           HZ       PHE  51  -0.892  -4.400   4.627
  412    H    ILE  52           H        ILE  52   0.881  -9.076  -2.248
  413    HA   ILE  52           HA       ILE  52   0.342 -10.401  -4.006
  414    HB   ILE  52           HB       ILE  52  -0.917 -12.319  -3.672
  415   HG12  ILE  52          2HG1      ILE  52  -2.771 -10.535  -2.499
  416   HG13  ILE  52          1HG1      ILE  52  -3.011 -12.224  -2.917
  417   HG21  ILE  52          1HG2      ILE  52  -0.190 -13.212  -1.631
  418   HG22  ILE  52          2HG2      ILE  52  -0.290 -11.653  -0.813
  419   HG23  ILE  52          3HG2      ILE  52   0.978 -11.944  -2.004
  420   HD11  ILE  52          3HD1      ILE  52  -3.556 -11.601  -0.555
  421   HD12  ILE  52          1HD1      ILE  52  -1.830 -11.334  -0.307
  422   HD13  ILE  52          2HD1      ILE  52  -2.421 -12.939  -0.740
  423    H    LEU  53           H        LEU  53  -0.845  -7.778  -3.705
  424    HA   LEU  53           HA       LEU  53  -2.731  -7.913  -5.814
  425    HB2  LEU  53           2HB      LEU  53  -3.965  -8.472  -3.539
  426    HB3  LEU  53           1HB      LEU  53  -3.952  -6.727  -3.370
  427    HG   LEU  53           HG       LEU  53  -5.208  -6.470  -5.426
  428   HD11  LEU  53          1HD1      LEU  53  -4.940  -9.461  -5.625
  429   HD12  LEU  53          2HD1      LEU  53  -4.362  -8.245  -6.765
  430   HD13  LEU  53          3HD1      LEU  53  -6.093  -8.516  -6.566
  431   HD21  LEU  53          3HD2      LEU  53  -6.581  -8.642  -3.876
  432   HD22  LEU  53          1HD2      LEU  53  -7.286  -7.230  -4.664
  433   HD23  LEU  53          2HD2      LEU  53  -6.324  -7.035  -3.198
  434    H    ASP  54           H        ASP  54  -2.754  -6.028  -6.912
  435    HA   ASP  54           HA       ASP  54  -1.047  -3.922  -5.995
  436    HB2  ASP  54           2HB      ASP  54  -2.736  -3.984  -8.496
  437    HB3  ASP  54           1HB      ASP  54  -1.341  -2.955  -8.182
  438    H    ILE  55           H        ILE  55  -1.610  -1.836  -5.461
  439    HA   ILE  55           HA       ILE  55  -4.400  -1.453  -4.722
  440    HB   ILE  55           HB       ILE  55  -2.125   0.354  -3.956
  441   HG12  ILE  55          2HG1      ILE  55  -1.328  -1.669  -3.109
  442   HG13  ILE  55          1HG1      ILE  55  -2.252  -1.024  -1.757
  443   HG21  ILE  55          1HG2      ILE  55  -4.860   0.528  -3.595
  444   HG22  ILE  55          2HG2      ILE  55  -3.627   1.431  -2.714
  445   HG23  ILE  55          3HG2      ILE  55  -4.265  -0.073  -2.047
  446   HD11  ILE  55          3HD1      ILE  55  -4.093  -2.513  -3.191
  447   HD12  ILE  55          1HD1      ILE  55  -3.290  -2.979  -1.692
  448   HD13  ILE  55          2HD1      ILE  55  -2.612  -3.468  -3.244
  449    HA   PRO  56           HA       PRO  56  -2.749   2.369  -7.536
  450    HB2  PRO  56           2HB      PRO  56  -2.086   0.394  -9.675
  451    HB3  PRO  56           1HB      PRO  56  -1.351   1.963  -9.328
  452    HG2  PRO  56           2HG      PRO  56  -0.122  -0.294  -8.634
  453    HG3  PRO  56           1HG      PRO  56  -0.080   1.129  -7.577
  454    HD2  PRO  56           2HD      PRO  56  -1.634  -1.394  -7.298
  455    HD3  PRO  56           1HD      PRO  56  -0.956  -0.340  -6.043
  456    H    ASP  57           H        ASP  57  -3.440   2.263 -10.247
  457    HA   ASP  57           HA       ASP  57  -5.252   2.362 -11.616
  458    HB2  ASP  57           2HB      ASP  57  -6.693   0.129 -10.335
  459    HB3  ASP  57           1HB      ASP  57  -6.252   0.367 -12.023
  460    H    HIS  58           H        HIS  58  -7.743   2.478 -11.607
  461    HA   HIS  58           HA       HIS  58  -8.576   4.515  -9.952
  462    HB2  HIS  58           2HB      HIS  58 -10.875   2.959 -10.579
  463    HB3  HIS  58           1HB      HIS  58 -10.313   4.435 -11.355
  464    HD1  HIS  58           1HD      HIS  58  -9.940   4.181 -13.777
  465    HD2  HIS  58           2HD      HIS  58  -9.378   0.595 -11.752
  466    HE1  HIS  58           1HE      HIS  58  -9.411   2.480 -15.553
  467    HE2  HIS  58           2HE      HIS  58  -8.982   0.340 -14.295
  468    H    ASP  59           H        ASP  59  -8.112   1.263  -9.142
  469    HA   ASP  59           HA       ASP  59 -10.077   0.879  -7.171
  470    HB2  ASP  59           2HB      ASP  59  -8.947  -1.059  -7.877
  471    HB3  ASP  59           1HB      ASP  59  -7.362  -0.328  -7.643
  472    H    ALA  60           H        ALA  60  -6.768   2.143  -6.963
  473    HA   ALA  60           HA       ALA  60  -7.024   2.659  -4.142
  474    HB1  ALA  60           1HB      ALA  60  -4.854   2.900  -6.151
  475    HB2  ALA  60           2HB      ALA  60  -4.849   2.121  -4.569
  476    HB3  ALA  60           3HB      ALA  60  -4.746   3.877  -4.687
  477    H    GLU  61           H        GLU  61  -7.418   4.375  -7.111
  478    HA   GLU  61           HA       GLU  61  -7.263   6.999  -5.997
  479    HB2  GLU  61           2HB      GLU  61  -8.025   5.836  -8.631
  480    HB3  GLU  61           1HB      GLU  61  -8.572   7.466  -8.263
  481    HG2  GLU  61           2HG      GLU  61  -6.368   7.188  -9.521
  482    HG3  GLU  61           1HG      GLU  61  -6.410   8.305  -8.157
  483    H    LYS  62           H        LYS  62  -9.750   4.615  -6.377
  484    HA   LYS  62           HA       LYS  62 -11.966   6.376  -6.072
  485    HB2  LYS  62           2HB      LYS  62 -11.666   3.389  -5.806
  486    HB3  LYS  62           1HB      LYS  62 -13.200   4.210  -5.554
  487    HG2  LYS  62           2HG      LYS  62 -13.458   4.711  -7.768
  488    HG3  LYS  62           1HG      LYS  62 -11.721   4.723  -8.080
  489    HD2  LYS  62           2HD      LYS  62 -11.633   2.321  -7.980
  490    HD3  LYS  62           1HD      LYS  62 -13.323   2.240  -7.478
  491    HE2  LYS  62           2HE      LYS  62 -12.863   3.704  -9.976
  492    HE3  LYS  62           1HE      LYS  62 -12.438   1.994 -10.045
  493    HZ1  LYS  62           3HZ      LYS  62 -14.574   1.496 -10.208
  494    HZ2  LYS  62           1HZ      LYS  62 -14.976   3.140 -10.185
  495    HZ3  LYS  62           2HZ      LYS  62 -14.908   2.264  -8.739
  496    H    ILE  63           H        ILE  63  -9.625   5.985  -3.988
  497    HA   ILE  63           HA       ILE  63 -11.328   5.715  -1.627
  498    HB   ILE  63           HB       ILE  63  -8.896   4.530  -2.176
  499   HG12  ILE  63          2HG1      ILE  63  -9.342   4.732   0.674
  500   HG13  ILE  63          1HG1      ILE  63 -10.868   4.510  -0.177
  501   HG21  ILE  63          1HG2      ILE  63  -8.377   6.597  -0.056
  502   HG22  ILE  63          2HG2      ILE  63  -7.893   6.813  -1.739
  503   HG23  ILE  63          3HG2      ILE  63  -7.233   5.477  -0.795
  504   HD11  ILE  63          3HD1      ILE  63  -8.448   2.745  -0.466
  505   HD12  ILE  63          1HD1      ILE  63 -10.024   2.503  -1.224
  506   HD13  ILE  63          2HD1      ILE  63  -9.862   2.394   0.529
  507    H    GLN  64           H        GLN  64 -11.752   7.449  -0.411
  508    HA   GLN  64           HA       GLN  64 -10.134   9.839  -0.811
  509    HB2  GLN  64           2HB      GLN  64 -12.844  10.245   0.236
  510    HB3  GLN  64           1HB      GLN  64 -11.976  11.132  -1.010
  511    HG2  GLN  64           2HG      GLN  64 -13.897  10.115  -1.991
  512    HG3  GLN  64           1HG      GLN  64 -12.459   9.292  -2.592
  513   HE21  GLN  64          1HE2      GLN  64 -14.668   9.049   0.181
  514   HE22  GLN  64          2HE2      GLN  64 -14.855   7.333   0.097
  515    H    SER  65           H        SER  65 -10.981   7.476   1.360
  516    HA   SER  65           HA       SER  65 -10.343   9.220   3.651
  517    HB2  SER  65           2HB      SER  65 -11.833   8.070   5.017
  518    HB3  SER  65           1HB      SER  65 -12.693   8.077   3.479
  519    HG   SER  65           HG       SER  65 -10.977   5.954   4.190
  520    H    ILE  66           H        ILE  66  -8.875   8.504   5.146
  521    HA   ILE  66           HA       ILE  66  -6.863   6.744   4.217
  522    HB   ILE  66           HB       ILE  66  -6.681   7.204   7.054
  523   HG12  ILE  66          2HG1      ILE  66  -8.210   9.064   6.646
  524   HG13  ILE  66          1HG1      ILE  66  -6.595   9.673   6.986
  525   HG21  ILE  66          1HG2      ILE  66  -4.545   7.449   6.481
  526   HG22  ILE  66          2HG2      ILE  66  -4.921   8.785   5.392
  527   HG23  ILE  66          3HG2      ILE  66  -5.034   7.119   4.819
  528   HD11  ILE  66          3HD1      ILE  66  -8.254  10.067   4.676
  529   HD12  ILE  66          1HD1      ILE  66  -6.690   9.392   4.221
  530   HD13  ILE  66          2HD1      ILE  66  -6.768  10.889   5.149
  531    HA   PRO  67           HA       PRO  67  -8.737   3.919   7.746
  532    HB2  PRO  67           2HB      PRO  67 -11.459   4.089   7.909
  533    HB3  PRO  67           1HB      PRO  67 -10.357   4.995   8.951
  534    HG2  PRO  67           2HG      PRO  67 -11.812   5.891   6.497
  535    HG3  PRO  67           1HG      PRO  67 -11.551   6.755   8.024
  536    HD2  PRO  67           2HD      PRO  67 -10.092   7.263   5.814
  537    HD3  PRO  67           1HD      PRO  67  -9.408   7.386   7.448
  538    H    ASP  68           H        ASP  68 -11.206   4.591   5.247
  539    HA   ASP  68           HA       ASP  68 -11.798   1.909   4.704
  540    HB2  ASP  68           2HB      ASP  68 -12.450   4.499   3.569
  541    HB3  ASP  68           1HB      ASP  68 -12.245   3.283   2.312
  542    H    ALA  69           H        ALA  69  -9.121   3.840   3.802
  543    HA   ALA  69           HA       ALA  69  -8.357   2.479   1.444
  544    HB1  ALA  69           1HB      ALA  69  -7.184   4.383   1.430
  545    HB2  ALA  69           2HB      ALA  69  -6.022   3.489   2.410
  546    HB3  ALA  69           3HB      ALA  69  -7.219   4.526   3.187
  547    H    VAL  70           H        VAL  70  -6.535   2.519   4.458
  548    HA   VAL  70           HA       VAL  70  -5.204   0.092   3.935
  549    HB   VAL  70           HB       VAL  70  -4.064   1.511   5.394
  550   HG11  VAL  70          1HG1      VAL  70  -6.646   2.274   6.229
  551   HG12  VAL  70          2HG1      VAL  70  -5.104   3.024   6.639
  552   HG13  VAL  70          3HG1      VAL  70  -5.770   1.757   7.669
  553   HG21  VAL  70          3HG2      VAL  70  -5.021  -0.072   7.647
  554   HG22  VAL  70          1HG2      VAL  70  -3.424  -0.011   6.903
  555   HG23  VAL  70          2HG2      VAL  70  -4.680  -1.037   6.210
  556    H    GLU  71           H        GLU  71  -8.290   0.783   5.229
  557    HA   GLU  71           HA       GLU  71  -8.615  -1.563   6.796
  558    HB2  GLU  71           2HB      GLU  71 -10.462   0.531   5.718
  559    HB3  GLU  71           1HB      GLU  71 -11.128  -0.941   6.411
  560    HG2  GLU  71           2HG      GLU  71  -9.169   0.056   8.200
  561    HG3  GLU  71           1HG      GLU  71 -10.221   1.392   7.736
  562    H    TYR  72           H        TYR  72  -9.525  -0.654   3.495
  563    HA   TYR  72           HA       TYR  72 -10.895  -3.028   2.878
  564    HB2  TYR  72           2HB      TYR  72 -11.364  -1.891   1.016
  565    HB3  TYR  72           1HB      TYR  72 -10.279  -0.619   1.564
  566    HD1  TYR  72           1HD      TYR  72  -7.804  -0.830   0.932
  567    HD2  TYR  72           2HD      TYR  72 -10.882  -3.110  -0.917
  568    HE1  TYR  72           1HE      TYR  72  -6.327  -1.255  -0.986
  569    HE2  TYR  72           2HE      TYR  72  -9.412  -3.545  -2.840
  570    HH   TYR  72           HH       TYR  72  -7.026  -3.589  -3.364
  571    H    ILE  73           H        ILE  73  -7.561  -2.045   2.241
  572    HA   ILE  73           HA       ILE  73  -6.772  -4.435   0.982
  573    HB   ILE  73           HB       ILE  73  -4.425  -3.664   1.958
  574   HG12  ILE  73          2HG1      ILE  73  -6.149  -1.742   3.058
  575   HG13  ILE  73          1HG1      ILE  73  -4.390  -1.707   3.034
  576   HG21  ILE  73          1HG2      ILE  73  -4.990  -1.736  -0.035
  577   HG22  ILE  73          2HG2      ILE  73  -5.923  -3.185  -0.406
  578   HG23  ILE  73          3HG2      ILE  73  -4.175  -3.289  -0.206
  579   HD11  ILE  73          3HD1      ILE  73  -5.468   0.354   2.183
  580   HD12  ILE  73          1HD1      ILE  73  -6.124  -0.592   0.847
  581   HD13  ILE  73          2HD1      ILE  73  -4.379  -0.415   1.029
  582    H    ALA  74           H        ALA  74  -6.997  -3.484   4.316
  583    HA   ALA  74           HA       ALA  74  -5.449  -5.560   5.426
  584    HB1  ALA  74           1HB      ALA  74  -6.693  -3.346   6.422
  585    HB2  ALA  74           2HB      ALA  74  -5.951  -4.616   7.396
  586    HB3  ALA  74           3HB      ALA  74  -7.685  -4.651   7.073
  587    H    GLN  75           H        GLN  75  -8.840  -5.294   4.600
  588    HA   GLN  75           HA       GLN  75  -9.530  -7.843   5.682
  589    HB2  GLN  75           2HB      GLN  75 -11.421  -6.815   3.750
  590    HB3  GLN  75           1HB      GLN  75 -11.635  -7.127   5.467
  591    HG2  GLN  75           2HG      GLN  75 -10.379  -4.929   5.831
  592    HG3  GLN  75           1HG      GLN  75 -10.688  -4.627   4.121
  593   HE21  GLN  75          1HE2      GLN  75 -11.663  -2.937   6.032
  594   HE22  GLN  75          2HE2      GLN  75 -13.382  -3.077   6.115
  595    H    ASN  76           H        ASN  76 -10.320  -6.838   2.411
  596    HA   ASN  76           HA       ASN  76 -10.565  -9.104   1.116
  597    HB2  ASN  76           2HB      ASN  76  -8.657  -7.621  -0.459
  598    HB3  ASN  76           1HB      ASN  76 -10.382  -7.855  -0.724
  599   HD21  ASN  76          1HD2      ASN  76  -8.170  -5.562  -0.469
  600   HD22  ASN  76          2HD2      ASN  76  -9.097  -4.296   0.245
  601    HA   PRO  77           HA       PRO  77  -5.842 -10.062   0.489
  602    HB2  PRO  77           2HB      PRO  77  -4.635  -8.153   2.420
  603    HB3  PRO  77           1HB      PRO  77  -4.085  -8.625   0.808
  604    HG2  PRO  77           2HG      PRO  77  -5.189  -6.242   1.194
  605    HG3  PRO  77           1HG      PRO  77  -5.566  -7.183  -0.262
  606    HD2  PRO  77           2HD      PRO  77  -7.202  -6.829   2.229
  607    HD3  PRO  77           1HD      PRO  77  -7.718  -6.811   0.533
  608    H    MET  78           H        MET  78  -6.883  -8.985   3.726
  609    HA   MET  78           HA       MET  78  -5.351 -10.806   5.213
  610    HB2  MET  78           2HB      MET  78  -6.305  -9.161   6.528
  611    HB3  MET  78           1HB      MET  78  -7.863  -9.273   5.722
  612    HG2  MET  78           2HG      MET  78  -7.876 -10.092   8.054
  613    HG3  MET  78           1HG      MET  78  -8.395 -11.292   6.873
  614    HE1  MET  78           3HE      MET  78  -8.025 -13.465   8.252
  615    HE2  MET  78           1HE      MET  78  -7.832 -12.362   9.615
  616    HE3  MET  78           2HE      MET  78  -6.675 -13.670   9.368
  617    H    ALA  79           H        ALA  79  -8.061 -11.278   3.201
  618    HA   ALA  79           HA       ALA  79  -8.713 -13.837   4.391
  619    HB1  ALA  79           1HB      ALA  79 -10.099 -12.065   2.435
  620    HB2  ALA  79           2HB      ALA  79 -10.688 -12.712   3.966
  621    HB3  ALA  79           3HB      ALA  79 -10.535 -13.769   2.563
  622    H    LYS  80           H        LYS  80  -8.844 -12.952   1.007
  623    HA   LYS  80           HA       LYS  80  -8.436 -14.536  -0.721
  624    HB2  LYS  80           2HB      LYS  80  -5.589 -13.921  -0.199
  625    HB3  LYS  80           1HB      LYS  80  -6.542 -13.693  -1.659
  626    HG2  LYS  80           2HG      LYS  80  -7.684 -11.837  -0.112
  627    HG3  LYS  80           1HG      LYS  80  -6.072 -11.862   0.606
  628    HD2  LYS  80           2HD      LYS  80  -5.066 -11.066  -1.290
  629    HD3  LYS  80           1HD      LYS  80  -6.282 -11.766  -2.358
  630    HE2  LYS  80           2HE      LYS  80  -7.522  -9.907  -2.332
  631    HE3  LYS  80           1HE      LYS  80  -7.379  -9.741  -0.584
  632    HZ1  LYS  80           3HZ      LYS  80  -5.396  -8.854  -2.607
  633    HZ2  LYS  80           1HZ      LYS  80  -5.159  -8.779  -0.933
  634    HZ3  LYS  80           2HZ      LYS  80  -6.379  -7.860  -1.657
  635   H282  PNS 101          8H2       PNS 101   1.978  15.232  -7.867
  636   H281  PNS 101          9H2       PNS 101   2.607  16.259  -9.159
  637   H303  PNS 101          0H3       PNS 101   5.658  15.410  -7.979
  638   H302  PNS 101          1H3       PNS 101   4.610  14.762  -6.717
  639   H301  PNS 101          2H3       PNS 101   4.215  16.298  -7.489
  640   H313  PNS 101          3H3       PNS 101   4.535  12.815  -7.741
  641   H312  PNS 101          4H3       PNS 101   3.508  12.533  -9.146
  642   H311  PNS 101          5H3       PNS 101   2.793  13.063  -7.623
  643    H32  PNS 101           6H3      PNS 101   3.721  14.455 -10.674
  644    H33  PNS 101           7H3      PNS 101   4.673  16.047 -11.390
  645    H36  PNS 101           8H3      PNS 101   6.987  14.576  -9.887
  646   H372  PNS 101          9H3       PNS 101   7.173  12.832 -12.228
  647   H371  PNS 101          0H4       PNS 101   8.225  12.507 -10.850
  648   H382  PNS 101          1H4       PNS 101   9.054  14.867 -11.055
  649   H381  PNS 101          2H4       PNS 101   9.485  13.796 -12.387
  650    H41  PNS 101           3H4      PNS 101   7.085  15.984 -11.278
  651   H422  PNS 101          4H4       PNS 101   6.061  17.124 -13.579
  652   H421  PNS 101          5H4       PNS 101   6.290  17.968 -12.049
  653   H431  PNS 101          7H4       PNS 101   7.885  19.204 -12.987
  654   H432  PNS 101          6H4       PNS 101   8.830  17.740 -13.293
  655    H44  PNS 101           8H4      PNS 101   7.025  17.719 -15.513
  Start of MODEL   12
    1    H1   MET   1           1HT      MET   1  -3.811  -7.937   8.359
    2    H2   MET   1           2HT      MET   1  -5.285  -7.763   7.494
    3    H3   MET   1           3HT      MET   1  -4.989  -9.182   8.414
    4    HA   MET   1           HA       MET   1  -6.384  -7.064   9.227
    5    HB2  MET   1           2HB      MET   1  -5.818  -8.128  11.546
    6    HB3  MET   1           1HB      MET   1  -6.663  -9.082  10.335
    7    HG2  MET   1           2HG      MET   1  -4.851 -10.420   9.919
    8    HG3  MET   1           1HG      MET   1  -3.693  -9.200  10.444
    9    HE1  MET   1           2HE      MET   1  -2.643 -11.784  12.709
   10    HE2  MET   1           3HE      MET   1  -2.965 -11.636  10.981
   11    HE3  MET   1           1HE      MET   1  -3.945 -12.718  11.970
   12    H    ASN   2           H        ASN   2  -3.976  -7.669  11.582
   13    HA   ASN   2           HA       ASN   2  -3.478  -4.897  11.954
   14    HB2  ASN   2           2HB      ASN   2  -2.051  -7.258  13.182
   15    HB3  ASN   2           1HB      ASN   2  -1.994  -5.596  13.760
   16   HD21  ASN   2          1HD2      ASN   2  -2.690  -6.850  15.727
   17   HD22  ASN   2          2HD2      ASN   2  -4.391  -7.013  15.982
   18    H    ASP   3           H        ASP   3  -1.805  -7.492  10.373
   19    HA   ASP   3           HA       ASP   3   0.753  -6.421  10.190
   20    HB2  ASP   3           2HB      ASP   3  -0.791  -8.375   8.538
   21    HB3  ASP   3           1HB      ASP   3   0.788  -7.826   7.983
   22    H    VAL   4           H        VAL   4  -2.065  -5.806   8.189
   23    HA   VAL   4           HA       VAL   4  -0.656  -4.413   6.159
   24    HB   VAL   4           HB       VAL   4  -2.873  -3.586   5.431
   25   HG11  VAL   4          1HG1      VAL   4  -2.456  -5.551   4.367
   26   HG12  VAL   4          2HG1      VAL   4  -3.866  -6.048   5.304
   27   HG13  VAL   4          3HG1      VAL   4  -2.244  -6.449   5.871
   28   HG21  VAL   4          3HG2      VAL   4  -4.877  -4.481   6.590
   29   HG22  VAL   4          1HG2      VAL   4  -3.970  -3.311   7.549
   30   HG23  VAL   4          2HG2      VAL   4  -3.827  -5.035   7.893
   31    H    LEU   5           H        LEU   5  -2.774  -3.171   8.767
   32    HA   LEU   5           HA       LEU   5  -2.163  -0.474   8.215
   33    HB2  LEU   5           2HB      LEU   5  -3.274   0.050  10.325
   34    HB3  LEU   5           1HB      LEU   5  -4.220  -1.031   9.331
   35    HG   LEU   5           HG       LEU   5  -4.274  -1.555  11.758
   36   HD11  LEU   5          1HD1      LEU   5  -4.324  -3.205   9.661
   37   HD12  LEU   5          2HD1      LEU   5  -4.547  -3.743  11.325
   38   HD13  LEU   5          3HD1      LEU   5  -2.969  -3.902  10.550
   39   HD21  LEU   5          3HD2      LEU   5  -2.453  -1.988  12.996
   40   HD22  LEU   5          1HD2      LEU   5  -1.609  -1.073  11.748
   41   HD23  LEU   5          2HD2      LEU   5  -1.633  -2.835  11.687
   42    H    THR   6           H        THR   6  -0.734  -2.844  10.328
   43    HA   THR   6           HA       THR   6   0.797  -1.116  11.917
   44    HB   THR   6           HB       THR   6   0.500  -3.381  12.615
   45    HG1  THR   6           1HG      THR   6   3.148  -2.693  11.941
   46   HG21  THR   6          3HG2      THR   6   2.288  -4.664  10.719
   47   HG22  THR   6          1HG2      THR   6   0.789  -4.088   9.991
   48   HG23  THR   6          2HG2      THR   6   0.735  -5.198  11.362
   49    H    ARG   7           H        ARG   7   1.826  -3.015   9.109
   50    HA   ARG   7           HA       ARG   7   4.340  -1.682   8.950
   51    HB2  ARG   7           2HB      ARG   7   4.888  -3.185   7.274
   52    HB3  ARG   7           1HB      ARG   7   3.719  -4.098   8.218
   53    HG2  ARG   7           2HG      ARG   7   3.084  -4.477   6.016
   54    HG3  ARG   7           1HG      ARG   7   1.976  -3.216   6.562
   55    HD2  ARG   7           2HD      ARG   7   2.612  -2.013   4.804
   56    HD3  ARG   7           1HD      ARG   7   4.191  -1.848   5.571
   57    HE   ARG   7           HE       ARG   7   3.495  -3.586   3.359
   58   HH11  ARG   7          1HH1      ARG   7   5.805  -2.785   5.838
   59   HH12  ARG   7          2HH1      ARG   7   7.127  -3.571   5.043
   60   HH21  ARG   7          1HH2      ARG   7   5.228  -4.625   2.301
   61   HH22  ARG   7          2HH2      ARG   7   6.799  -4.617   3.031
   62    H    VAL   8           H        VAL   8   1.320  -1.609   7.135
   63    HA   VAL   8           HA       VAL   8   2.161   0.150   5.119
   64    HB   VAL   8           HB       VAL   8   0.006  -1.288   5.255
   65   HG11  VAL   8          1HG1      VAL   8  -0.778  -0.167   7.345
   66   HG12  VAL   8          2HG1      VAL   8  -1.965  -0.190   6.040
   67   HG13  VAL   8          3HG1      VAL   8  -1.068   1.288   6.391
   68   HG21  VAL   8          3HG2      VAL   8  -0.807   1.282   4.134
   69   HG22  VAL   8          1HG2      VAL   8  -0.572  -0.278   3.345
   70   HG23  VAL   8          2HG2      VAL   8   0.810   0.778   3.641
   71    H    LEU   9           H        LEU   9   0.379   0.761   8.137
   72    HA   LEU   9           HA       LEU   9   0.116   3.528   7.866
   73    HB2  LEU   9           2HB      LEU   9  -0.494   3.567  10.119
   74    HB3  LEU   9           1HB      LEU   9  -0.928   1.952   9.598
   75    HG   LEU   9           HG       LEU   9   1.356   1.236  10.544
   76   HD11  LEU   9          1HD1      LEU   9   1.694   3.934  10.875
   77   HD12  LEU   9          2HD1      LEU   9   2.622   2.675  11.689
   78   HD13  LEU   9          3HD1      LEU   9   1.231   3.403  12.492
   79   HD21  LEU   9          3HD2      LEU   9   0.383   1.274  12.907
   80   HD22  LEU   9          1HD2      LEU   9  -0.562   0.479  11.648
   81   HD23  LEU   9          2HD2      LEU   9  -1.001   2.098  12.188
   82    H    GLU  10           H        GLU  10   2.690   1.616   9.370
   83    HA   GLU  10           HA       GLU  10   4.253   3.794  10.236
   84    HB2  GLU  10           2HB      GLU  10   6.001   2.188  10.603
   85    HB3  GLU  10           1HB      GLU  10   4.473   1.441  11.049
   86    HG2  GLU  10           2HG      GLU  10   4.561  -0.073   9.377
   87    HG3  GLU  10           1HG      GLU  10   5.374   1.032   8.267
   88    H    VAL  11           H        VAL  11   4.107   1.978   7.269
   89    HA   VAL  11           HA       VAL  11   6.437   2.849   6.043
   90    HB   VAL  11           HB       VAL  11   3.906   1.723   5.104
   91   HG11  VAL  11          1HG1      VAL  11   5.251   2.003   2.746
   92   HG12  VAL  11          2HG1      VAL  11   5.494   3.573   3.509
   93   HG13  VAL  11          3HG1      VAL  11   3.860   2.965   3.244
   94   HG21  VAL  11          3HG2      VAL  11   6.199   0.650   3.838
   95   HG22  VAL  11          1HG2      VAL  11   5.169  -0.095   5.061
   96   HG23  VAL  11          2HG2      VAL  11   6.565   0.867   5.549
   97    H    VAL  12           H        VAL  12   3.173   4.147   5.724
   98    HA   VAL  12           HA       VAL  12   3.923   6.337   4.088
   99    HB   VAL  12           HB       VAL  12   1.669   7.279   4.799
  100   HG11  VAL  12          1HG1      VAL  12   2.279   5.609   2.854
  101   HG12  VAL  12          2HG1      VAL  12   0.604   6.030   3.206
  102   HG13  VAL  12          3HG1      VAL  12   1.272   4.508   3.794
  103   HG21  VAL  12          3HG2      VAL  12   1.471   4.598   6.168
  104   HG22  VAL  12          1HG2      VAL  12   0.151   5.745   5.947
  105   HG23  VAL  12          2HG2      VAL  12   1.524   6.168   6.968
  106    H    LYS  13           H        LYS  13   3.171   6.088   7.556
  107    HA   LYS  13           HA       LYS  13   3.470   8.750   8.256
  108    HB2  LYS  13           2HB      LYS  13   3.666   8.031  10.490
  109    HB3  LYS  13           1HB      LYS  13   2.696   6.794   9.703
  110    HG2  LYS  13           2HG      LYS  13   4.685   5.378   9.491
  111    HG3  LYS  13           1HG      LYS  13   5.641   6.619  10.315
  112    HD2  LYS  13           2HD      LYS  13   3.302   5.090  11.457
  113    HD3  LYS  13           1HD      LYS  13   5.001   4.884  11.884
  114    HE2  LYS  13           2HE      LYS  13   4.161   7.641  12.141
  115    HE3  LYS  13           1HE      LYS  13   3.157   6.567  13.113
  116    HZ1  LYS  13           3HZ      LYS  13   5.391   7.540  14.035
  117    HZ2  LYS  13           1HZ      LYS  13   6.065   6.221  13.216
  118    HZ3  LYS  13           2HZ      LYS  13   4.906   5.967  14.422
  119    H    ASN  14           H        ASN  14   5.960   6.208   8.192
  120    HA   ASN  14           HA       ASN  14   8.034   8.104   8.781
  121    HB2  ASN  14           2HB      ASN  14   8.357   5.220   7.955
  122    HB3  ASN  14           1HB      ASN  14   9.532   6.228   8.794
  123   HD21  ASN  14          1HD2      ASN  14   7.330   3.842   9.187
  124   HD22  ASN  14          2HD2      ASN  14   6.991   4.027  10.871
  125    H    PHE  15           H        PHE  15   6.350   7.384   6.057
  126    HA   PHE  15           HA       PHE  15   8.410   7.224   4.120
  127    HB2  PHE  15           2HB      PHE  15   5.495   7.404   4.136
  128    HB3  PHE  15           1HB      PHE  15   6.226   8.276   2.794
  129    HD1  PHE  15           2HD      PHE  15   8.130   5.491   4.007
  130    HD2  PHE  15           1HD      PHE  15   4.989   6.617   1.367
  131    HE1  PHE  15           2HE      PHE  15   8.404   3.374   2.785
  132    HE2  PHE  15           1HE      PHE  15   5.257   4.501   0.139
  133    HZ   PHE  15           HZ       PHE  15   6.966   2.876   0.848
  134    H    GLU  16           H        GLU  16   6.949   9.797   5.856
  135    HA   GLU  16           HA       GLU  16   8.087  11.888   6.057
  136    HB2  GLU  16           2HB      GLU  16   9.407  12.775   4.388
  137    HB3  GLU  16           1HB      GLU  16   9.606  11.058   4.092
  138    HG2  GLU  16           2HG      GLU  16   7.394  11.767   2.596
  139    HG3  GLU  16           1HG      GLU  16   8.509  13.112   2.409
  140    H    LYS  17           H        LYS  17   5.622  10.688   4.079
  141    HA   LYS  17           HA       LYS  17   4.516  13.058   3.051
  142    HB2  LYS  17           2HB      LYS  17   3.380  10.348   3.678
  143    HB3  LYS  17           1HB      LYS  17   2.346  11.649   3.102
  144    HG2  LYS  17           2HG      LYS  17   2.888  10.516   1.164
  145    HG3  LYS  17           1HG      LYS  17   4.048  11.846   1.175
  146    HD2  LYS  17           2HD      LYS  17   5.771  10.435   1.255
  147    HD3  LYS  17           1HD      LYS  17   5.067   9.560   2.617
  148    HE2  LYS  17           2HE      LYS  17   3.985   8.043   1.251
  149    HE3  LYS  17           1HE      LYS  17   3.985   9.133  -0.134
  150    HZ1  LYS  17           3HZ      LYS  17   6.496   8.011   0.951
  151    HZ2  LYS  17           1HZ      LYS  17   6.215   8.683  -0.576
  152    HZ3  LYS  17           2HZ      LYS  17   5.571   7.168  -0.188
  153    H    VAL  18           H        VAL  18   3.786  11.252   6.030
  154    HA   VAL  18           HA       VAL  18   3.377  13.472   7.642
  155    HB   VAL  18           HB       VAL  18   0.742  13.030   7.792
  156   HG11  VAL  18          1HG1      VAL  18   2.271  15.131   7.208
  157   HG12  VAL  18          2HG1      VAL  18   0.515  15.165   7.052
  158   HG13  VAL  18          3HG1      VAL  18   1.522  14.897   5.629
  159   HG21  VAL  18          3HG2      VAL  18  -0.300  12.622   5.738
  160   HG22  VAL  18          1HG2      VAL  18   0.999  11.432   5.805
  161   HG23  VAL  18          2HG2      VAL  18   1.187  12.888   4.828
  162    H    ASP  19           H        ASP  19   2.966  12.901   9.760
  163    HA   ASP  19           HA       ASP  19   3.405  10.208  10.470
  164    HB2  ASP  19           2HB      ASP  19   4.157  11.916  11.966
  165    HB3  ASP  19           1HB      ASP  19   2.541  12.607  12.086
  166    H    ALA  20           H        ALA  20   2.018   8.577  10.568
  167    HA   ALA  20           HA       ALA  20  -0.692   8.768   9.955
  168    HB1  ALA  20           1HB      ALA  20  -0.249   6.446  11.554
  169    HB2  ALA  20           2HB      ALA  20   1.150   6.705  10.513
  170    HB3  ALA  20           3HB      ALA  20  -0.460   6.566   9.808
  171    H    SER  21           H        SER  21   0.895   9.517  12.853
  172    HA   SER  21           HA       SER  21  -1.106   8.844  14.726
  173    HB2  SER  21           2HB      SER  21   1.291   9.400  15.266
  174    HB3  SER  21           1HB      SER  21   0.897  11.093  14.970
  175    HG   SER  21           HG       SER  21  -0.525  11.045  16.682
  176    H    LYS  22           H        LYS  22  -0.856  11.342  12.407
  177    HA   LYS  22           HA       LYS  22  -2.809  13.025  13.742
  178    HB2  LYS  22           2HB      LYS  22  -2.435  14.564  11.824
  179    HB3  LYS  22           1HB      LYS  22  -0.968  14.194  12.721
  180    HG2  LYS  22           2HG      LYS  22  -1.243  12.292  10.625
  181    HG3  LYS  22           1HG      LYS  22  -1.458  13.911   9.955
  182    HD2  LYS  22           2HD      LYS  22   0.873  12.933  11.604
  183    HD3  LYS  22           1HD      LYS  22   0.882  13.301   9.878
  184    HE2  LYS  22           2HE      LYS  22   0.092  15.652  10.630
  185    HE3  LYS  22           1HE      LYS  22   0.707  15.168  12.211
  186    HZ1  LYS  22           3HZ      LYS  22   2.265  16.396  10.613
  187    HZ2  LYS  22           1HZ      LYS  22   2.389  14.917   9.799
  188    HZ3  LYS  22           2HZ      LYS  22   2.864  15.035  11.418
  189    H    VAL  23           H        VAL  23  -2.684  10.516  11.467
  190    HA   VAL  23           HA       VAL  23  -4.874  11.209   9.821
  191    HB   VAL  23           HB       VAL  23  -4.895   8.898   9.106
  192   HG11  VAL  23          1HG1      VAL  23  -2.163   8.738   9.007
  193   HG12  VAL  23          2HG1      VAL  23  -2.433  10.458   9.284
  194   HG13  VAL  23          3HG1      VAL  23  -3.175   9.662   7.897
  195   HG21  VAL  23          3HG2      VAL  23  -3.937   8.417  11.749
  196   HG22  VAL  23          1HG2      VAL  23  -2.789   7.739  10.593
  197   HG23  VAL  23          2HG2      VAL  23  -4.484   7.254  10.540
  198    H    THR  24           H        THR  24  -6.980  11.211  10.248
  199    HA   THR  24           HA       THR  24  -7.931   9.748  12.580
  200    HB   THR  24           HB       THR  24  -8.060  12.413  12.266
  201    HG1  THR  24           1HG      THR  24  -9.598  12.354  13.864
  202   HG21  THR  24          3HG2      THR  24 -10.600  12.774  11.848
  203   HG22  THR  24          1HG2      THR  24 -10.443  11.323  10.862
  204   HG23  THR  24          2HG2      THR  24  -9.470  12.745  10.494
  205    HA   PRO  25           HA       PRO  25 -10.640   7.240  10.207
  206    HB2  PRO  25           2HB      PRO  25 -13.048   7.598  11.537
  207    HB3  PRO  25           1HB      PRO  25 -11.782   6.463  12.013
  208    HG2  PRO  25           2HG      PRO  25 -12.375   9.195  13.065
  209    HG3  PRO  25           1HG      PRO  25 -11.863   7.740  13.941
  210    HD2  PRO  25           2HD      PRO  25 -10.141   9.718  13.393
  211    HD3  PRO  25           1HD      PRO  25  -9.637   8.015  13.346
  212    H    GLU  26           H        GLU  26 -11.869  10.460  10.993
  213    HA   GLU  26           HA       GLU  26 -13.497  10.447   8.579
  214    HB2  GLU  26           2HB      GLU  26 -14.422  12.578   9.475
  215    HB3  GLU  26           1HB      GLU  26 -14.661  11.202  10.543
  216    HG2  GLU  26           2HG      GLU  26 -12.211  12.741  11.031
  217    HG3  GLU  26           1HG      GLU  26 -13.718  13.609  11.324
  218    H    SER  27           H        SER  27 -10.413  11.008   9.202
  219    HA   SER  27           HA       SER  27 -10.038  13.581   8.019
  220    HB2  SER  27           2HB      SER  27  -8.037  13.388   9.000
  221    HB3  SER  27           1HB      SER  27  -8.450  11.744   9.484
  222    HG   SER  27           HG       SER  27  -7.035  11.085   8.097
  223    H    HIS  28           H        HIS  28  -9.547  14.088   5.948
  224    HA   HIS  28           HA       HIS  28 -10.026  12.102   3.943
  225    HB2  HIS  28           2HB      HIS  28 -10.007  14.988   4.095
  226    HB3  HIS  28           1HB      HIS  28  -9.115  14.432   2.683
  227    HD1  HIS  28           1HD      HIS  28 -10.549  12.612   1.172
  228    HD2  HIS  28           2HD      HIS  28 -12.676  15.145   3.687
  229    HE1  HIS  28           1HE      HIS  28 -12.911  12.586   0.310
  230    HE2  HIS  28           2HE      HIS  28 -14.198  14.058   1.900
  231    H    PHE  29           H        PHE  29  -8.578  11.447   2.309
  232    HA   PHE  29           HA       PHE  29  -5.923  11.026   3.180
  233    HB2  PHE  29           2HB      PHE  29  -7.370   9.606   1.566
  234    HB3  PHE  29           1HB      PHE  29  -6.796  10.711   0.322
  235    HD1  PHE  29           1HD      PHE  29  -4.274  10.506   2.691
  236    HD2  PHE  29           2HD      PHE  29  -6.079   8.243  -0.429
  237    HE1  PHE  29           1HE      PHE  29  -2.213   9.179   2.464
  238    HE2  PHE  29           2HE      PHE  29  -4.024   6.912  -0.660
  239    HZ   PHE  29           HZ       PHE  29  -2.087   7.379   0.789
  240    H    VAL  30           H        VAL  30  -4.976  11.435   0.275
  241    HA   VAL  30           HA       VAL  30  -3.263  13.439   0.455
  242    HB   VAL  30           HB       VAL  30  -4.531  13.868  -2.078
  243   HG11  VAL  30          1HG1      VAL  30  -2.388  12.516  -2.748
  244   HG12  VAL  30          2HG1      VAL  30  -1.977  12.728  -1.047
  245   HG13  VAL  30          3HG1      VAL  30  -2.250  14.138  -2.070
  246   HG21  VAL  30          3HG2      VAL  30  -3.988  10.959  -1.585
  247   HG22  VAL  30          1HG2      VAL  30  -4.823  11.717  -2.941
  248   HG23  VAL  30          2HG2      VAL  30  -5.597  11.646  -1.358
  249    H    LYS  31           H        LYS  31  -6.687  13.856   0.138
  250    HA   LYS  31           HA       LYS  31  -6.743  16.605  -0.457
  251    HB2  LYS  31           2HB      LYS  31  -8.778  14.900   0.989
  252    HB3  LYS  31           1HB      LYS  31  -9.077  16.523   0.382
  253    HG2  LYS  31           2HG      LYS  31  -9.939  15.288  -1.326
  254    HG3  LYS  31           1HG      LYS  31  -8.277  15.470  -1.889
  255    HD2  LYS  31           2HD      LYS  31  -8.558  13.177  -0.149
  256    HD3  LYS  31           1HD      LYS  31  -9.668  13.087  -1.518
  257    HE2  LYS  31           2HE      LYS  31  -6.714  12.990  -1.453
  258    HE3  LYS  31           1HE      LYS  31  -7.852  12.152  -2.506
  259    HZ1  LYS  31           3HZ      LYS  31  -6.846  14.924  -2.734
  260    HZ2  LYS  31           1HZ      LYS  31  -8.238  14.414  -3.549
  261    HZ3  LYS  31           2HZ      LYS  31  -6.751  13.676  -3.871
  262    H    ASP  32           H        ASP  32  -7.024  14.901   2.654
  263    HA   ASP  32           HA       ASP  32  -6.905  17.387   4.100
  264    HB2  ASP  32           2HB      ASP  32  -8.170  15.064   4.637
  265    HB3  ASP  32           1HB      ASP  32  -6.697  14.833   5.575
  266    H    LEU  33           H        LEU  33  -4.630  15.902   2.527
  267    HA   LEU  33           HA       LEU  33  -2.352  16.615   2.830
  268    HB2  LEU  33           2HB      LEU  33  -2.863  15.932   5.727
  269    HB3  LEU  33           1HB      LEU  33  -1.336  16.484   5.065
  270    HG   LEU  33           HG       LEU  33  -3.811  18.168   4.839
  271   HD11  LEU  33          1HD1      LEU  33  -3.868  18.255   7.076
  272   HD12  LEU  33          2HD1      LEU  33  -2.436  19.272   6.909
  273   HD13  LEU  33          3HD1      LEU  33  -2.260  17.550   7.243
  274   HD21  LEU  33          3HD2      LEU  33  -2.438  19.652   3.917
  275   HD22  LEU  33          1HD2      LEU  33  -1.199  18.397   3.888
  276   HD23  LEU  33          2HD2      LEU  33  -1.296  19.508   5.253
  277    H    GLY  34           H        GLY  34  -3.590  14.252   1.946
  278    HA2  GLY  34           2HA      GLY  34  -2.211  12.027   3.208
  279    HA3  GLY  34           1HA      GLY  34  -3.326  11.932   1.854
  280    H    LEU  35           H        LEU  35  -1.466  10.367   1.308
  281    HA   LEU  35           HA       LEU  35   1.010  11.393   0.427
  282    HB2  LEU  35           2HB      LEU  35  -0.497   8.850   0.010
  283    HB3  LEU  35           1HB      LEU  35   0.899   9.179  -0.997
  284    HG   LEU  35           HG       LEU  35   2.386   8.909   0.717
  285   HD11  LEU  35          1HD1      LEU  35   2.039   9.443   2.994
  286   HD12  LEU  35          2HD1      LEU  35   0.286   9.472   2.795
  287   HD13  LEU  35          3HD1      LEU  35   1.279  10.732   2.061
  288   HD21  LEU  35          3HD2      LEU  35   0.724   6.901   0.437
  289   HD22  LEU  35          1HD2      LEU  35   0.261   7.329   2.084
  290   HD23  LEU  35          2HD2      LEU  35   1.933   6.897   1.722
  291    H    ASN  36           H        ASN  36   1.527  12.490  -1.350
  292    HA   ASN  36           HA       ASN  36  -0.402  13.345  -3.207
  293    HB2  ASN  36           2HB      ASN  36   1.322  14.536  -4.260
  294    HB3  ASN  36           1HB      ASN  36   1.834  14.447  -2.577
  295   HD21  ASN  36          1HD2      ASN  36   2.668  13.856  -5.767
  296   HD22  ASN  36          2HD2      ASN  36   4.104  12.941  -5.489
  297    H    SER  37           H        SER  37   1.044  13.102  -5.671
  298    HA   SER  37           HA       SER  37  -0.081  10.718  -6.647
  299    HB2  SER  37           2HB      SER  37   1.561  12.909  -7.743
  300    HB3  SER  37           1HB      SER  37   1.688  11.370  -8.595
  301    H    LEU  38           H        LEU  38   3.336  11.611  -6.489
  302    HA   LEU  38           HA       LEU  38   4.242   8.961  -6.951
  303    HB2  LEU  38           2HB      LEU  38   6.355   9.830  -6.958
  304    HB3  LEU  38           1HB      LEU  38   5.423  11.263  -7.306
  305    HG   LEU  38           HG       LEU  38   7.117  10.657  -5.031
  306   HD11  LEU  38          1HD1      LEU  38   6.033  13.282  -5.994
  307   HD12  LEU  38          2HD1      LEU  38   7.408  12.469  -6.742
  308   HD13  LEU  38          3HD1      LEU  38   7.499  12.989  -5.060
  309   HD21  LEU  38          3HD2      LEU  38   4.310  11.477  -4.624
  310   HD22  LEU  38          1HD2      LEU  38   5.537  12.355  -3.715
  311   HD23  LEU  38          2HD2      LEU  38   5.403  10.605  -3.548
  312    H    ASP  39           H        ASP  39   2.993  10.452  -4.214
  313    HA   ASP  39           HA       ASP  39   4.528   9.011  -2.256
  314    HB2  ASP  39           2HB      ASP  39   2.206  10.881  -2.190
  315    HB3  ASP  39           1HB      ASP  39   2.483   9.840  -0.797
  316    H    VAL  40           H        VAL  40   1.066   8.998  -2.970
  317    HA   VAL  40           HA       VAL  40   0.448   6.624  -1.674
  318    HB   VAL  40           HB       VAL  40  -1.013   8.476  -3.048
  319   HG11  VAL  40          1HG1      VAL  40  -0.304   6.871  -5.075
  320   HG12  VAL  40          2HG1      VAL  40  -1.845   7.726  -5.014
  321   HG13  VAL  40          3HG1      VAL  40  -1.757   6.032  -4.531
  322   HG21  VAL  40          3HG2      VAL  40  -2.292   7.564  -1.451
  323   HG22  VAL  40          1HG2      VAL  40  -1.514   5.988  -1.601
  324   HG23  VAL  40          2HG2      VAL  40  -2.813   6.440  -2.707
  325    H    VAL  41           H        VAL  41   1.740   7.179  -4.885
  326    HA   VAL  41           HA       VAL  41   1.280   4.616  -5.955
  327    HB   VAL  41           HB       VAL  41   3.564   6.469  -6.633
  328   HG11  VAL  41          1HG1      VAL  41   2.615   5.107  -8.893
  329   HG12  VAL  41          2HG1      VAL  41   2.755   3.899  -7.616
  330   HG13  VAL  41          3HG1      VAL  41   4.153   4.876  -8.062
  331   HG21  VAL  41          3HG2      VAL  41   2.194   7.770  -7.872
  332   HG22  VAL  41          1HG2      VAL  41   0.972   7.196  -6.738
  333   HG23  VAL  41          2HG2      VAL  41   1.142   6.426  -8.315
  334    H    GLU  42           H        GLU  42   4.275   5.995  -4.579
  335    HA   GLU  42           HA       GLU  42   5.792   3.672  -4.638
  336    HB2  GLU  42           2HB      GLU  42   5.875   6.143  -2.953
  337    HB3  GLU  42           1HB      GLU  42   6.948   4.801  -2.577
  338    HG2  GLU  42           2HG      GLU  42   7.444   4.997  -5.183
  339    HG3  GLU  42           1HG      GLU  42   6.968   6.665  -4.869
  340    H    VAL  43           H        VAL  43   3.679   4.902  -2.112
  341    HA   VAL  43           HA       VAL  43   4.176   2.917  -0.194
  342    HB   VAL  43           HB       VAL  43   3.016   4.670   0.736
  343   HG11  VAL  43          1HG1      VAL  43   1.972   6.153  -0.535
  344   HG12  VAL  43          2HG1      VAL  43   0.662   5.009  -0.815
  345   HG13  VAL  43          3HG1      VAL  43   2.054   5.035  -1.896
  346   HG21  VAL  43          3HG2      VAL  43   1.874   2.348   1.025
  347   HG22  VAL  43          1HG2      VAL  43   0.582   3.108   0.104
  348   HG23  VAL  43          2HG2      VAL  43   1.092   3.807   1.636
  349    H    VAL  44           H        VAL  44   1.635   3.166  -2.631
  350    HA   VAL  44           HA       VAL  44   0.303   0.784  -2.049
  351    HB   VAL  44           HB       VAL  44  -0.683   0.900  -4.226
  352   HG11  VAL  44          1HG1      VAL  44  -0.699   3.698  -4.207
  353   HG12  VAL  44          2HG1      VAL  44  -0.457   3.208  -2.531
  354   HG13  VAL  44          3HG1      VAL  44  -1.851   2.612  -3.431
  355   HG21  VAL  44          3HG2      VAL  44   1.131   3.072  -5.149
  356   HG22  VAL  44          1HG2      VAL  44   0.214   1.893  -6.086
  357   HG23  VAL  44          2HG2      VAL  44   1.688   1.402  -5.253
  358    H    PHE  45           H        PHE  45   3.164   1.437  -3.966
  359    HA   PHE  45           HA       PHE  45   3.377  -1.177  -5.072
  360    HB2  PHE  45           2HB      PHE  45   5.374   1.071  -4.769
  361    HB3  PHE  45           1HB      PHE  45   5.741  -0.445  -5.588
  362    HD1  PHE  45           1HD      PHE  45   2.958  -0.765  -6.838
  363    HD2  PHE  45           2HD      PHE  45   5.688   2.494  -6.652
  364    HE1  PHE  45           1HE      PHE  45   2.023   0.132  -8.930
  365    HE2  PHE  45           2HE      PHE  45   4.759   3.397  -8.744
  366    HZ   PHE  45           HZ       PHE  45   2.924   2.217  -9.885
  367    H    ALA  46           H        ALA  46   4.125   0.267  -2.069
  368    HA   ALA  46           HA       ALA  46   6.110  -1.611  -1.247
  369    HB1  ALA  46           1HB      ALA  46   4.517   0.422   0.291
  370    HB2  ALA  46           2HB      ALA  46   6.178   0.576  -0.283
  371    HB3  ALA  46           3HB      ALA  46   5.790  -0.576   0.995
  372    H    ILE  47           H        ILE  47   2.914  -0.915   0.073
  373    HA   ILE  47           HA       ILE  47   2.613  -3.253   1.544
  374    HB   ILE  47           HB       ILE  47   0.102  -2.813   1.249
  375   HG12  ILE  47          2HG1      ILE  47   1.300  -0.754  -0.516
  376   HG13  ILE  47          1HG1      ILE  47  -0.266  -1.549  -0.617
  377   HG21  ILE  47          1HG2      ILE  47   1.005  -0.311   2.323
  378   HG22  ILE  47          2HG2      ILE  47   2.085  -1.612   2.821
  379   HG23  ILE  47          3HG2      ILE  47   0.358  -1.720   3.162
  380   HD11  ILE  47          3HD1      ILE  47  -1.230   0.245   0.220
  381   HD12  ILE  47          1HD1      ILE  47   0.340   1.036   0.324
  382   HD13  ILE  47          2HD1      ILE  47  -0.262   0.099   1.688
  383    H    GLU  48           H        GLU  48   1.610  -2.531  -1.784
  384    HA   GLU  48           HA       GLU  48   0.271  -4.899  -2.342
  385    HB2  GLU  48           2HB      GLU  48   0.188  -3.040  -3.880
  386    HB3  GLU  48           1HB      GLU  48   1.922  -3.134  -4.152
  387    HG2  GLU  48           2HG      GLU  48  -0.109  -5.206  -4.950
  388    HG3  GLU  48           1HG      GLU  48   0.686  -4.056  -6.024
  389    H    GLN  49           H        GLN  49   3.681  -4.146  -2.365
  390    HA   GLN  49           HA       GLN  49   4.679  -6.428  -3.617
  391    HB2  GLN  49           2HB      GLN  49   5.778  -4.505  -1.605
  392    HB3  GLN  49           1HB      GLN  49   6.683  -5.968  -1.967
  393    HG2  GLN  49           2HG      GLN  49   6.979  -5.357  -4.215
  394    HG3  GLN  49           1HG      GLN  49   5.751  -4.096  -4.117
  395   HE21  GLN  49          1HE2      GLN  49   7.309  -2.640  -4.962
  396   HE22  GLN  49          2HE2      GLN  49   8.529  -1.963  -3.943
  397    H    GLU  50           H        GLU  50   4.183  -5.832  -0.136
  398    HA   GLU  50           HA       GLU  50   4.407  -8.693   0.322
  399    HB2  GLU  50           2HB      GLU  50   5.880  -7.528   1.752
  400    HB3  GLU  50           1HB      GLU  50   4.667  -6.317   2.140
  401    HG2  GLU  50           2HG      GLU  50   5.225  -8.058   3.913
  402    HG3  GLU  50           1HG      GLU  50   3.524  -7.741   3.578
  403    H    PHE  51           H        PHE  51   2.058  -7.597  -0.869
  404    HA   PHE  51           HA       PHE  51   0.104  -8.260   1.187
  405    HB2  PHE  51           2HB      PHE  51   0.170  -5.938  -0.656
  406    HB3  PHE  51           1HB      PHE  51  -1.396  -6.685  -0.372
  407    HD1  PHE  51           2HD      PHE  51   0.533  -7.195   2.483
  408    HD2  PHE  51           1HD      PHE  51  -1.637  -4.168   0.426
  409    HE1  PHE  51           2HE      PHE  51   0.315  -5.930   4.582
  410    HE2  PHE  51           1HE      PHE  51  -1.859  -2.898   2.521
  411    HZ   PHE  51           HZ       PHE  51  -0.883  -3.778   4.602
  412    H    ILE  52           H        ILE  52   1.323  -8.804  -1.940
  413    HA   ILE  52           HA       ILE  52   0.790 -10.307  -3.564
  414    HB   ILE  52           HB       ILE  52  -1.474 -11.497  -2.072
  415   HG12  ILE  52          2HG1      ILE  52   0.939 -12.596  -1.003
  416   HG13  ILE  52          1HG1      ILE  52   0.943 -10.856  -0.731
  417   HG21  ILE  52          1HG2      ILE  52  -0.446 -13.569  -2.807
  418   HG22  ILE  52          2HG2      ILE  52   0.963 -12.683  -3.392
  419   HG23  ILE  52          3HG2      ILE  52  -0.607 -12.451  -4.161
  420   HD11  ILE  52          3HD1      ILE  52  -1.094 -12.860   0.183
  421   HD12  ILE  52          1HD1      ILE  52  -1.359 -11.117   0.241
  422   HD13  ILE  52          2HD1      ILE  52  -0.044 -11.842   1.167
  423    H    LEU  53           H        LEU  53  -0.546  -7.722  -3.354
  424    HA   LEU  53           HA       LEU  53  -2.406  -8.009  -5.444
  425    HB2  LEU  53           2HB      LEU  53  -4.388  -8.201  -4.447
  426    HB3  LEU  53           1HB      LEU  53  -3.522  -8.566  -2.966
  427    HG   LEU  53           HG       LEU  53  -3.483  -5.879  -2.842
  428   HD11  LEU  53          1HD1      LEU  53  -6.002  -6.596  -4.330
  429   HD12  LEU  53          2HD1      LEU  53  -4.717  -5.518  -4.873
  430   HD13  LEU  53          3HD1      LEU  53  -5.726  -5.065  -3.500
  431   HD21  LEU  53          3HD2      LEU  53  -5.594  -7.814  -1.924
  432   HD22  LEU  53          1HD2      LEU  53  -5.571  -6.122  -1.428
  433   HD23  LEU  53          2HD2      LEU  53  -4.220  -7.179  -1.017
  434    H    ASP  54           H        ASP  54  -2.606  -6.099  -6.488
  435    HA   ASP  54           HA       ASP  54  -1.304  -3.809  -5.301
  436    HB2  ASP  54           2HB      ASP  54  -2.166  -3.194  -7.920
  437    HB3  ASP  54           1HB      ASP  54  -0.526  -3.532  -7.375
  438    H    ILE  55           H        ILE  55  -2.259  -1.827  -4.978
  439    HA   ILE  55           HA       ILE  55  -5.173  -1.839  -4.957
  440    HB   ILE  55           HB       ILE  55  -3.858  -1.332  -2.854
  441   HG12  ILE  55          2HG1      ILE  55  -6.082   0.252  -4.012
  442   HG13  ILE  55          1HG1      ILE  55  -6.040  -0.729  -2.551
  443   HG21  ILE  55          1HG2      ILE  55  -3.334   1.236  -4.343
  444   HG22  ILE  55          2HG2      ILE  55  -2.132   0.058  -3.813
  445   HG23  ILE  55          3HG2      ILE  55  -3.044   0.985  -2.621
  446   HD11  ILE  55          3HD1      ILE  55  -6.348   1.732  -2.206
  447   HD12  ILE  55          1HD1      ILE  55  -4.691   1.944  -2.772
  448   HD13  ILE  55          2HD1      ILE  55  -5.012   1.004  -1.314
  449    HA   PRO  56           HA       PRO  56  -3.188   2.121  -7.410
  450    HB2  PRO  56           2HB      PRO  56  -2.415   0.069  -9.448
  451    HB3  PRO  56           1HB      PRO  56  -1.685   1.643  -9.106
  452    HG2  PRO  56           2HG      PRO  56  -0.559  -0.609  -8.225
  453    HG3  PRO  56           1HG      PRO  56  -0.557   0.867  -7.242
  454    HD2  PRO  56           2HD      PRO  56  -2.126  -1.626  -6.905
  455    HD3  PRO  56           1HD      PRO  56  -1.601  -0.446  -5.689
  456    H    ASP  57           H        ASP  57  -3.710   2.221 -10.075
  457    HA   ASP  57           HA       ASP  57  -5.379   2.351 -11.616
  458    HB2  ASP  57           2HB      ASP  57  -6.445  -0.117 -10.224
  459    HB3  ASP  57           1HB      ASP  57  -6.957   0.475 -11.801
  460    H    HIS  58           H        HIS  58  -7.965   2.316 -11.715
  461    HA   HIS  58           HA       HIS  58  -8.882   4.447 -10.245
  462    HB2  HIS  58           2HB      HIS  58 -11.189   3.624 -10.819
  463    HB3  HIS  58           1HB      HIS  58 -10.089   3.742 -12.189
  464    HD1  HIS  58           1HD      HIS  58 -12.659   1.837 -11.908
  465    HD2  HIS  58           2HD      HIS  58  -8.671   0.725 -11.557
  466    HE1  HIS  58           1HE      HIS  58 -12.601  -0.624 -12.420
  467    HE2  HIS  58           2HE      HIS  58 -10.189  -1.292 -12.118
  468    H    ASP  59           H        ASP  59  -8.333   1.285  -9.153
  469    HA   ASP  59           HA       ASP  59 -10.294   1.123  -7.120
  470    HB2  ASP  59           2HB      ASP  59  -7.661  -0.248  -6.813
  471    HB3  ASP  59           1HB      ASP  59  -9.284  -0.857  -6.504
  472    H    ALA  60           H        ALA  60  -6.903   2.170  -7.121
  473    HA   ALA  60           HA       ALA  60  -6.974   2.845  -4.329
  474    HB1  ALA  60           1HB      ALA  60  -4.889   3.249  -6.458
  475    HB2  ALA  60           2HB      ALA  60  -4.895   2.052  -5.163
  476    HB3  ALA  60           3HB      ALA  60  -4.684   3.760  -4.782
  477    H    GLU  61           H        GLU  61  -7.393   4.474  -7.359
  478    HA   GLU  61           HA       GLU  61  -7.147   7.120  -6.299
  479    HB2  GLU  61           2HB      GLU  61  -7.399   7.854  -8.450
  480    HB3  GLU  61           1HB      GLU  61  -6.901   6.199  -8.775
  481    HG2  GLU  61           2HG      GLU  61  -9.316   5.588  -8.936
  482    HG3  GLU  61           1HG      GLU  61  -9.696   7.307  -8.820
  483    H    LYS  62           H        LYS  62  -9.731   4.835  -6.788
  484    HA   LYS  62           HA       LYS  62 -11.866   6.695  -6.486
  485    HB2  LYS  62           2HB      LYS  62 -11.577   3.768  -6.718
  486    HB3  LYS  62           1HB      LYS  62 -12.982   4.312  -5.813
  487    HG2  LYS  62           2HG      LYS  62 -12.289   4.803  -8.681
  488    HG3  LYS  62           1HG      LYS  62 -13.760   4.113  -7.992
  489    HD2  LYS  62           2HD      LYS  62 -14.627   6.160  -8.290
  490    HD3  LYS  62           1HD      LYS  62 -13.706   6.593  -6.849
  491    HE2  LYS  62           2HE      LYS  62 -13.043   8.228  -8.332
  492    HE3  LYS  62           1HE      LYS  62 -11.778   7.020  -8.545
  493    HZ1  LYS  62           3HZ      LYS  62 -12.278   7.041 -10.691
  494    HZ2  LYS  62           1HZ      LYS  62 -13.639   8.015 -10.442
  495    HZ3  LYS  62           2HZ      LYS  62 -13.769   6.333 -10.319
  496    H    ILE  63           H        ILE  63  -9.603   5.722  -4.326
  497    HA   ILE  63           HA       ILE  63 -11.433   5.788  -2.048
  498    HB   ILE  63           HB       ILE  63  -9.506   3.970  -2.503
  499   HG12  ILE  63          2HG1      ILE  63  -9.632   4.549   0.346
  500   HG13  ILE  63          1HG1      ILE  63 -11.216   4.666  -0.415
  501   HG21  ILE  63          1HG2      ILE  63  -8.162   5.860  -0.597
  502   HG22  ILE  63          2HG2      ILE  63  -7.818   5.872  -2.327
  503   HG23  ILE  63          3HG2      ILE  63  -7.501   4.422  -1.374
  504   HD11  ILE  63          3HD1      ILE  63  -9.757   2.348   0.345
  505   HD12  ILE  63          1HD1      ILE  63 -10.003   2.326  -1.401
  506   HD13  ILE  63          2HD1      ILE  63 -11.387   2.470  -0.319
  507    H    GLN  64           H        GLN  64 -11.565   7.612  -0.920
  508    HA   GLN  64           HA       GLN  64  -9.316   9.465  -0.997
  509    HB2  GLN  64           2HB      GLN  64 -12.227  10.182  -0.669
  510    HB3  GLN  64           1HB      GLN  64 -10.884  11.307  -0.808
  511    HG2  GLN  64           2HG      GLN  64 -11.420  11.388  -2.965
  512    HG3  GLN  64           1HG      GLN  64 -10.608   9.827  -3.078
  513   HE21  GLN  64          1HE2      GLN  64 -11.977   7.910  -2.746
  514   HE22  GLN  64          2HE2      GLN  64 -13.602   7.953  -3.332
  515    H    SER  65           H        SER  65 -11.196   7.479   0.939
  516    HA   SER  65           HA       SER  65 -10.741   9.044   3.369
  517    HB2  SER  65           2HB      SER  65 -11.988   6.436   3.747
  518    HB3  SER  65           1HB      SER  65 -12.577   8.037   4.193
  519    HG   SER  65           HG       SER  65 -13.440   8.278   2.167
  520    H    ILE  66           H        ILE  66  -9.378   8.459   4.960
  521    HA   ILE  66           HA       ILE  66  -7.190   6.793   4.352
  522    HB   ILE  66           HB       ILE  66  -7.566   7.244   7.203
  523   HG12  ILE  66          2HG1      ILE  66  -8.918   9.122   6.511
  524   HG13  ILE  66          1HG1      ILE  66  -7.353   9.728   7.039
  525   HG21  ILE  66          1HG2      ILE  66  -5.384   6.874   6.643
  526   HG22  ILE  66          2HG2      ILE  66  -5.402   8.637   6.609
  527   HG23  ILE  66          3HG2      ILE  66  -5.518   7.724   5.104
  528   HD11  ILE  66          3HD1      ILE  66  -8.662   9.984   4.487
  529   HD12  ILE  66          1HD1      ILE  66  -7.044   9.303   4.319
  530   HD13  ILE  66          2HD1      ILE  66  -7.269  10.851   5.135
  531    HA   PRO  67           HA       PRO  67  -9.262   3.760   7.564
  532    HB2  PRO  67           2HB      PRO  67 -11.983   3.965   7.706
  533    HB3  PRO  67           1HB      PRO  67 -10.882   4.785   8.818
  534    HG2  PRO  67           2HG      PRO  67 -12.283   5.858   6.401
  535    HG3  PRO  67           1HG      PRO  67 -12.044   6.615   7.987
  536    HD2  PRO  67           2HD      PRO  67 -10.529   7.255   5.852
  537    HD3  PRO  67           1HD      PRO  67  -9.872   7.242   7.502
  538    H    ASP  68           H        ASP  68 -11.117   4.785   4.728
  539    HA   ASP  68           HA       ASP  68 -12.164   2.256   4.074
  540    HB2  ASP  68           2HB      ASP  68 -12.065   4.896   2.871
  541    HB3  ASP  68           1HB      ASP  68 -11.883   3.627   1.662
  542    H    ALA  69           H        ALA  69  -9.092   3.746   3.520
  543    HA   ALA  69           HA       ALA  69  -8.212   2.017   1.453
  544    HB1  ALA  69           1HB      ALA  69  -6.222   3.152   1.519
  545    HB2  ALA  69           2HB      ALA  69  -6.282   3.365   3.269
  546    HB3  ALA  69           3HB      ALA  69  -7.309   4.348   2.225
  547    H    VAL  70           H        VAL  70  -7.216   2.248   4.838
  548    HA   VAL  70           HA       VAL  70  -5.827  -0.205   4.862
  549    HB   VAL  70           HB       VAL  70  -5.646   1.770   6.517
  550   HG11  VAL  70          1HG1      VAL  70  -7.475   2.175   7.721
  551   HG12  VAL  70          2HG1      VAL  70  -7.111   0.696   8.611
  552   HG13  VAL  70          3HG1      VAL  70  -8.217   0.650   7.238
  553   HG21  VAL  70          3HG2      VAL  70  -5.693  -0.802   8.001
  554   HG22  VAL  70          1HG2      VAL  70  -4.437   0.434   7.914
  555   HG23  VAL  70          2HG2      VAL  70  -4.661  -0.691   6.574
  556    H    GLU  71           H        GLU  71  -9.150   0.569   5.105
  557    HA   GLU  71           HA       GLU  71 -10.053  -1.635   6.617
  558    HB2  GLU  71           2HB      GLU  71 -11.263   0.436   4.907
  559    HB3  GLU  71           1HB      GLU  71 -12.169  -1.067   4.998
  560    HG2  GLU  71           2HG      GLU  71 -11.364   0.716   7.279
  561    HG3  GLU  71           1HG      GLU  71 -12.992   0.416   6.671
  562    H    TYR  72           H        TYR  72  -9.876  -1.097   3.104
  563    HA   TYR  72           HA       TYR  72 -10.836  -3.626   2.358
  564    HB2  TYR  72           2HB      TYR  72 -10.547  -2.894   0.238
  565    HB3  TYR  72           1HB      TYR  72 -10.208  -1.348   1.009
  566    HD1  TYR  72           2HD      TYR  72  -8.411  -4.488   0.059
  567    HD2  TYR  72           1HD      TYR  72  -8.279  -0.249   0.385
  568    HE1  TYR  72           2HE      TYR  72  -6.167  -4.487  -0.947
  569    HE2  TYR  72           1HE      TYR  72  -6.035  -0.235  -0.622
  570    HH   TYR  72           HH       TYR  72  -4.339  -3.241  -1.373
  571    H    ILE  73           H        ILE  73  -7.560  -2.408   2.774
  572    HA   ILE  73           HA       ILE  73  -6.217  -4.760   2.037
  573    HB   ILE  73           HB       ILE  73  -5.265  -2.652   3.935
  574   HG12  ILE  73          2HG1      ILE  73  -4.338  -2.687   1.129
  575   HG13  ILE  73          1HG1      ILE  73  -6.012  -2.202   1.375
  576   HG21  ILE  73          1HG2      ILE  73  -3.495  -4.307   2.201
  577   HG22  ILE  73          2HG2      ILE  73  -4.084  -4.955   3.731
  578   HG23  ILE  73          3HG2      ILE  73  -3.123  -3.476   3.712
  579   HD11  ILE  73          3HD1      ILE  73  -4.185  -0.893   3.212
  580   HD12  ILE  73          1HD1      ILE  73  -5.417  -0.208   2.155
  581   HD13  ILE  73          2HD1      ILE  73  -3.813  -0.570   1.519
  582    H    ALA  74           H        ALA  74  -7.548  -3.670   5.068
  583    HA   ALA  74           HA       ALA  74  -6.337  -5.594   6.730
  584    HB1  ALA  74           1HB      ALA  74  -8.633  -3.738   6.972
  585    HB2  ALA  74           2HB      ALA  74  -7.213  -3.923   8.002
  586    HB3  ALA  74           3HB      ALA  74  -8.541  -5.079   8.113
  587    H    GLN  75           H        GLN  75  -9.496  -5.503   5.168
  588    HA   GLN  75           HA       GLN  75 -10.166  -8.151   6.002
  589    HB2  GLN  75           2HB      GLN  75 -11.481  -5.998   4.460
  590    HB3  GLN  75           1HB      GLN  75 -11.995  -7.640   4.102
  591    HG2  GLN  75           2HG      GLN  75 -13.438  -6.661   5.763
  592    HG3  GLN  75           1HG      GLN  75 -12.512  -7.980   6.472
  593   HE21  GLN  75          1HE2      GLN  75 -11.035  -4.949   5.786
  594   HE22  GLN  75          2HE2      GLN  75 -10.886  -4.412   7.418
  595    H    ASN  76           H        ASN  76 -10.425  -6.996   2.698
  596    HA   ASN  76           HA       ASN  76 -10.221  -9.147   1.226
  597    HB2  ASN  76           2HB      ASN  76  -8.966  -6.493   0.906
  598    HB3  ASN  76           1HB      ASN  76  -8.297  -7.765  -0.114
  599   HD21  ASN  76          1HD2      ASN  76 -10.371  -5.338  -0.165
  600   HD22  ASN  76          2HD2      ASN  76 -11.554  -5.934  -1.273
  601    HA   PRO  77           HA       PRO  77  -5.407  -9.841   1.506
  602    HB2  PRO  77           2HB      PRO  77  -4.785  -7.993   3.759
  603    HB3  PRO  77           1HB      PRO  77  -3.832  -8.376   2.321
  604    HG2  PRO  77           2HG      PRO  77  -5.113  -6.060   2.487
  605    HG3  PRO  77           1HG      PRO  77  -5.077  -6.959   0.959
  606    HD2  PRO  77           2HD      PRO  77  -7.292  -6.720   2.962
  607    HD3  PRO  77           1HD      PRO  77  -7.366  -6.732   1.188
  608    H    MET  78           H        MET  78  -7.164  -9.041   4.505
  609    HA   MET  78           HA       MET  78  -5.866 -10.982   6.105
  610    HB2  MET  78           2HB      MET  78  -6.968  -9.281   7.290
  611    HB3  MET  78           1HB      MET  78  -8.448  -9.470   6.361
  612    HG2  MET  78           2HG      MET  78  -8.451 -11.855   7.446
  613    HG3  MET  78           1HG      MET  78  -7.422 -11.072   8.644
  614    HE1  MET  78           3HE      MET  78 -11.900 -10.564   8.023
  615    HE2  MET  78           1HE      MET  78 -10.836 -11.831   7.413
  616    HE3  MET  78           2HE      MET  78 -10.846 -10.242   6.646
  617    H    ALA  79           H        ALA  79  -8.269 -11.214   3.692
  618    HA   ALA  79           HA       ALA  79  -9.368 -13.692   4.640
  619    HB1  ALA  79           1HB      ALA  79 -10.336 -11.700   3.029
  620    HB2  ALA  79           2HB      ALA  79 -11.060 -13.294   3.240
  621    HB3  ALA  79           3HB      ALA  79  -9.974 -12.992   1.884
  622    H    LYS  80           H        LYS  80  -7.059 -12.600   2.273
  623    HA   LYS  80           HA       LYS  80  -6.784 -14.984   0.812
  624    HB2  LYS  80           2HB      LYS  80  -4.473 -14.037   0.274
  625    HB3  LYS  80           1HB      LYS  80  -5.862 -13.054  -0.169
  626    HG2  LYS  80           2HG      LYS  80  -5.511 -11.573   1.636
  627    HG3  LYS  80           1HG      LYS  80  -4.343 -12.660   2.392
  628    HD2  LYS  80           2HD      LYS  80  -2.819 -12.321   0.498
  629    HD3  LYS  80           1HD      LYS  80  -3.985 -11.217  -0.235
  630    HE2  LYS  80           2HE      LYS  80  -2.768  -9.645   0.828
  631    HE3  LYS  80           1HE      LYS  80  -3.750 -10.115   2.215
  632    HZ1  LYS  80           3HZ      LYS  80  -1.652 -11.889   2.174
  633    HZ2  LYS  80           1HZ      LYS  80  -1.853 -10.587   3.236
  634    HZ3  LYS  80           2HZ      LYS  80  -0.948 -10.392   1.820
  635   H282  PNS 101          8H2       PNS 101   1.952  15.123 -11.133
  636   H281  PNS 101          9H2       PNS 101   1.538  13.419 -11.346
  637   H303  PNS 101          0H3       PNS 101   5.243  14.451  -9.605
  638   H302  PNS 101          1H3       PNS 101   3.718  14.956  -8.880
  639   H301  PNS 101          2H3       PNS 101   4.288  15.727 -10.360
  640   H313  PNS 101          3H3       PNS 101   2.717  11.881 -10.045
  641   H312  PNS 101          4H3       PNS 101   3.925  12.541  -8.941
  642   H311  PNS 101          5H3       PNS 101   4.425  11.851 -10.485
  643    H32  PNS 101           6H3      PNS 101   3.277  13.238 -12.538
  644    H33  PNS 101           7H3      PNS 101   3.817  15.663 -12.111
  645    H36  PNS 101           8H3      PNS 101   5.878  12.928 -10.505
  646   H372  PNS 101          9H3       PNS 101   7.665  11.806 -12.452
  647   H371  PNS 101          0H4       PNS 101   8.076  12.375 -10.835
  648   H382  PNS 101          1H4       PNS 101   7.876  14.717 -11.716
  649   H381  PNS 101          2H4       PNS 101   9.218  13.775 -12.367
  650    H41  PNS 101           3H4      PNS 101   5.702  14.497 -13.499
  651   H422  PNS 101          4H4       PNS 101   7.115  16.558 -14.848
  652   H421  PNS 101          5H4       PNS 101   5.567  16.708 -14.017
  653   H431  PNS 101          7H4       PNS 101   6.989  18.148 -12.841
  654   H432  PNS 101          6H4       PNS 101   6.955  16.682 -11.851
  655    H44  PNS 101           8H4      PNS 101   9.274  16.569 -13.762
  Start of MODEL   13
    1    H1   MET   1           1HT      MET   1  -3.584  -9.364   8.516
    2    H2   MET   1           2HT      MET   1  -4.461 -10.522   9.431
    3    H3   MET   1           3HT      MET   1  -3.109  -9.723  10.124
    4    HA   MET   1           HA       MET   1  -5.405  -8.207   9.148
    5    HB2  MET   1           2HB      MET   1  -5.872  -8.417  11.815
    6    HB3  MET   1           1HB      MET   1  -6.667  -9.404  10.596
    7    HG2  MET   1           2HG      MET   1  -5.747 -11.260  11.376
    8    HG3  MET   1           1HG      MET   1  -4.135 -10.545  11.371
    9    HE1  MET   1           2HE      MET   1  -4.388 -12.521  13.989
   10    HE2  MET   1           3HE      MET   1  -3.476 -11.281  14.851
   11    HE3  MET   1           1HE      MET   1  -3.180 -11.560  13.135
   12    H    ASN   2           H        ASN   2  -3.603  -8.452  12.197
   13    HA   ASN   2           HA       ASN   2  -3.215  -5.641  12.318
   14    HB2  ASN   2           2HB      ASN   2  -1.876  -7.783  13.972
   15    HB3  ASN   2           1HB      ASN   2  -1.972  -6.067  14.361
   16   HD21  ASN   2          1HD2      ASN   2  -3.285  -5.832  16.017
   17   HD22  ASN   2          2HD2      ASN   2  -4.831  -6.580  16.205
   18    H    ASP   3           H        ASP   3  -1.295  -8.327  11.237
   19    HA   ASP   3           HA       ASP   3   1.230  -7.133  11.237
   20    HB2  ASP   3           2HB      ASP   3   1.808  -8.811   9.490
   21    HB3  ASP   3           1HB      ASP   3   0.997  -9.511  10.888
   22    H    VAL   4           H        VAL   4  -1.344  -7.036   8.860
   23    HA   VAL   4           HA       VAL   4   0.149  -5.688   6.855
   24    HB   VAL   4           HB       VAL   4  -2.115  -5.169   5.877
   25   HG11  VAL   4          1HG1      VAL   4  -1.272  -7.037   4.898
   26   HG12  VAL   4          2HG1      VAL   4  -2.644  -7.774   5.727
   27   HG13  VAL   4          3HG1      VAL   4  -1.030  -7.869   6.434
   28   HG21  VAL   4          3HG2      VAL   4  -4.055  -6.282   6.852
   29   HG22  VAL   4          1HG2      VAL   4  -3.368  -5.110   7.976
   30   HG23  VAL   4          2HG2      VAL   4  -3.068  -6.833   8.206
   31    H    LEU   5           H        LEU   5  -2.263  -4.563   9.211
   32    HA   LEU   5           HA       LEU   5  -2.144  -1.855   8.455
   33    HB2  LEU   5           2HB      LEU   5  -3.486  -3.453  10.422
   34    HB3  LEU   5           1HB      LEU   5  -2.906  -1.968  11.148
   35    HG   LEU   5           HG       LEU   5  -4.046  -0.909   8.987
   36   HD11  LEU   5          1HD1      LEU   5  -5.029  -3.655   9.095
   37   HD12  LEU   5          2HD1      LEU   5  -5.105  -2.471   7.789
   38   HD13  LEU   5          3HD1      LEU   5  -6.311  -2.443   9.076
   39   HD21  LEU   5          3HD2      LEU   5  -5.973  -0.425  10.344
   40   HD22  LEU   5          1HD2      LEU   5  -4.536  -0.422  11.367
   41   HD23  LEU   5          2HD2      LEU   5  -5.632  -1.803  11.389
   42    H    THR   6           H        THR   6  -0.368  -3.757  10.770
   43    HA   THR   6           HA       THR   6   0.807  -1.671  12.219
   44    HB   THR   6           HB       THR   6   0.908  -4.462  12.248
   45    HG1  THR   6           1HG      THR   6   2.395  -2.698  13.884
   46   HG21  THR   6          3HG2      THR   6   3.435  -4.648  12.764
   47   HG22  THR   6          1HG2      THR   6   3.576  -3.271  11.670
   48   HG23  THR   6          2HG2      THR   6   2.873  -4.784  11.097
   49    H    ARG   7           H        ARG   7   2.238  -3.627   9.639
   50    HA   ARG   7           HA       ARG   7   4.500  -1.912   9.405
   51    HB2  ARG   7           2HB      ARG   7   4.496  -4.397   8.958
   52    HB3  ARG   7           1HB      ARG   7   3.634  -4.050   7.466
   53    HG2  ARG   7           2HG      ARG   7   5.889  -2.360   7.520
   54    HG3  ARG   7           1HG      ARG   7   6.433  -3.975   7.982
   55    HD2  ARG   7           2HD      ARG   7   4.637  -3.574   5.618
   56    HD3  ARG   7           1HD      ARG   7   6.377  -3.336   5.476
   57    HE   ARG   7           HE       ARG   7   5.375  -5.871   6.548
   58   HH11  ARG   7          1HH1      ARG   7   6.941  -4.087   4.001
   59   HH12  ARG   7          2HH1      ARG   7   7.547  -5.501   3.205
   60   HH21  ARG   7          1HH2      ARG   7   6.169  -7.740   5.510
   61   HH22  ARG   7          2HH2      ARG   7   7.108  -7.578   4.063
   62    H    VAL   8           H        VAL   8   1.556  -2.479   7.570
   63    HA   VAL   8           HA       VAL   8   2.195  -0.840   5.377
   64    HB   VAL   8           HB       VAL   8   0.285  -2.585   5.652
   65   HG11  VAL   8          1HG1      VAL   8  -1.879  -1.672   6.189
   66   HG12  VAL   8          2HG1      VAL   8  -1.182  -0.072   6.441
   67   HG13  VAL   8          3HG1      VAL   8  -0.783  -1.391   7.541
   68   HG21  VAL   8          3HG2      VAL   8  -1.056  -0.684   4.101
   69   HG22  VAL   8          1HG2      VAL   8   0.063  -1.929   3.544
   70   HG23  VAL   8          2HG2      VAL   8   0.661  -0.314   3.931
   71    H    LEU   9           H        LEU   9   0.216  -0.195   8.276
   72    HA   LEU   9           HA       LEU   9  -0.409   2.468   7.647
   73    HB2  LEU   9           2HB      LEU   9  -1.430   2.513   9.660
   74    HB3  LEU   9           1HB      LEU   9  -1.136   0.792   9.621
   75    HG   LEU   9           HG       LEU   9   1.139   1.552  10.796
   76   HD11  LEU   9          1HD1      LEU   9   0.747   3.899  10.786
   77   HD12  LEU   9          2HD1      LEU   9   0.570   3.336  12.448
   78   HD13  LEU   9          3HD1      LEU   9  -0.861   3.691  11.480
   79   HD21  LEU   9          3HD2      LEU   9  -0.003   1.128  12.967
   80   HD22  LEU   9          1HD2      LEU   9  -0.335  -0.077  11.724
   81   HD23  LEU   9          2HD2      LEU   9  -1.542   1.152  12.104
   82    H    GLU  10           H        GLU  10   2.267   1.103   9.516
   83    HA   GLU  10           HA       GLU  10   3.462   3.558  10.211
   84    HB2  GLU  10           2HB      GLU  10   5.342   2.270  10.932
   85    HB3  GLU  10           1HB      GLU  10   3.892   1.355  11.323
   86    HG2  GLU  10           2HG      GLU  10   4.393  -0.310   9.898
   87    HG3  GLU  10           1HG      GLU  10   5.105   0.775   8.705
   88    H    VAL  11           H        VAL  11   3.724   1.489   7.431
   89    HA   VAL  11           HA       VAL  11   6.073   2.422   6.309
   90    HB   VAL  11           HB       VAL  11   3.631   1.269   5.111
   91   HG11  VAL  11          1HG1      VAL  11   5.717   1.243   3.200
   92   HG12  VAL  11          2HG1      VAL  11   5.473   2.908   3.723
   93   HG13  VAL  11          3HG1      VAL  11   4.122   1.982   3.070
   94   HG21  VAL  11          3HG2      VAL  11   6.330   0.094   4.831
   95   HG22  VAL  11          1HG2      VAL  11   4.769  -0.697   5.041
   96   HG23  VAL  11          2HG2      VAL  11   5.573   0.050   6.422
   97    H    VAL  12           H        VAL  12   2.788   3.565   5.748
   98    HA   VAL  12           HA       VAL  12   3.526   5.612   3.934
   99    HB   VAL  12           HB       VAL  12   1.313   6.190   3.841
  100   HG11  VAL  12          1HG1      VAL  12   0.433   4.202   3.381
  101   HG12  VAL  12          2HG1      VAL  12   0.360   3.776   5.090
  102   HG13  VAL  12          3HG1      VAL  12   1.829   3.467   4.167
  103   HG21  VAL  12          3HG2      VAL  12   0.944   5.370   6.720
  104   HG22  VAL  12          1HG2      VAL  12  -0.244   6.167   5.690
  105   HG23  VAL  12          2HG2      VAL  12   1.224   7.019   6.165
  106    H    LYS  13           H        LYS  13   2.600   5.739   7.370
  107    HA   LYS  13           HA       LYS  13   2.943   8.503   7.694
  108    HB2  LYS  13           2HB      LYS  13   3.358   6.450   9.859
  109    HB3  LYS  13           1HB      LYS  13   2.796   8.106  10.035
  110    HG2  LYS  13           2HG      LYS  13   0.707   7.573   8.989
  111    HG3  LYS  13           1HG      LYS  13   1.277   5.944   8.592
  112    HD2  LYS  13           2HD      LYS  13   1.511   5.495  11.019
  113    HD3  LYS  13           1HD      LYS  13   0.808   7.080  11.350
  114    HE2  LYS  13           2HE      LYS  13  -0.509   4.753   9.957
  115    HE3  LYS  13           1HE      LYS  13  -0.916   5.420  11.538
  116    HZ1  LYS  13           3HZ      LYS  13  -1.147   6.910   8.979
  117    HZ2  LYS  13           1HZ      LYS  13  -1.661   7.432  10.504
  118    HZ3  LYS  13           2HZ      LYS  13  -2.435   6.131   9.751
  119    H    ASN  14           H        ASN  14   5.258   5.902   7.710
  120    HA   ASN  14           HA       ASN  14   7.324   7.674   8.721
  121    HB2  ASN  14           2HB      ASN  14   7.498   4.714   8.161
  122    HB3  ASN  14           1HB      ASN  14   8.699   5.692   8.998
  123   HD21  ASN  14          1HD2      ASN  14   6.495   3.449   9.528
  124   HD22  ASN  14          2HD2      ASN  14   5.954   3.877  11.110
  125    H    PHE  15           H        PHE  15   6.022   6.879   5.838
  126    HA   PHE  15           HA       PHE  15   8.525   6.856   4.384
  127    HB2  PHE  15           2HB      PHE  15   7.319   5.262   3.328
  128    HB3  PHE  15           1HB      PHE  15   5.785   5.937   3.858
  129    HD1  PHE  15           1HD      PHE  15   8.568   7.111   1.660
  130    HD2  PHE  15           2HD      PHE  15   4.403   6.422   2.145
  131    HE1  PHE  15           1HE      PHE  15   8.171   7.982  -0.607
  132    HE2  PHE  15           2HE      PHE  15   3.989   7.292  -0.124
  133    HZ   PHE  15           HZ       PHE  15   5.877   8.073  -1.502
  134    H    GLU  16           H        GLU  16   6.470   9.108   5.581
  135    HA   GLU  16           HA       GLU  16   6.864  11.419   5.258
  136    HB2  GLU  16           2HB      GLU  16   7.874  12.271   3.375
  137    HB3  GLU  16           1HB      GLU  16   8.509  10.634   3.369
  138    HG2  GLU  16           2HG      GLU  16   7.659  10.273   1.373
  139    HG3  GLU  16           1HG      GLU  16   6.046  10.671   1.954
  140    H    LYS  17           H        LYS  17   4.455   9.827   5.208
  141    HA   LYS  17           HA       LYS  17   2.804  10.988   3.153
  142    HB2  LYS  17           2HB      LYS  17   2.536   8.813   5.112
  143    HB3  LYS  17           1HB      LYS  17   1.057   9.706   4.794
  144    HG2  LYS  17           2HG      LYS  17   1.171   7.803   3.338
  145    HG3  LYS  17           1HG      LYS  17   1.349   9.276   2.385
  146    HD2  LYS  17           2HD      LYS  17   3.774   7.841   3.390
  147    HD3  LYS  17           1HD      LYS  17   2.934   7.258   1.951
  148    HE2  LYS  17           2HE      LYS  17   3.774  10.125   2.237
  149    HE3  LYS  17           1HE      LYS  17   4.877   8.897   1.625
  150    HZ1  LYS  17           3HZ      LYS  17   3.918   9.024  -0.352
  151    HZ2  LYS  17           1HZ      LYS  17   2.949  10.293   0.208
  152    HZ3  LYS  17           2HZ      LYS  17   2.393   8.699   0.300
  153    H    VAL  18           H        VAL  18   2.948  11.041   6.706
  154    HA   VAL  18           HA       VAL  18   2.430  13.749   6.990
  155    HB   VAL  18           HB       VAL  18  -0.059  13.072   7.985
  156   HG11  VAL  18          1HG1      VAL  18   0.554  15.163   6.889
  157   HG12  VAL  18          2HG1      VAL  18  -0.914  14.488   6.182
  158   HG13  VAL  18          3HG1      VAL  18   0.624  14.336   5.332
  159   HG21  VAL  18          3HG2      VAL  18  -1.085  11.534   6.733
  160   HG22  VAL  18          1HG2      VAL  18   0.527  11.058   6.198
  161   HG23  VAL  18          2HG2      VAL  18  -0.424  12.190   5.236
  162    H    ASP  19           H        ASP  19   2.008  14.389   9.209
  163    HA   ASP  19           HA       ASP  19   3.280  12.673  11.071
  164    HB2  ASP  19           2HB      ASP  19   2.657  15.408  10.920
  165    HB3  ASP  19           1HB      ASP  19   1.814  14.810  12.346
  166    H    ALA  20           H        ALA  20   2.420  11.135  12.312
  167    HA   ALA  20           HA       ALA  20  -0.236  10.322  12.141
  168    HB1  ALA  20           1HB      ALA  20   0.291   8.959  14.194
  169    HB2  ALA  20           2HB      ALA  20   1.873   9.739  14.205
  170    HB3  ALA  20           3HB      ALA  20   1.391   8.743  12.832
  171    H    SER  21           H        SER  21   1.216  12.754  14.086
  172    HA   SER  21           HA       SER  21  -0.692  12.845  16.170
  173    HB2  SER  21           2HB      SER  21   0.336  15.436  15.868
  174    HB3  SER  21           1HB      SER  21   0.924  14.183  16.960
  175    HG   SER  21           HG       SER  21   2.415  13.570  15.445
  176    H    LYS  22           H        LYS  22  -1.033  13.510  12.934
  177    HA   LYS  22           HA       LYS  22  -3.240  15.366  13.441
  178    HB2  LYS  22           2HB      LYS  22  -2.032  16.692  12.058
  179    HB3  LYS  22           1HB      LYS  22  -1.139  15.338  11.378
  180    HG2  LYS  22           2HG      LYS  22  -4.009  15.789  10.668
  181    HG3  LYS  22           1HG      LYS  22  -2.717  16.674   9.855
  182    HD2  LYS  22           2HD      LYS  22  -2.869  13.669  10.053
  183    HD3  LYS  22           1HD      LYS  22  -3.416  14.607   8.663
  184    HE2  LYS  22           2HE      LYS  22  -0.715  13.854   9.480
  185    HE3  LYS  22           1HE      LYS  22  -1.336  14.296   7.891
  186    HZ1  LYS  22           3HZ      LYS  22  -0.322  16.061  10.029
  187    HZ2  LYS  22           1HZ      LYS  22  -1.339  16.662   8.817
  188    HZ3  LYS  22           2HZ      LYS  22   0.154  15.981   8.408
  189    H    VAL  23           H        VAL  23  -2.353  12.295  12.299
  190    HA   VAL  23           HA       VAL  23  -4.600  11.936  10.544
  191    HB   VAL  23           HB       VAL  23  -3.883   9.594  10.401
  192   HG11  VAL  23          1HG1      VAL  23  -2.109  10.024   9.033
  193   HG12  VAL  23          2HG1      VAL  23  -1.333  11.103  10.192
  194   HG13  VAL  23          3HG1      VAL  23  -2.711  11.668   9.248
  195   HG21  VAL  23          3HG2      VAL  23  -1.923  10.420  12.534
  196   HG22  VAL  23          1HG2      VAL  23  -1.739   8.964  11.554
  197   HG23  VAL  23          2HG2      VAL  23  -3.137   9.143  12.614
  198    H    THR  24           H        THR  24  -6.585  11.365  11.120
  199    HA   THR  24           HA       THR  24  -6.998  10.205  13.761
  200    HB   THR  24           HB       THR  24  -8.119  12.516  12.624
  201    HG1  THR  24           1HG      THR  24  -8.671  12.782  14.637
  202   HG21  THR  24          3HG2      THR  24 -10.331  12.208  12.255
  203   HG22  THR  24          1HG2      THR  24 -10.417  10.769  13.273
  204   HG23  THR  24          2HG2      THR  24  -9.730  10.664  11.653
  205    HA   PRO  25           HA       PRO  25  -8.985   6.616  12.183
  206    HB2  PRO  25           2HB      PRO  25 -11.514   6.673  13.286
  207    HB3  PRO  25           1HB      PRO  25 -10.064   6.125  14.131
  208    HG2  PRO  25           2HG      PRO  25 -11.441   8.776  14.249
  209    HG3  PRO  25           1HG      PRO  25 -10.708   7.833  15.560
  210    HD2  PRO  25           2HD      PRO  25  -9.459   9.952  14.484
  211    HD3  PRO  25           1HD      PRO  25  -8.559   8.518  15.019
  212    H    GLU  26           H        GLU  26 -10.988   9.520  12.006
  213    HA   GLU  26           HA       GLU  26 -12.242   8.499   9.574
  214    HB2  GLU  26           2HB      GLU  26 -13.969  10.145   9.896
  215    HB3  GLU  26           1HB      GLU  26 -13.735   9.277  11.407
  216    HG2  GLU  26           2HG      GLU  26 -12.514  11.105  12.345
  217    HG3  GLU  26           1HG      GLU  26 -12.505  11.954  10.799
  218    H    SER  27           H        SER  27  -9.528   9.902  10.134
  219    HA   SER  27           HA       SER  27  -9.574  12.386   8.814
  220    HB2  SER  27           2HB      SER  27  -7.620  12.218   9.971
  221    HB3  SER  27           1HB      SER  27  -7.494  10.479   9.710
  222    HG   SER  27           HG       SER  27  -5.961  11.185   8.400
  223    H    HIS  28           H        HIS  28  -9.483  12.946   6.728
  224    HA   HIS  28           HA       HIS  28  -9.837  10.921   4.736
  225    HB2  HIS  28           2HB      HIS  28 -10.124  13.848   4.893
  226    HB3  HIS  28           1HB      HIS  28  -9.610  13.239   3.323
  227    HD1  HIS  28           1HD      HIS  28 -11.309  11.842   1.978
  228    HD2  HIS  28           2HD      HIS  28 -12.743  13.176   5.644
  229    HE1  HIS  28           1HE      HIS  28 -13.790  11.441   1.915
  230    HE2  HIS  28           2HE      HIS  28 -14.624  12.177   4.177
  231    H    PHE  29           H        PHE  29  -8.486  10.556   2.927
  232    HA   PHE  29           HA       PHE  29  -5.722  10.609   3.495
  233    HB2  PHE  29           2HB      PHE  29  -6.974   8.930   2.044
  234    HB3  PHE  29           1HB      PHE  29  -6.922  10.147   0.773
  235    HD1  PHE  29           2HD      PHE  29  -4.352  11.248   0.739
  236    HD2  PHE  29           1HD      PHE  29  -5.463   7.254   1.700
  237    HE1  PHE  29           2HE      PHE  29  -2.110  10.472   0.089
  238    HE2  PHE  29           1HE      PHE  29  -3.221   6.471   1.053
  239    HZ   PHE  29           HZ       PHE  29  -1.542   8.081   0.246
  240    H    VAL  30           H        VAL  30  -7.058  11.837   0.487
  241    HA   VAL  30           HA       VAL  30  -5.008  13.715   0.108
  242    HB   VAL  30           HB       VAL  30  -6.668  14.713  -1.602
  243   HG11  VAL  30          1HG1      VAL  30  -4.786  13.236  -2.161
  244   HG12  VAL  30          2HG1      VAL  30  -6.189  12.935  -3.185
  245   HG13  VAL  30          3HG1      VAL  30  -5.811  11.833  -1.862
  246   HG21  VAL  30          3HG2      VAL  30  -8.400  12.985  -0.217
  247   HG22  VAL  30          1HG2      VAL  30  -8.158  12.276  -1.813
  248   HG23  VAL  30          2HG2      VAL  30  -8.746  13.932  -1.664
  249    H    LYS  31           H        LYS  31  -8.115  13.930   1.623
  250    HA   LYS  31           HA       LYS  31  -8.238  16.765   1.723
  251    HB2  LYS  31           2HB      LYS  31  -9.688  15.043   3.687
  252    HB3  LYS  31           1HB      LYS  31 -10.227  16.510   2.883
  253    HG2  LYS  31           2HG      LYS  31 -10.306  15.205   0.748
  254    HG3  LYS  31           1HG      LYS  31  -9.996  13.754   1.703
  255    HD2  LYS  31           2HD      LYS  31 -12.297  13.739   1.593
  256    HD3  LYS  31           1HD      LYS  31 -12.030  14.599   3.111
  257    HE2  LYS  31           2HE      LYS  31 -13.180  16.323   2.318
  258    HE3  LYS  31           1HE      LYS  31 -11.980  16.521   1.042
  259    HZ1  LYS  31           3HZ      LYS  31 -13.217  15.038  -0.357
  260    HZ2  LYS  31           1HZ      LYS  31 -14.261  16.247   0.200
  261    HZ3  LYS  31           2HZ      LYS  31 -14.319  14.699   0.879
  262    H    ASP  32           H        ASP  32  -6.828  14.321   3.771
  263    HA   ASP  32           HA       ASP  32  -6.451  16.146   5.964
  264    HB2  ASP  32           2HB      ASP  32  -6.945  13.752   6.364
  265    HB3  ASP  32           1HB      ASP  32  -5.401  13.337   5.625
  266    H    LEU  33           H        LEU  33  -4.960  15.823   3.090
  267    HA   LEU  33           HA       LEU  33  -3.046  17.411   2.879
  268    HB2  LEU  33           2HB      LEU  33  -2.103  15.629   5.108
  269    HB3  LEU  33           1HB      LEU  33  -0.968  16.523   4.117
  270    HG   LEU  33           HG       LEU  33  -3.163  18.119   5.279
  271   HD11  LEU  33          1HD1      LEU  33  -0.968  17.657   7.170
  272   HD12  LEU  33          2HD1      LEU  33  -2.083  16.304   6.977
  273   HD13  LEU  33          3HD1      LEU  33  -2.692  17.887   7.460
  274   HD21  LEU  33          3HD2      LEU  33  -0.175  18.490   5.098
  275   HD22  LEU  33          1HD2      LEU  33  -1.341  19.706   5.619
  276   HD23  LEU  33          2HD2      LEU  33  -1.366  19.114   3.958
  277    H    GLY  34           H        GLY  34  -4.224  14.938   1.708
  278    HA2  GLY  34           2HA      GLY  34  -2.934  12.875   0.874
  279    HA3  GLY  34           1HA      GLY  34  -3.478  14.002  -0.359
  280    H    LEU  35           H        LEU  35  -1.077  12.143  -0.008
  281    HA   LEU  35           HA       LEU  35   1.153  13.969  -0.086
  282    HB2  LEU  35           2HB      LEU  35   1.457  11.127  -0.885
  283    HB3  LEU  35           1HB      LEU  35   2.512  12.135   0.087
  284    HG   LEU  35           HG       LEU  35   1.773  10.814   1.760
  285   HD11  LEU  35          1HD1      LEU  35   0.424  12.033   3.085
  286   HD12  LEU  35          2HD1      LEU  35  -0.850  12.140   1.870
  287   HD13  LEU  35          3HD1      LEU  35   0.544  13.215   1.781
  288   HD21  LEU  35          3HD2      LEU  35   0.596   9.120   0.831
  289   HD22  LEU  35          1HD2      LEU  35  -0.403  10.200  -0.143
  290   HD23  LEU  35          2HD2      LEU  35  -0.762   9.970   1.568
  291    H    ASN  36           H        ASN  36   2.635  14.089  -1.893
  292    HA   ASN  36           HA       ASN  36   1.494  14.762  -4.294
  293    HB2  ASN  36           2HB      ASN  36   4.003  13.879  -5.055
  294    HB3  ASN  36           1HB      ASN  36   3.615  15.484  -4.458
  295   HD21  ASN  36          1HD2      ASN  36   4.303  12.257  -3.243
  296   HD22  ASN  36          2HD2      ASN  36   5.312  12.764  -1.934
  297    H    SER  37           H        SER  37   2.308  13.605  -6.456
  298    HA   SER  37           HA       SER  37   0.769  11.264  -6.679
  299    HB2  SER  37           2HB      SER  37   2.489  11.308  -8.886
  300    HB3  SER  37           1HB      SER  37   0.858  11.974  -8.802
  301    H    LEU  38           H        LEU  38   4.249  11.637  -7.159
  302    HA   LEU  38           HA       LEU  38   4.928   8.979  -7.335
  303    HB2  LEU  38           2HB      LEU  38   7.158   9.605  -6.954
  304    HB3  LEU  38           1HB      LEU  38   6.405  10.989  -7.709
  305    HG   LEU  38           HG       LEU  38   7.751  10.798  -5.182
  306   HD11  LEU  38          1HD1      LEU  38   6.633  13.226  -6.546
  307   HD12  LEU  38          2HD1      LEU  38   8.099  12.410  -7.089
  308   HD13  LEU  38          3HD1      LEU  38   8.031  13.121  -5.476
  309   HD21  LEU  38          3HD2      LEU  38   5.846  10.765  -3.922
  310   HD22  LEU  38          1HD2      LEU  38   4.882  11.564  -5.165
  311   HD23  LEU  38          2HD2      LEU  38   6.009  12.501  -4.184
  312    H    ASP  39           H        ASP  39   3.686  10.574  -4.626
  313    HA   ASP  39           HA       ASP  39   4.948   8.958  -2.620
  314    HB2  ASP  39           2HB      ASP  39   3.052  11.176  -2.690
  315    HB3  ASP  39           1HB      ASP  39   2.650   9.975  -1.467
  316    H    VAL  40           H        VAL  40   1.492   9.262  -2.604
  317    HA   VAL  40           HA       VAL  40   0.782   6.853  -1.710
  318    HB   VAL  40           HB       VAL  40  -0.698   8.839  -2.628
  319   HG11  VAL  40          1HG1      VAL  40  -0.079   7.496  -5.007
  320   HG12  VAL  40          2HG1      VAL  40  -1.264   8.781  -4.777
  321   HG13  VAL  40          3HG1      VAL  40  -1.759   7.094  -4.651
  322   HG21  VAL  40          3HG2      VAL  40  -2.175   7.641  -1.480
  323   HG22  VAL  40          1HG2      VAL  40  -1.172   6.201  -1.665
  324   HG23  VAL  40          2HG2      VAL  40  -2.399   6.586  -2.875
  325    H    VAL  41           H        VAL  41   1.966   7.489  -4.936
  326    HA   VAL  41           HA       VAL  41   1.179   5.047  -6.112
  327    HB   VAL  41           HB       VAL  41   1.801   6.705  -7.643
  328   HG11  VAL  41          1HG1      VAL  41   3.391   8.248  -7.340
  329   HG12  VAL  41          2HG1      VAL  41   4.610   7.045  -6.918
  330   HG13  VAL  41          3HG1      VAL  41   3.480   7.624  -5.693
  331   HG21  VAL  41          3HG2      VAL  41   3.698   4.440  -7.423
  332   HG22  VAL  41          1HG2      VAL  41   4.098   5.723  -8.564
  333   HG23  VAL  41          2HG2      VAL  41   2.571   4.855  -8.714
  334    H    GLU  42           H        GLU  42   4.278   6.064  -4.665
  335    HA   GLU  42           HA       GLU  42   5.590   3.610  -5.019
  336    HB2  GLU  42           2HB      GLU  42   7.334   4.573  -3.935
  337    HB3  GLU  42           1HB      GLU  42   6.391   6.034  -4.198
  338    HG2  GLU  42           2HG      GLU  42   5.714   6.158  -2.005
  339    HG3  GLU  42           1HG      GLU  42   5.964   4.436  -1.719
  340    H    VAL  43           H        VAL  43   3.749   4.876  -2.312
  341    HA   VAL  43           HA       VAL  43   4.166   2.683  -0.587
  342    HB   VAL  43           HB       VAL  43   3.453   4.542   0.576
  343   HG11  VAL  43          1HG1      VAL  43   2.420   6.244  -0.404
  344   HG12  VAL  43          2HG1      VAL  43   0.970   5.274  -0.644
  345   HG13  VAL  43          3HG1      VAL  43   2.250   5.259  -1.856
  346   HG21  VAL  43          3HG2      VAL  43   2.070   2.419   0.994
  347   HG22  VAL  43          1HG2      VAL  43   0.779   3.310   0.194
  348   HG23  VAL  43          2HG2      VAL  43   1.498   3.947   1.669
  349    H    VAL  44           H        VAL  44   1.571   3.521  -2.792
  350    HA   VAL  44           HA       VAL  44  -0.223   1.489  -2.173
  351    HB   VAL  44           HB       VAL  44  -0.763   3.420  -3.620
  352   HG11  VAL  44          1HG1      VAL  44   1.248   3.464  -4.972
  353   HG12  VAL  44          2HG1      VAL  44  -0.184   3.360  -5.992
  354   HG13  VAL  44          3HG1      VAL  44   0.805   1.927  -5.713
  355   HG21  VAL  44          3HG2      VAL  44  -1.554   0.686  -3.998
  356   HG22  VAL  44          1HG2      VAL  44  -1.668   1.571  -5.518
  357   HG23  VAL  44          2HG2      VAL  44  -2.526   2.154  -4.093
  358    H    PHE  45           H        PHE  45   2.151   1.541  -4.845
  359    HA   PHE  45           HA       PHE  45   1.716  -1.237  -5.370
  360    HB2  PHE  45           2HB      PHE  45   3.314  -1.017  -7.134
  361    HB3  PHE  45           1HB      PHE  45   2.316   0.430  -7.137
  362    HD1  PHE  45           1HD      PHE  45   5.565  -0.846  -5.850
  363    HD2  PHE  45           2HD      PHE  45   3.304   2.501  -7.194
  364    HE1  PHE  45           1HE      PHE  45   7.594   0.545  -5.781
  365    HE2  PHE  45           2HE      PHE  45   5.330   3.897  -7.131
  366    HZ   PHE  45           HZ       PHE  45   7.477   2.920  -6.423
  367    H    ALA  46           H        ALA  46   3.383   0.367  -3.013
  368    HA   ALA  46           HA       ALA  46   5.664  -1.354  -2.838
  369    HB1  ALA  46           1HB      ALA  46   4.525   0.736  -1.012
  370    HB2  ALA  46           2HB      ALA  46   5.996   0.818  -1.981
  371    HB3  ALA  46           3HB      ALA  46   5.925  -0.243  -0.574
  372    H    ILE  47           H        ILE  47   2.843  -0.809  -0.792
  373    HA   ILE  47           HA       ILE  47   3.153  -2.983   0.908
  374    HB   ILE  47           HB       ILE  47   0.551  -2.878   1.025
  375   HG12  ILE  47          2HG1      ILE  47   1.222  -0.785  -0.956
  376   HG13  ILE  47          1HG1      ILE  47  -0.267  -1.692  -0.738
  377   HG21  ILE  47          1HG2      ILE  47   2.529  -0.820   1.893
  378   HG22  ILE  47          2HG2      ILE  47   1.664  -2.022   2.850
  379   HG23  ILE  47          3HG2      ILE  47   0.818  -0.594   2.252
  380   HD11  ILE  47          3HD1      ILE  47  -1.179   0.096   0.164
  381   HD12  ILE  47          1HD1      ILE  47   0.356   0.955   0.071
  382   HD13  ILE  47          2HD1      ILE  47  -0.026  -0.010   1.494
  383    H    GLU  48           H        GLU  48   1.550  -2.764  -2.245
  384    HA   GLU  48           HA       GLU  48   0.407  -5.299  -2.327
  385    HB2  GLU  48           2HB      GLU  48   1.613  -4.406  -4.856
  386    HB3  GLU  48           1HB      GLU  48  -0.053  -4.831  -4.495
  387    HG2  GLU  48           2HG      GLU  48  -0.263  -2.610  -3.348
  388    HG3  GLU  48           1HG      GLU  48   1.321  -2.207  -4.008
  389    H    GLN  49           H        GLN  49   3.657  -4.229  -3.081
  390    HA   GLN  49           HA       GLN  49   4.710  -6.557  -4.160
  391    HB2  GLN  49           2HB      GLN  49   5.717  -4.086  -3.201
  392    HB3  GLN  49           1HB      GLN  49   6.650  -5.355  -2.418
  393    HG2  GLN  49           2HG      GLN  49   7.791  -5.766  -4.270
  394    HG3  GLN  49           1HG      GLN  49   6.315  -5.910  -5.224
  395   HE21  GLN  49          1HE2      GLN  49   5.598  -4.183  -6.406
  396   HE22  GLN  49          2HE2      GLN  49   6.521  -2.741  -6.633
  397    H    GLU  50           H        GLU  50   4.382  -5.581  -0.771
  398    HA   GLU  50           HA       GLU  50   5.095  -8.299   0.009
  399    HB2  GLU  50           2HB      GLU  50   6.044  -7.517   1.941
  400    HB3  GLU  50           1HB      GLU  50   6.322  -6.135   0.891
  401    HG2  GLU  50           2HG      GLU  50   3.760  -5.862   2.101
  402    HG3  GLU  50           1HG      GLU  50   4.951  -6.221   3.352
  403    H    PHE  51           H        PHE  51   2.496  -7.621  -0.961
  404    HA   PHE  51           HA       PHE  51   0.935  -8.326   1.383
  405    HB2  PHE  51           2HB      PHE  51   0.569  -5.964  -0.348
  406    HB3  PHE  51           1HB      PHE  51  -0.897  -6.854   0.045
  407    HD1  PHE  51           1HD      PHE  51   2.127  -5.447   1.712
  408    HD2  PHE  51           2HD      PHE  51  -2.034  -6.304   1.961
  409    HE1  PHE  51           1HE      PHE  51   2.028  -4.314   3.894
  410    HE2  PHE  51           2HE      PHE  51  -2.141  -5.173   4.142
  411    HZ   PHE  51           HZ       PHE  51  -0.109  -4.176   5.112
  412    H    ILE  52           H        ILE  52   1.818  -9.049  -1.734
  413    HA   ILE  52           HA       ILE  52   1.118 -10.560  -3.273
  414    HB   ILE  52           HB       ILE  52   0.121 -12.511  -2.535
  415   HG12  ILE  52          2HG1      ILE  52  -1.727 -10.738  -1.310
  416   HG13  ILE  52          1HG1      ILE  52  -1.877 -12.471  -1.547
  417   HG21  ILE  52          1HG2      ILE  52   1.288 -13.090  -0.640
  418   HG22  ILE  52          2HG2      ILE  52   0.940 -11.563   0.171
  419   HG23  ILE  52          3HG2      ILE  52   2.137 -11.621  -1.123
  420   HD11  ILE  52          3HD1      ILE  52  -2.206 -12.102   0.744
  421   HD12  ILE  52          1HD1      ILE  52  -0.825 -11.012   0.848
  422   HD13  ILE  52          2HD1      ILE  52  -0.568 -12.740   0.600
  423    H    LEU  53           H        LEU  53  -0.235  -8.011  -3.114
  424    HA   LEU  53           HA       LEU  53  -2.356  -8.507  -4.903
  425    HB2  LEU  53           2HB      LEU  53  -3.422  -9.153  -2.720
  426    HB3  LEU  53           1HB      LEU  53  -3.233  -7.488  -2.205
  427    HG   LEU  53           HG       LEU  53  -4.896  -6.717  -3.594
  428   HD11  LEU  53          1HD1      LEU  53  -4.418  -7.222  -5.745
  429   HD12  LEU  53          2HD1      LEU  53  -5.690  -8.418  -5.498
  430   HD13  LEU  53          3HD1      LEU  53  -3.997  -8.895  -5.375
  431   HD21  LEU  53          3HD2      LEU  53  -5.848  -9.553  -3.309
  432   HD22  LEU  53          1HD2      LEU  53  -6.797  -8.067  -3.275
  433   HD23  LEU  53          2HD2      LEU  53  -5.718  -8.455  -1.935
  434    H    ASP  54           H        ASP  54  -2.726  -6.725  -6.106
  435    HA   ASP  54           HA       ASP  54  -1.396  -4.279  -5.290
  436    HB2  ASP  54           2HB      ASP  54  -2.398  -5.115  -8.011
  437    HB3  ASP  54           1HB      ASP  54  -1.503  -3.639  -7.660
  438    H    ILE  55           H        ILE  55  -2.404  -2.231  -5.557
  439    HA   ILE  55           HA       ILE  55  -5.302  -2.250  -5.860
  440    HB   ILE  55           HB       ILE  55  -4.264  -0.487  -3.727
  441   HG12  ILE  55          2HG1      ILE  55  -4.695  -3.439  -3.228
  442   HG13  ILE  55          1HG1      ILE  55  -3.110  -2.678  -3.338
  443   HG21  ILE  55          1HG2      ILE  55  -6.556  -0.315  -4.071
  444   HG22  ILE  55          2HG2      ILE  55  -6.439  -1.392  -2.679
  445   HG23  ILE  55          3HG2      ILE  55  -6.754  -2.055  -4.284
  446   HD11  ILE  55          3HD1      ILE  55  -4.936  -1.412  -1.433
  447   HD12  ILE  55          1HD1      ILE  55  -3.236  -1.850  -1.266
  448   HD13  ILE  55          2HD1      ILE  55  -4.488  -3.072  -1.042
  449    HA   PRO  56           HA       PRO  56  -2.903   1.551  -7.517
  450    HB2  PRO  56           2HB      PRO  56  -2.056   0.761  -9.945
  451    HB3  PRO  56           1HB      PRO  56  -1.094   0.488  -8.487
  452    HG2  PRO  56           2HG      PRO  56  -2.871  -1.414  -9.966
  453    HG3  PRO  56           1HG      PRO  56  -1.256  -1.691  -9.289
  454    HD2  PRO  56           2HD      PRO  56  -3.561  -2.457  -8.042
  455    HD3  PRO  56           1HD      PRO  56  -2.069  -2.044  -7.174
  456    H    ASP  57           H        ASP  57  -3.174   2.135 -10.219
  457    HA   ASP  57           HA       ASP  57  -4.717   3.082 -11.607
  458    HB2  ASP  57           2HB      ASP  57  -5.734   0.274 -11.238
  459    HB3  ASP  57           1HB      ASP  57  -6.558   1.409 -12.303
  460    H    HIS  58           H        HIS  58  -7.451   2.843 -11.870
  461    HA   HIS  58           HA       HIS  58  -8.489   4.704 -10.185
  462    HB2  HIS  58           2HB      HIS  58  -9.785   2.444 -11.676
  463    HB3  HIS  58           1HB      HIS  58 -10.753   3.501 -10.656
  464    HD1  HIS  58           1HD      HIS  58 -12.012   4.757 -12.433
  465    HD2  HIS  58           2HD      HIS  58  -7.903   4.787 -13.053
  466    HE1  HIS  58           1HE      HIS  58 -11.629   6.375 -14.319
  467    HE2  HIS  58           2HE      HIS  58  -9.128   6.443 -14.617
  468    H    ASP  59           H        ASP  59  -7.738   1.458  -9.408
  469    HA   ASP  59           HA       ASP  59  -9.542   0.954  -7.325
  470    HB2  ASP  59           2HB      ASP  59  -6.685  -0.005  -7.329
  471    HB3  ASP  59           1HB      ASP  59  -8.107  -0.817  -6.683
  472    H    ALA  60           H        ALA  60  -6.338   2.479  -7.290
  473    HA   ALA  60           HA       ALA  60  -6.529   3.027  -4.463
  474    HB1  ALA  60           1HB      ALA  60  -4.422   3.637  -6.517
  475    HB2  ALA  60           2HB      ALA  60  -4.361   2.442  -5.220
  476    HB3  ALA  60           3HB      ALA  60  -4.315   4.162  -4.837
  477    H    GLU  61           H        GLU  61  -7.194   4.611  -7.439
  478    HA   GLU  61           HA       GLU  61  -7.072   7.285  -6.446
  479    HB2  GLU  61           2HB      GLU  61  -8.601   6.359  -8.870
  480    HB3  GLU  61           1HB      GLU  61  -7.927   7.953  -8.563
  481    HG2  GLU  61           2HG      GLU  61  -5.850   5.983  -8.470
  482    HG3  GLU  61           1HG      GLU  61  -6.763   5.831  -9.971
  483    H    LYS  62           H        LYS  62  -9.502   4.799  -6.614
  484    HA   LYS  62           HA       LYS  62 -11.738   6.499  -6.154
  485    HB2  LYS  62           2HB      LYS  62 -11.307   3.529  -5.980
  486    HB3  LYS  62           1HB      LYS  62 -12.827   4.259  -5.486
  487    HG2  LYS  62           2HG      LYS  62 -11.653   4.753  -8.198
  488    HG3  LYS  62           1HG      LYS  62 -12.663   3.346  -7.858
  489    HD2  LYS  62           2HD      LYS  62 -14.540   4.566  -7.864
  490    HD3  LYS  62           1HD      LYS  62 -13.814   5.838  -6.880
  491    HE2  LYS  62           2HE      LYS  62 -12.725   5.785  -9.566
  492    HE3  LYS  62           1HE      LYS  62 -14.476   5.993  -9.569
  493    HZ1  LYS  62           3HZ      LYS  62 -13.931   8.138  -9.285
  494    HZ2  LYS  62           1HZ      LYS  62 -12.399   7.796  -8.653
  495    HZ3  LYS  62           2HZ      LYS  62 -13.764   7.707  -7.659
  496    H    ILE  63           H        ILE  63  -9.226   6.098  -4.239
  497    HA   ILE  63           HA       ILE  63 -10.765   5.859  -1.764
  498    HB   ILE  63           HB       ILE  63  -8.453   4.577  -2.444
  499   HG12  ILE  63          2HG1      ILE  63  -8.567   4.997   0.421
  500   HG13  ILE  63          1HG1      ILE  63 -10.180   4.767  -0.246
  501   HG21  ILE  63          1HG2      ILE  63  -7.183   6.668  -2.358
  502   HG22  ILE  63          2HG2      ILE  63  -6.650   5.534  -1.116
  503   HG23  ILE  63          3HG2      ILE  63  -7.680   6.899  -0.681
  504   HD11  ILE  63          3HD1      ILE  63  -9.292   2.654   0.450
  505   HD12  ILE  63          1HD1      ILE  63  -7.835   2.903  -0.511
  506   HD13  ILE  63          2HD1      ILE  63  -9.392   2.682  -1.310
  507    H    GLN  64           H        GLN  64 -11.195   7.662  -0.676
  508    HA   GLN  64           HA       GLN  64  -9.465   9.974  -1.069
  509    HB2  GLN  64           2HB      GLN  64 -12.444   9.810  -0.726
  510    HB3  GLN  64           1HB      GLN  64 -11.564  11.303  -0.429
  511    HG2  GLN  64           2HG      GLN  64 -12.638  10.621  -2.800
  512    HG3  GLN  64           1HG      GLN  64 -11.270  11.717  -2.609
  513   HE21  GLN  64          1HE2      GLN  64 -12.095   8.318  -3.097
  514   HE22  GLN  64          2HE2      GLN  64 -10.695   7.928  -4.030
  515    H    SER  65           H        SER  65 -10.546   7.701   1.116
  516    HA   SER  65           HA       SER  65  -9.695   9.384   3.377
  517    HB2  SER  65           2HB      SER  65 -11.391   8.495   4.783
  518    HB3  SER  65           1HB      SER  65 -12.206   8.921   3.279
  519    HG   SER  65           HG       SER  65 -12.696   6.901   3.014
  520    H    ILE  66           H        ILE  66  -8.473   8.372   4.974
  521    HA   ILE  66           HA       ILE  66  -6.836   6.244   4.125
  522    HB   ILE  66           HB       ILE  66  -6.519   6.309   6.871
  523   HG12  ILE  66          2HG1      ILE  66  -7.238   9.073   5.863
  524   HG13  ILE  66          1HG1      ILE  66  -8.080   8.158   7.110
  525   HG21  ILE  66          1HG2      ILE  66  -4.724   6.315   5.269
  526   HG22  ILE  66          2HG2      ILE  66  -4.533   7.692   6.353
  527   HG23  ILE  66          3HG2      ILE  66  -5.164   7.933   4.724
  528   HD11  ILE  66          3HD1      ILE  66  -6.816   9.659   8.320
  529   HD12  ILE  66          1HD1      ILE  66  -5.431   9.523   7.236
  530   HD13  ILE  66          2HD1      ILE  66  -5.817   8.205   8.343
  531    HA   PRO  67           HA       PRO  67  -9.766   3.885   7.385
  532    HB2  PRO  67           2HB      PRO  67 -12.240   4.804   6.013
  533    HB3  PRO  67           1HB      PRO  67 -11.952   4.494   7.729
  534    HG2  PRO  67           2HG      PRO  67 -12.111   6.987   6.803
  535    HG3  PRO  67           1HG      PRO  67 -10.944   6.555   8.067
  536    HD2  PRO  67           2HD      PRO  67 -10.493   7.038   5.154
  537    HD3  PRO  67           1HD      PRO  67  -9.468   7.459   6.540
  538    H    ASP  68           H        ASP  68 -11.627   4.353   4.392
  539    HA   ASP  68           HA       ASP  68 -11.974   1.666   3.823
  540    HB2  ASP  68           2HB      ASP  68 -12.589   4.128   2.576
  541    HB3  ASP  68           1HB      ASP  68 -11.787   3.135   1.362
  542    H    ALA  69           H        ALA  69  -9.168   3.581   3.487
  543    HA   ALA  69           HA       ALA  69  -7.879   2.219   1.385
  544    HB1  ALA  69           1HB      ALA  69  -6.553   3.974   1.673
  545    HB2  ALA  69           2HB      ALA  69  -5.883   3.161   3.088
  546    HB3  ALA  69           3HB      ALA  69  -7.229   4.286   3.273
  547    H    VAL  70           H        VAL  70  -6.476   2.200   4.583
  548    HA   VAL  70           HA       VAL  70  -5.386  -0.381   4.290
  549    HB   VAL  70           HB       VAL  70  -4.313   1.209   5.750
  550   HG11  VAL  70          1HG1      VAL  70  -6.569   2.230   6.445
  551   HG12  VAL  70          2HG1      VAL  70  -5.272   2.182   7.640
  552   HG13  VAL  70          3HG1      VAL  70  -6.575   0.997   7.706
  553   HG21  VAL  70          3HG2      VAL  70  -5.269  -0.738   7.763
  554   HG22  VAL  70          1HG2      VAL  70  -3.626  -0.298   7.301
  555   HG23  VAL  70          2HG2      VAL  70  -4.562  -1.394   6.286
  556    H    GLU  71           H        GLU  71  -8.480   0.685   5.238
  557    HA   GLU  71           HA       GLU  71  -9.235  -1.364   7.008
  558    HB2  GLU  71           2HB      GLU  71 -10.767   0.475   5.193
  559    HB3  GLU  71           1HB      GLU  71 -11.594  -0.785   6.099
  560    HG2  GLU  71           2HG      GLU  71  -9.843   1.304   7.367
  561    HG3  GLU  71           1HG      GLU  71 -11.588   1.468   7.172
  562    H    TYR  72           H        TYR  72  -9.643  -1.052   3.487
  563    HA   TYR  72           HA       TYR  72 -10.834  -3.598   3.168
  564    HB2  TYR  72           2HB      TYR  72 -11.277  -2.730   1.158
  565    HB3  TYR  72           1HB      TYR  72 -10.228  -1.363   1.516
  566    HD1  TYR  72           1HD      TYR  72  -7.657  -1.823   1.172
  567    HD2  TYR  72           2HD      TYR  72 -10.771  -4.072  -0.654
  568    HE1  TYR  72           1HE      TYR  72  -6.094  -2.558  -0.575
  569    HE2  TYR  72           2HE      TYR  72  -9.216  -4.815  -2.407
  570    HH   TYR  72           HH       TYR  72  -5.819  -4.293  -2.192
  571    H    ILE  73           H        ILE  73  -7.562  -2.381   2.959
  572    HA   ILE  73           HA       ILE  73  -6.310  -4.638   1.894
  573    HB   ILE  73           HB       ILE  73  -5.333  -2.434   3.637
  574   HG12  ILE  73          2HG1      ILE  73  -4.224  -3.146   0.963
  575   HG13  ILE  73          1HG1      ILE  73  -5.812  -2.390   1.042
  576   HG21  ILE  73          1HG2      ILE  73  -3.514  -4.542   2.527
  577   HG22  ILE  73          2HG2      ILE  73  -4.171  -4.633   4.161
  578   HG23  ILE  73          3HG2      ILE  73  -3.142  -3.278   3.699
  579   HD11  ILE  73          3HD1      ILE  73  -3.222  -1.269   2.074
  580   HD12  ILE  73          1HD1      ILE  73  -4.804  -0.531   2.327
  581   HD13  ILE  73          2HD1      ILE  73  -4.161  -0.701   0.694
  582    H    ALA  74           H        ALA  74  -7.019  -3.756   5.214
  583    HA   ALA  74           HA       ALA  74  -5.698  -5.906   6.447
  584    HB1  ALA  74           1HB      ALA  74  -7.179  -3.686   7.287
  585    HB2  ALA  74           2HB      ALA  74  -6.284  -4.823   8.295
  586    HB3  ALA  74           3HB      ALA  74  -7.994  -5.097   7.962
  587    H    GLN  75           H        GLN  75  -9.069  -5.480   5.511
  588    HA   GLN  75           HA       GLN  75  -9.796  -8.123   6.310
  589    HB2  GLN  75           2HB      GLN  75 -11.724  -7.016   4.530
  590    HB3  GLN  75           1HB      GLN  75 -11.847  -7.253   6.268
  591    HG2  GLN  75           2HG      GLN  75 -10.497  -5.054   6.421
  592    HG3  GLN  75           1HG      GLN  75 -11.008  -4.823   4.749
  593   HE21  GLN  75          1HE2      GLN  75 -11.750  -3.037   6.665
  594   HE22  GLN  75          2HE2      GLN  75 -13.445  -3.167   6.970
  595    H    ASN  76           H        ASN  76 -10.619  -6.797   3.175
  596    HA   ASN  76           HA       ASN  76 -10.818  -8.870   1.606
  597    HB2  ASN  76           2HB      ASN  76  -9.478  -6.275   1.148
  598    HB3  ASN  76           1HB      ASN  76  -9.119  -7.530  -0.035
  599   HD21  ASN  76          1HD2      ASN  76 -11.158  -5.065   0.730
  600   HD22  ASN  76          2HD2      ASN  76 -12.515  -5.501  -0.248
  601    HA   PRO  77           HA       PRO  77  -6.086  -9.815   0.913
  602    HB2  PRO  77           2HB      PRO  77  -4.948  -8.144   3.103
  603    HB3  PRO  77           1HB      PRO  77  -4.299  -8.487   1.494
  604    HG2  PRO  77           2HG      PRO  77  -5.384  -6.123   2.010
  605    HG3  PRO  77           1HG      PRO  77  -5.688  -6.931   0.461
  606    HD2  PRO  77           2HD      PRO  77  -7.472  -6.698   2.855
  607    HD3  PRO  77           1HD      PRO  77  -7.876  -6.602   1.129
  608    H    MET  78           H        MET  78  -7.195  -9.125   4.236
  609    HA   MET  78           HA       MET  78  -5.746 -11.254   5.424
  610    HB2  MET  78           2HB      MET  78  -6.442  -9.535   6.883
  611    HB3  MET  78           1HB      MET  78  -8.103  -9.611   6.312
  612    HG2  MET  78           2HG      MET  78  -8.130 -11.975   7.288
  613    HG3  MET  78           1HG      MET  78  -6.659 -11.496   8.133
  614    HE1  MET  78           3HE      MET  78  -9.269 -12.284  10.154
  615    HE2  MET  78           1HE      MET  78  -8.572 -11.073  11.231
  616    HE3  MET  78           2HE      MET  78  -7.520 -12.071  10.226
  617    H    ALA  79           H        ALA  79  -8.606 -11.136   3.567
  618    HA   ALA  79           HA       ALA  79  -9.690 -13.594   4.587
  619    HB1  ALA  79           1HB      ALA  79 -10.922 -11.494   3.547
  620    HB2  ALA  79           2HB      ALA  79 -11.584 -13.123   3.419
  621    HB3  ALA  79           3HB      ALA  79 -10.701 -12.421   2.063
  622    H    LYS  80           H        LYS  80  -7.708 -12.518   1.964
  623    HA   LYS  80           HA       LYS  80  -7.862 -14.291  -0.017
  624    HB2  LYS  80           2HB      LYS  80  -5.259 -13.634   1.375
  625    HB3  LYS  80           1HB      LYS  80  -5.429 -14.207  -0.278
  626    HG2  LYS  80           2HG      LYS  80  -6.839 -12.124  -0.679
  627    HG3  LYS  80           1HG      LYS  80  -6.211 -11.549   0.867
  628    HD2  LYS  80           2HD      LYS  80  -3.914 -11.849   0.004
  629    HD3  LYS  80           1HD      LYS  80  -4.587 -12.325  -1.556
  630    HE2  LYS  80           2HE      LYS  80  -4.704 -10.191  -2.148
  631    HE3  LYS  80           1HE      LYS  80  -5.813  -9.887  -0.812
  632    HZ1  LYS  80           3HZ      LYS  80  -3.618  -9.795   0.552
  633    HZ2  LYS  80           1HZ      LYS  80  -4.116  -8.446  -0.341
  634    HZ3  LYS  80           2HZ      LYS  80  -2.910  -9.465  -0.947
  635   H282  PNS 101          8H2       PNS 101   3.535  14.860  -8.193
  636   H281  PNS 101          9H2       PNS 101   4.267  16.297  -8.910
  637   H303  PNS 101          0H3       PNS 101   7.335  14.815  -7.958
  638   H302  PNS 101          1H3       PNS 101   5.916  14.790  -6.910
  639   H301  PNS 101          2H3       PNS 101   6.262  16.213  -7.893
  640   H313  PNS 101          3H3       PNS 101   5.378  12.857  -7.708
  641   H312  PNS 101          4H3       PNS 101   6.079  12.539  -9.294
  642   H311  PNS 101          5H3       PNS 101   4.339  12.774  -9.131
  643    H32  PNS 101           6H3      PNS 101   5.344  14.786 -10.956
  644    H33  PNS 101           7H3      PNS 101   7.477  16.144 -10.949
  645    H36  PNS 101           8H3      PNS 101   8.728  14.183 -10.165
  646   H372  PNS 101          9H3       PNS 101   8.341  14.211 -13.063
  647   H371  PNS 101          0H4       PNS 101   9.534  13.105 -12.384
  648   H382  PNS 101          1H4       PNS 101  10.190  15.487 -11.201
  649   H381  PNS 101          2H4       PNS 101  10.983  14.785 -12.611
  650    H41  PNS 101           3H4      PNS 101   7.848  17.011 -12.428
  651   H422  PNS 101          4H4       PNS 101   9.724  18.969 -11.990
  652   H421  PNS 101          5H4       PNS 101   8.447  18.538 -10.853
  653   H431  PNS 101          7H4       PNS 101  10.558  18.390  -9.717
  654   H432  PNS 101          6H4       PNS 101   9.945  16.747  -9.961
  655    H44  PNS 101           8H4      PNS 101  12.046  16.266 -11.127
  Start of MODEL   14
    1    H1   MET   1           1HT      MET   1  -6.243  -7.124   8.688
    2    H2   MET   1           2HT      MET   1  -6.844  -8.731   8.657
    3    H3   MET   1           3HT      MET   1  -5.241  -8.403   8.140
    4    HA   MET   1           HA       MET   1  -6.366  -8.499  10.823
    5    HB2  MET   1           2HB      MET   1  -4.426  -9.855  11.224
    6    HB3  MET   1           1HB      MET   1  -5.159 -10.401   9.723
    7    HG2  MET   1           2HG      MET   1  -3.487  -9.346   8.419
    8    HG3  MET   1           1HG      MET   1  -2.852  -8.481   9.817
    9    HE1  MET   1           2HE      MET   1  -2.275 -11.293  12.108
   10    HE2  MET   1           3HE      MET   1  -2.190  -9.551  11.846
   11    HE3  MET   1           1HE      MET   1  -0.736 -10.538  11.695
   12    H    ASN   2           H        ASN   2  -4.184  -8.122  12.321
   13    HA   ASN   2           HA       ASN   2  -3.914  -5.294  12.362
   14    HB2  ASN   2           2HB      ASN   2  -2.028  -6.158  14.127
   15    HB3  ASN   2           1HB      ASN   2  -3.731  -5.937  14.516
   16   HD21  ASN   2          1HD2      ASN   2  -1.175  -8.169  14.080
   17   HD22  ASN   2          2HD2      ASN   2  -2.054  -9.601  14.482
   18    H    ASP   3           H        ASP   3  -1.958  -7.927  11.236
   19    HA   ASP   3           HA       ASP   3   0.523  -6.689  11.068
   20    HB2  ASP   3           2HB      ASP   3   1.162  -8.643  10.181
   21    HB3  ASP   3           1HB      ASP   3  -0.509  -9.158  10.393
   22    H    VAL   4           H        VAL   4  -2.188  -6.557   8.843
   23    HA   VAL   4           HA       VAL   4  -0.749  -5.330   6.727
   24    HB   VAL   4           HB       VAL   4  -2.991  -4.750   5.807
   25   HG11  VAL   4          1HG1      VAL   4  -2.233  -6.773   5.013
   26   HG12  VAL   4          2HG1      VAL   4  -3.754  -7.249   5.770
   27   HG13  VAL   4          3HG1      VAL   4  -2.227  -7.521   6.610
   28   HG21  VAL   4          3HG2      VAL   4  -4.949  -5.796   6.984
   29   HG22  VAL   4          1HG2      VAL   4  -4.265  -4.376   7.776
   30   HG23  VAL   4          2HG2      VAL   4  -3.905  -5.989   8.390
   31    H    LEU   5           H        LEU   5  -3.122  -3.934   9.018
   32    HA   LEU   5           HA       LEU   5  -2.654  -1.289   8.156
   33    HB2  LEU   5           2HB      LEU   5  -3.949  -0.587  10.102
   34    HB3  LEU   5           1HB      LEU   5  -4.744  -1.860   9.207
   35    HG   LEU   5           HG       LEU   5  -4.934  -2.068  11.674
   36   HD11  LEU   5          1HD1      LEU   5  -4.720  -3.974   9.822
   37   HD12  LEU   5          2HD1      LEU   5  -5.014  -4.309  11.528
   38   HD13  LEU   5          3HD1      LEU   5  -3.381  -4.439  10.871
   39   HD21  LEU   5          3HD2      LEU   5  -3.180  -2.183  13.068
   40   HD22  LEU   5          1HD2      LEU   5  -2.313  -1.383  11.760
   41   HD23  LEU   5          2HD2      LEU   5  -2.213  -3.134  11.943
   42    H    THR   6           H        THR   6  -1.228  -3.260  10.646
   43    HA   THR   6           HA       THR   6   0.068  -1.242  12.091
   44    HB   THR   6           HB       THR   6  -0.101  -3.421  13.049
   45    HG1  THR   6           1HG      THR   6   2.488  -2.523  12.463
   46   HG21  THR   6          3HG2      THR   6   1.869  -4.695  11.271
   47   HG22  THR   6          1HG2      THR   6   0.242  -4.479  10.625
   48   HG23  THR   6          2HG2      THR   6   0.484  -5.381  12.122
   49    H    ARG   7           H        ARG   7   1.367  -3.337   9.550
   50    HA   ARG   7           HA       ARG   7   3.807  -1.873   9.384
   51    HB2  ARG   7           2HB      ARG   7   4.546  -3.679   8.291
   52    HB3  ARG   7           1HB      ARG   7   2.981  -4.407   8.629
   53    HG2  ARG   7           2HG      ARG   7   3.466  -4.650   6.298
   54    HG3  ARG   7           1HG      ARG   7   2.144  -3.496   6.485
   55    HD2  ARG   7           2HD      ARG   7   3.329  -1.834   5.575
   56    HD3  ARG   7           1HD      ARG   7   4.765  -2.232   6.517
   57    HE   ARG   7           HE       ARG   7   4.284  -2.904   3.810
   58   HH11  ARG   7          1HH1      ARG   7   5.687  -4.156   6.740
   59   HH12  ARG   7          2HH1      ARG   7   6.815  -5.180   5.917
   60   HH21  ARG   7          1HH2      ARG   7   5.765  -4.249   2.715
   61   HH22  ARG   7          2HH2      ARG   7   6.859  -5.233   3.627
   62    H    VAL   8           H        VAL   8   0.973  -2.271   7.298
   63    HA   VAL   8           HA       VAL   8   1.808  -0.608   5.227
   64    HB   VAL   8           HB       VAL   8  -0.341  -2.176   5.550
   65   HG11  VAL   8          1HG1      VAL   8  -1.454  -0.664   7.099
   66   HG12  VAL   8          2HG1      VAL   8  -2.370  -0.803   5.599
   67   HG13  VAL   8          3HG1      VAL   8  -1.389   0.630   5.903
   68   HG21  VAL   8          3HG2      VAL   8  -1.296  -0.728   3.544
   69   HG22  VAL   8          1HG2      VAL   8   0.149  -1.724   3.373
   70   HG23  VAL   8          2HG2      VAL   8   0.301   0.011   3.649
   71    H    LEU   9           H        LEU   9  -0.237   0.135   8.039
   72    HA   LEU   9           HA       LEU   9  -0.657   2.842   7.476
   73    HB2  LEU   9           2HB      LEU   9  -1.511   3.033   9.623
   74    HB3  LEU   9           1HB      LEU   9  -1.727   1.330   9.277
   75    HG   LEU   9           HG       LEU   9   0.502   0.981  10.506
   76   HD11  LEU   9          1HD1      LEU   9   0.348   3.800  10.607
   77   HD12  LEU   9          2HD1      LEU   9   1.572   2.744  11.312
   78   HD13  LEU   9          3HD1      LEU   9   0.152   3.199  12.254
   79   HD21  LEU   9          3HD2      LEU   9  -0.693   1.210  12.751
   80   HD22  LEU   9          1HD2      LEU   9  -1.442   0.177  11.534
   81   HD23  LEU   9          2HD2      LEU   9  -2.069   1.801  11.820
   82    H    GLU  10           H        GLU  10   1.933   1.230   9.259
   83    HA   GLU  10           HA       GLU  10   3.239   3.562  10.134
   84    HB2  GLU  10           2HB      GLU  10   5.187   2.080  10.508
   85    HB3  GLU  10           1HB      GLU  10   3.696   1.433  11.180
   86    HG2  GLU  10           2HG      GLU  10   3.500  -0.171   9.469
   87    HG3  GLU  10           1HG      GLU  10   4.729   0.622   8.483
   88    H    VAL  11           H        VAL  11   3.422   1.725   7.169
   89    HA   VAL  11           HA       VAL  11   5.784   2.805   6.133
   90    HB   VAL  11           HB       VAL  11   3.723   2.311   4.146
   91   HG11  VAL  11          1HG1      VAL  11   5.442   1.263   2.995
   92   HG12  VAL  11          2HG1      VAL  11   6.310   0.855   4.476
   93   HG13  VAL  11          3HG1      VAL  11   6.273   2.525   3.906
   94   HG21  VAL  11          3HG2      VAL  11   2.971   0.755   5.878
   95   HG22  VAL  11          1HG2      VAL  11   4.594   0.074   5.962
   96   HG23  VAL  11          2HG2      VAL  11   3.640  -0.100   4.490
   97    H    VAL  12           H        VAL  12   2.470   3.923   5.936
   98    HA   VAL  12           HA       VAL  12   3.005   6.076   4.159
   99    HB   VAL  12           HB       VAL  12   0.781   6.952   4.931
  100   HG11  VAL  12          1HG1      VAL  12   1.234   5.194   3.091
  101   HG12  VAL  12          2HG1      VAL  12  -0.419   5.423   3.662
  102   HG13  VAL  12          3HG1      VAL  12   0.530   4.051   4.234
  103   HG21  VAL  12          3HG2      VAL  12  -0.562   5.697   6.438
  104   HG22  VAL  12          1HG2      VAL  12   0.993   5.950   7.231
  105   HG23  VAL  12          2HG2      VAL  12   0.618   4.388   6.503
  106    H    LYS  13           H        LYS  13   2.679   5.860   7.680
  107    HA   LYS  13           HA       LYS  13   2.967   8.623   8.176
  108    HB2  LYS  13           2HB      LYS  13   3.676   6.408  10.091
  109    HB3  LYS  13           1HB      LYS  13   3.154   8.041  10.480
  110    HG2  LYS  13           2HG      LYS  13   0.937   7.600   9.776
  111    HG3  LYS  13           1HG      LYS  13   1.410   6.065   9.032
  112    HD2  LYS  13           2HD      LYS  13   1.611   4.992  11.067
  113    HD3  LYS  13           1HD      LYS  13   1.879   6.496  11.952
  114    HE2  LYS  13           2HE      LYS  13  -0.537   7.071  11.314
  115    HE3  LYS  13           1HE      LYS  13  -0.696   5.364  10.907
  116    HZ1  LYS  13           3HZ      LYS  13  -1.424   5.719  13.147
  117    HZ2  LYS  13           1HZ      LYS  13   0.024   6.491  13.558
  118    HZ3  LYS  13           2HZ      LYS  13   0.020   4.840  13.191
  119    H    ASN  14           H        ASN  14   5.311   6.017   7.864
  120    HA   ASN  14           HA       ASN  14   7.454   7.825   8.608
  121    HB2  ASN  14           2HB      ASN  14   7.658   4.881   7.991
  122    HB3  ASN  14           1HB      ASN  14   8.873   5.889   8.771
  123   HD21  ASN  14          1HD2      ASN  14   6.599   3.627   9.323
  124   HD22  ASN  14          2HD2      ASN  14   6.229   3.966  10.976
  125    H    PHE  15           H        PHE  15   5.847   6.994   5.872
  126    HA   PHE  15           HA       PHE  15   8.109   6.853   4.105
  127    HB2  PHE  15           2HB      PHE  15   6.529   5.638   3.042
  128    HB3  PHE  15           1HB      PHE  15   5.215   6.437   3.899
  129    HD1  PHE  15           2HD      PHE  15   5.023   9.044   3.178
  130    HD2  PHE  15           1HD      PHE  15   6.483   5.857   0.769
  131    HE1  PHE  15           2HE      PHE  15   4.460  10.324   1.151
  132    HE2  PHE  15           1HE      PHE  15   5.927   7.129  -1.262
  133    HZ   PHE  15           HZ       PHE  15   4.914   9.366  -1.072
  134    H    GLU  16           H        GLU  16   6.204   9.248   5.541
  135    HA   GLU  16           HA       GLU  16   6.965  11.526   5.450
  136    HB2  GLU  16           2HB      GLU  16   7.893  12.473   3.551
  137    HB3  GLU  16           1HB      GLU  16   8.445  10.813   3.425
  138    HG2  GLU  16           2HG      GLU  16   6.012  10.838   2.114
  139    HG3  GLU  16           1HG      GLU  16   6.780  12.351   1.656
  140    H    LYS  17           H        LYS  17   4.459   9.756   4.661
  141    HA   LYS  17           HA       LYS  17   2.807  11.392   3.083
  142    HB2  LYS  17           2HB      LYS  17   1.809   9.550   5.238
  143    HB3  LYS  17           1HB      LYS  17   1.007   9.998   3.748
  144    HG2  LYS  17           2HG      LYS  17   3.579   8.461   3.773
  145    HG3  LYS  17           1HG      LYS  17   2.003   7.672   3.884
  146    HD2  LYS  17           2HD      LYS  17   2.533   9.667   1.743
  147    HD3  LYS  17           1HD      LYS  17   3.113   8.009   1.556
  148    HE2  LYS  17           2HE      LYS  17   0.276   8.531   2.338
  149    HE3  LYS  17           1HE      LYS  17   0.759   8.686   0.648
  150    HZ1  LYS  17           3HZ      LYS  17   0.276   6.334   2.169
  151    HZ2  LYS  17           1HZ      LYS  17   1.830   6.302   1.500
  152    HZ3  LYS  17           2HZ      LYS  17   0.482   6.503   0.499
  153    H    VAL  18           H        VAL  18   3.064  11.072   6.621
  154    HA   VAL  18           HA       VAL  18   2.734  13.764   7.192
  155    HB   VAL  18           HB       VAL  18   0.246  13.166   8.218
  156   HG11  VAL  18          1HG1      VAL  18   1.429  15.050   6.529
  157   HG12  VAL  18          2HG1      VAL  18  -0.163  15.140   7.282
  158   HG13  VAL  18          3HG1      VAL  18   0.009  14.466   5.661
  159   HG21  VAL  18          3HG2      VAL  18  -0.959  11.842   6.869
  160   HG22  VAL  18          1HG2      VAL  18   0.603  11.243   6.309
  161   HG23  VAL  18          2HG2      VAL  18  -0.231  12.510   5.409
  162    H    ASP  19           H        ASP  19   2.672  14.208   9.432
  163    HA   ASP  19           HA       ASP  19   3.782  12.193  11.067
  164    HB2  ASP  19           2HB      ASP  19   2.901  15.009  11.451
  165    HB3  ASP  19           1HB      ASP  19   3.082  14.015  12.894
  166    H    ALA  20           H        ALA  20   2.904  10.923  12.652
  167    HA   ALA  20           HA       ALA  20   0.249  10.104  12.422
  168    HB1  ALA  20           1HB      ALA  20   0.982   9.380  14.990
  169    HB2  ALA  20           2HB      ALA  20   2.513   9.479  14.120
  170    HB3  ALA  20           3HB      ALA  20   1.225   8.432  13.524
  171    H    SER  21           H        SER  21   1.634  12.706  14.199
  172    HA   SER  21           HA       SER  21  -0.377  13.030  16.153
  173    HB2  SER  21           2HB      SER  21   0.601  15.558  15.809
  174    HB3  SER  21           1HB      SER  21   1.356  14.325  16.817
  175    HG   SER  21           HG       SER  21   2.745  13.833  15.156
  176    H    LYS  22           H        LYS  22  -0.283  13.703  12.804
  177    HA   LYS  22           HA       LYS  22  -2.571  15.506  12.994
  178    HB2  LYS  22           2HB      LYS  22  -2.102  16.190  10.752
  179    HB3  LYS  22           1HB      LYS  22  -0.580  16.193  11.633
  180    HG2  LYS  22           2HG      LYS  22  -0.796  13.637  10.527
  181    HG3  LYS  22           1HG      LYS  22  -1.321  14.752   9.263
  182    HD2  LYS  22           2HD      LYS  22   1.307  14.688  10.726
  183    HD3  LYS  22           1HD      LYS  22   1.014  14.527   8.994
  184    HE2  LYS  22           2HE      LYS  22  -0.104  16.984   9.709
  185    HE3  LYS  22           1HE      LYS  22   1.430  16.903  10.573
  186    HZ1  LYS  22           3HZ      LYS  22   1.535  17.882   8.292
  187    HZ2  LYS  22           1HZ      LYS  22   1.176  16.350   7.672
  188    HZ3  LYS  22           2HZ      LYS  22   2.597  16.593   8.556
  189    H    VAL  23           H        VAL  23  -1.750  12.288  12.304
  190    HA   VAL  23           HA       VAL  23  -3.987  11.796  10.548
  191    HB   VAL  23           HB       VAL  23  -3.218   9.583  10.339
  192   HG11  VAL  23          1HG1      VAL  23  -0.539  10.742  10.766
  193   HG12  VAL  23          2HG1      VAL  23  -1.621  11.651   9.711
  194   HG13  VAL  23          3HG1      VAL  23  -1.231   9.972   9.338
  195   HG21  VAL  23          3HG2      VAL  23  -2.214  10.021  13.052
  196   HG22  VAL  23          1HG2      VAL  23  -1.124   9.097  12.020
  197   HG23  VAL  23          2HG2      VAL  23  -2.778   8.542  12.275
  198    H    THR  24           H        THR  24  -5.962  11.281  11.193
  199    HA   THR  24           HA       THR  24  -6.350  10.341  13.924
  200    HB   THR  24           HB       THR  24  -7.560  12.263  14.020
  201    HG1  THR  24           1HG      THR  24  -9.521  11.555  14.115
  202   HG21  THR  24          3HG2      THR  24  -8.128  12.063  11.073
  203   HG22  THR  24          1HG2      THR  24  -6.929  13.107  11.839
  204   HG23  THR  24          2HG2      THR  24  -8.648  13.368  12.139
  205    HA   PRO  25           HA       PRO  25  -8.281   6.590  12.694
  206    HB2  PRO  25           2HB      PRO  25 -10.824   7.437  13.980
  207    HB3  PRO  25           1HB      PRO  25  -9.850   5.990  14.259
  208    HG2  PRO  25           2HG      PRO  25  -9.860   7.988  16.023
  209    HG3  PRO  25           1HG      PRO  25  -8.372   7.093  15.663
  210    HD2  PRO  25           2HD      PRO  25  -9.219   9.810  14.753
  211    HD3  PRO  25           1HD      PRO  25  -7.606   9.222  15.205
  212    H    GLU  26           H        GLU  26 -10.297   9.465  12.290
  213    HA   GLU  26           HA       GLU  26 -11.560   8.244   9.956
  214    HB2  GLU  26           2HB      GLU  26 -13.372   9.691  10.228
  215    HB3  GLU  26           1HB      GLU  26 -12.923   9.286  11.879
  216    HG2  GLU  26           2HG      GLU  26 -12.249  11.383  12.359
  217    HG3  GLU  26           1HG      GLU  26 -11.639  11.678  10.731
  218    H    SER  27           H        SER  27  -8.837   9.625  10.308
  219    HA   SER  27           HA       SER  27  -8.825  12.052   8.922
  220    HB2  SER  27           2HB      SER  27  -6.918  10.422  10.100
  221    HB3  SER  27           1HB      SER  27  -6.465  10.422   8.396
  222    HG   SER  27           HG       SER  27  -6.609  12.564  10.204
  223    H    HIS  28           H        HIS  28  -8.949  12.595   6.840
  224    HA   HIS  28           HA       HIS  28  -9.506  10.539   4.903
  225    HB2  HIS  28           2HB      HIS  28  -9.859  13.488   5.038
  226    HB3  HIS  28           1HB      HIS  28  -9.707  12.761   3.443
  227    HD1  HIS  28           1HD      HIS  28 -11.489  10.704   3.025
  228    HD2  HIS  28           2HD      HIS  28 -12.384  13.446   6.016
  229    HE1  HIS  28           1HE      HIS  28 -13.952  10.445   3.459
  230    HE2  HIS  28           2HE      HIS  28 -14.488  12.176   5.209
  231    H    PHE  29           H        PHE  29  -8.364  10.274   2.936
  232    HA   PHE  29           HA       PHE  29  -5.560  10.525   3.171
  233    HB2  PHE  29           2HB      PHE  29  -6.795   8.742   1.881
  234    HB3  PHE  29           1HB      PHE  29  -7.094   9.949   0.636
  235    HD1  PHE  29           2HD      PHE  29  -4.081  10.966   1.734
  236    HD2  PHE  29           1HD      PHE  29  -5.802   7.625  -0.264
  237    HE1  PHE  29           2HE      PHE  29  -1.899  10.451   0.722
  238    HE2  PHE  29           1HE      PHE  29  -3.622   7.104  -1.279
  239    HZ   PHE  29           HZ       PHE  29  -1.667   8.519  -0.787
  240    H    VAL  30           H        VAL  30  -6.846  11.458   0.103
  241    HA   VAL  30           HA       VAL  30  -5.144  13.616  -0.250
  242    HB   VAL  30           HB       VAL  30  -7.799  13.679  -1.599
  243   HG11  VAL  30          1HG1      VAL  30  -6.386  14.178  -3.558
  244   HG12  VAL  30          2HG1      VAL  30  -4.955  14.032  -2.537
  245   HG13  VAL  30          3HG1      VAL  30  -6.131  15.310  -2.230
  246   HG21  VAL  30          3HG2      VAL  30  -5.725  11.528  -1.975
  247   HG22  VAL  30          1HG2      VAL  30  -6.965  11.905  -3.171
  248   HG23  VAL  30          2HG2      VAL  30  -7.430  11.329  -1.570
  249    H    LYS  31           H        LYS  31  -8.274  13.464   1.224
  250    HA   LYS  31           HA       LYS  31  -8.833  16.232   1.252
  251    HB2  LYS  31           2HB      LYS  31  -9.889  14.498   3.422
  252    HB3  LYS  31           1HB      LYS  31 -10.719  15.695   2.437
  253    HG2  LYS  31           2HG      LYS  31 -10.481  14.062   0.511
  254    HG3  LYS  31           1HG      LYS  31 -10.008  12.868   1.722
  255    HD2  LYS  31           2HD      LYS  31 -12.294  12.517   1.524
  256    HD3  LYS  31           1HD      LYS  31 -12.186  13.583   2.927
  257    HE2  LYS  31           2HE      LYS  31 -12.354  15.373   0.876
  258    HE3  LYS  31           1HE      LYS  31 -13.360  14.053   0.281
  259    HZ1  LYS  31           3HZ      LYS  31 -14.688  14.169   2.257
  260    HZ2  LYS  31           1HZ      LYS  31 -14.600  15.717   1.579
  261    HZ3  LYS  31           2HZ      LYS  31 -13.672  15.336   2.941
  262    H    ASP  32           H        ASP  32  -7.180  14.093   3.520
  263    HA   ASP  32           HA       ASP  32  -6.839  16.210   5.439
  264    HB2  ASP  32           2HB      ASP  32  -7.217  13.737   5.996
  265    HB3  ASP  32           1HB      ASP  32  -5.525  13.508   5.562
  266    H    LEU  33           H        LEU  33  -5.389  15.547   2.609
  267    HA   LEU  33           HA       LEU  33  -3.555  17.021   1.986
  268    HB2  LEU  33           2HB      LEU  33  -2.407  15.998   4.583
  269    HB3  LEU  33           1HB      LEU  33  -1.504  16.938   3.410
  270    HG   LEU  33           HG       LEU  33  -4.034  18.150   4.335
  271   HD11  LEU  33          1HD1      LEU  33  -3.618  17.795   6.503
  272   HD12  LEU  33          2HD1      LEU  33  -2.329  18.982   6.299
  273   HD13  LEU  33          3HD1      LEU  33  -1.966  17.259   6.196
  274   HD21  LEU  33          3HD2      LEU  33  -2.047  19.980   4.610
  275   HD22  LEU  33          1HD2      LEU  33  -2.964  19.711   3.128
  276   HD23  LEU  33          2HD2      LEU  33  -1.391  18.943   3.343
  277    H    GLY  34           H        GLY  34  -4.398  14.596   1.043
  278    HA2  GLY  34           2HA      GLY  34  -2.740  12.412   1.127
  279    HA3  GLY  34           1HA      GLY  34  -3.602  12.916  -0.318
  280    H    LEU  35           H        LEU  35  -0.888  11.726   0.129
  281    HA   LEU  35           HA       LEU  35   0.994  13.757  -0.579
  282    HB2  LEU  35           2HB      LEU  35   1.148  10.752  -0.506
  283    HB3  LEU  35           1HB      LEU  35   2.496  11.759  -1.000
  284    HG   LEU  35           HG       LEU  35   2.904  11.248   1.257
  285   HD11  LEU  35          1HD1      LEU  35   2.667  13.409   2.423
  286   HD12  LEU  35          2HD1      LEU  35   1.600  13.962   1.132
  287   HD13  LEU  35          3HD1      LEU  35   3.286  13.582   0.780
  288   HD21  LEU  35          3HD2      LEU  35  -0.023  11.775   1.636
  289   HD22  LEU  35          1HD2      LEU  35   1.098  11.805   2.997
  290   HD23  LEU  35          2HD2      LEU  35   0.908  10.334   2.044
  291    H    ASN  36           H        ASN  36   2.215  13.823  -2.564
  292    HA   ASN  36           HA       ASN  36   0.680  14.002  -4.848
  293    HB2  ASN  36           2HB      ASN  36   2.634  14.508  -5.997
  294    HB3  ASN  36           1HB      ASN  36   3.081  14.877  -4.336
  295   HD21  ASN  36          1HD2      ASN  36   3.499  12.730  -7.002
  296   HD22  ASN  36          2HD2      ASN  36   4.869  11.884  -6.382
  297    H    SER  37           H        SER  37   1.703  12.744  -6.957
  298    HA   SER  37           HA       SER  37   0.485  10.217  -6.881
  299    HB2  SER  37           2HB      SER  37   1.168  11.903  -8.868
  300    HB3  SER  37           1HB      SER  37   2.454  10.708  -9.027
  301    H    LEU  38           H        LEU  38   3.911  10.923  -7.473
  302    HA   LEU  38           HA       LEU  38   4.855   8.349  -7.378
  303    HB2  LEU  38           2HB      LEU  38   6.988   9.201  -7.248
  304    HB3  LEU  38           1HB      LEU  38   6.090  10.540  -7.920
  305    HG   LEU  38           HG       LEU  38   7.756  10.492  -5.629
  306   HD11  LEU  38          1HD1      LEU  38   6.436  12.387  -7.400
  307   HD12  LEU  38          2HD1      LEU  38   8.050  12.426  -6.688
  308   HD13  LEU  38          3HD1      LEU  38   6.663  12.995  -5.760
  309   HD21  LEU  38          3HD2      LEU  38   4.864  11.021  -5.027
  310   HD22  LEU  38          1HD2      LEU  38   6.170  11.746  -4.092
  311   HD23  LEU  38          2HD2      LEU  38   6.002   9.993  -4.153
  312    H    ASP  39           H        ASP  39   3.486  10.080  -4.833
  313    HA   ASP  39           HA       ASP  39   4.878   8.747  -2.697
  314    HB2  ASP  39           2HB      ASP  39   2.410  10.482  -2.772
  315    HB3  ASP  39           1HB      ASP  39   3.045   9.778  -1.287
  316    H    VAL  40           H        VAL  40   1.423   8.881  -2.633
  317    HA   VAL  40           HA       VAL  40   0.893   6.463  -1.561
  318    HB   VAL  40           HB       VAL  40  -0.745   8.338  -2.320
  319   HG11  VAL  40          1HG1      VAL  40  -0.160   7.171  -4.809
  320   HG12  VAL  40          2HG1      VAL  40  -1.347   8.424  -4.454
  321   HG13  VAL  40          3HG1      VAL  40  -1.821   6.726  -4.425
  322   HG21  VAL  40          3HG2      VAL  40  -1.221   5.432  -1.965
  323   HG22  VAL  40          1HG2      VAL  40  -2.578   6.424  -2.502
  324   HG23  VAL  40          2HG2      VAL  40  -1.758   6.797  -0.986
  325    H    VAL  41           H        VAL  41   1.769   7.084  -4.885
  326    HA   VAL  41           HA       VAL  41   1.036   4.559  -5.929
  327    HB   VAL  41           HB       VAL  41   2.261   5.135  -7.889
  328   HG11  VAL  41          1HG1      VAL  41   1.609   7.776  -7.875
  329   HG12  VAL  41          2HG1      VAL  41   0.607   7.157  -6.563
  330   HG13  VAL  41          3HG1      VAL  41   0.475   6.460  -8.179
  331   HG21  VAL  41          3HG2      VAL  41   3.636   7.196  -6.175
  332   HG22  VAL  41          1HG2      VAL  41   3.761   7.129  -7.932
  333   HG23  VAL  41          2HG2      VAL  41   4.364   5.791  -6.954
  334    H    GLU  42           H        GLU  42   4.108   5.861  -4.696
  335    HA   GLU  42           HA       GLU  42   5.609   3.526  -5.242
  336    HB2  GLU  42           2HB      GLU  42   6.035   6.074  -3.860
  337    HB3  GLU  42           1HB      GLU  42   6.936   4.733  -3.164
  338    HG2  GLU  42           2HG      GLU  42   7.385   4.406  -5.840
  339    HG3  GLU  42           1HG      GLU  42   7.333   6.161  -5.674
  340    H    VAL  43           H        VAL  43   3.881   4.702  -2.444
  341    HA   VAL  43           HA       VAL  43   4.668   2.663  -0.656
  342    HB   VAL  43           HB       VAL  43   3.805   4.361   0.574
  343   HG11  VAL  43          1HG1      VAL  43   1.910   5.784  -0.154
  344   HG12  VAL  43          2HG1      VAL  43   1.821   4.834  -1.635
  345   HG13  VAL  43          3HG1      VAL  43   3.264   5.784  -1.280
  346   HG21  VAL  43          3HG2      VAL  43   2.452   2.336   1.068
  347   HG22  VAL  43          1HG2      VAL  43   1.218   2.979  -0.010
  348   HG23  VAL  43          2HG2      VAL  43   1.646   3.859   1.452
  349    H    VAL  44           H        VAL  44   1.901   3.092  -2.775
  350    HA   VAL  44           HA       VAL  44   0.391   0.884  -1.977
  351    HB   VAL  44           HB       VAL  44  -0.631   0.956  -4.225
  352   HG11  VAL  44          1HG1      VAL  44  -0.797   3.731  -3.947
  353   HG12  VAL  44          2HG1      VAL  44  -0.487   3.111  -2.325
  354   HG13  VAL  44          3HG1      VAL  44  -1.870   2.519  -3.246
  355   HG21  VAL  44          3HG2      VAL  44   1.253   3.208  -4.863
  356   HG22  VAL  44          1HG2      VAL  44   0.127   2.384  -5.940
  357   HG23  VAL  44          2HG2      VAL  44   1.566   1.545  -5.360
  358    H    PHE  45           H        PHE  45   3.125   1.156  -4.165
  359    HA   PHE  45           HA       PHE  45   2.958  -1.495  -5.177
  360    HB2  PHE  45           2HB      PHE  45   4.979   0.697  -5.257
  361    HB3  PHE  45           1HB      PHE  45   5.515  -0.937  -5.635
  362    HD1  PHE  45           2HD      PHE  45   4.051  -2.212  -7.391
  363    HD2  PHE  45           1HD      PHE  45   4.147   2.019  -6.944
  364    HE1  PHE  45           2HE      PHE  45   3.219  -1.954  -9.692
  365    HE2  PHE  45           1HE      PHE  45   3.314   2.285  -9.243
  366    HZ   PHE  45           HZ       PHE  45   2.850   0.298 -10.621
  367    H    ALA  46           H        ALA  46   4.399   0.023  -2.417
  368    HA   ALA  46           HA       ALA  46   6.142  -2.054  -1.646
  369    HB1  ALA  46           1HB      ALA  46   4.879  -0.256   0.364
  370    HB2  ALA  46           2HB      ALA  46   5.982   0.418  -0.836
  371    HB3  ALA  46           3HB      ALA  46   6.539  -0.840   0.268
  372    H    ILE  47           H        ILE  47   3.241  -1.057   0.092
  373    HA   ILE  47           HA       ILE  47   2.882  -3.410   1.518
  374    HB   ILE  47           HB       ILE  47   0.672  -2.678   2.038
  375   HG12  ILE  47          2HG1      ILE  47   0.580  -1.847  -0.632
  376   HG13  ILE  47          1HG1      ILE  47  -0.698  -1.687   0.567
  377   HG21  ILE  47          1HG2      ILE  47   1.237  -0.048   2.208
  378   HG22  ILE  47          2HG2      ILE  47   2.846  -0.698   1.899
  379   HG23  ILE  47          3HG2      ILE  47   1.915  -1.270   3.283
  380   HD11  ILE  47          3HD1      ILE  47   1.159   0.340  -0.514
  381   HD12  ILE  47          1HD1      ILE  47   0.689   0.493   1.179
  382   HD13  ILE  47          2HD1      ILE  47  -0.545   0.472  -0.081
  383    H    GLU  48           H        GLU  48   1.740  -2.511  -1.694
  384    HA   GLU  48           HA       GLU  48  -0.063  -4.579  -2.142
  385    HB2  GLU  48           2HB      GLU  48   0.110  -2.770  -3.720
  386    HB3  GLU  48           1HB      GLU  48   1.793  -3.158  -4.052
  387    HG2  GLU  48           2HG      GLU  48  -0.579  -4.878  -4.735
  388    HG3  GLU  48           1HG      GLU  48   0.332  -3.873  -5.860
  389    H    GLN  49           H        GLN  49   3.415  -4.487  -2.316
  390    HA   GLN  49           HA       GLN  49   3.829  -7.001  -3.521
  391    HB2  GLN  49           2HB      GLN  49   5.440  -4.916  -2.628
  392    HB3  GLN  49           1HB      GLN  49   5.886  -6.267  -1.596
  393    HG2  GLN  49           2HG      GLN  49   6.307  -7.632  -3.593
  394    HG3  GLN  49           1HG      GLN  49   5.912  -6.243  -4.605
  395   HE21  GLN  49          1HE2      GLN  49   7.194  -4.221  -3.993
  396   HE22  GLN  49          2HE2      GLN  49   8.887  -4.453  -3.732
  397    H    GLU  50           H        GLU  50   3.645  -5.975  -0.131
  398    HA   GLU  50           HA       GLU  50   3.636  -8.768   0.678
  399    HB2  GLU  50           2HB      GLU  50   5.235  -7.547   1.921
  400    HB3  GLU  50           1HB      GLU  50   4.118  -6.217   2.190
  401    HG2  GLU  50           2HG      GLU  50   4.607  -7.779   4.142
  402    HG3  GLU  50           1HG      GLU  50   2.921  -7.384   3.807
  403    H    PHE  51           H        PHE  51   1.352  -7.625  -0.602
  404    HA   PHE  51           HA       PHE  51  -0.598  -8.016   1.511
  405    HB2  PHE  51           2HB      PHE  51  -0.285  -5.634  -0.179
  406    HB3  PHE  51           1HB      PHE  51  -1.928  -6.252  -0.081
  407    HD1  PHE  51           2HD      PHE  51   0.940  -5.160   2.004
  408    HD2  PHE  51           1HD      PHE  51  -3.262  -5.790   1.768
  409    HE1  PHE  51           2HE      PHE  51   0.655  -4.050   4.182
  410    HE2  PHE  51           1HE      PHE  51  -3.555  -4.680   3.944
  411    HZ   PHE  51           HZ       PHE  51  -1.594  -3.809   5.154
  412    H    ILE  52           H        ILE  52   0.440  -8.657  -1.670
  413    HA   ILE  52           HA       ILE  52  -0.320 -10.075  -3.276
  414    HB   ILE  52           HB       ILE  52  -2.658 -11.056  -1.789
  415   HG12  ILE  52          2HG1      ILE  52  -0.420 -12.321  -0.575
  416   HG13  ILE  52          1HG1      ILE  52  -0.227 -10.584  -0.377
  417   HG21  ILE  52          1HG2      ILE  52  -1.905 -13.167  -2.536
  418   HG22  ILE  52          2HG2      ILE  52  -0.275 -12.562  -2.830
  419   HG23  ILE  52          3HG2      ILE  52  -1.607 -12.044  -3.863
  420   HD11  ILE  52          3HD1      ILE  52  -2.345 -12.385   0.677
  421   HD12  ILE  52          1HD1      ILE  52  -2.713 -10.684   0.392
  422   HD13  ILE  52          2HD1      ILE  52  -1.416 -11.132   1.500
  423    H    LEU  53           H        LEU  53  -1.315  -7.374  -3.117
  424    HA   LEU  53           HA       LEU  53  -3.355  -7.527  -5.059
  425    HB2  LEU  53           2HB      LEU  53  -4.337  -7.767  -2.493
  426    HB3  LEU  53           1HB      LEU  53  -4.526  -6.055  -2.824
  427    HG   LEU  53           HG       LEU  53  -6.498  -6.660  -3.708
  428   HD11  LEU  53          1HD1      LEU  53  -5.076  -6.081  -5.677
  429   HD12  LEU  53          2HD1      LEU  53  -6.462  -7.105  -6.049
  430   HD13  LEU  53          3HD1      LEU  53  -4.849  -7.809  -5.949
  431   HD21  LEU  53          3HD2      LEU  53  -7.203  -8.859  -4.117
  432   HD22  LEU  53          1HD2      LEU  53  -6.066  -8.997  -2.775
  433   HD23  LEU  53          2HD2      LEU  53  -5.557  -9.424  -4.409
  434    H    ASP  54           H        ASP  54  -3.382  -5.696  -6.241
  435    HA   ASP  54           HA       ASP  54  -1.577  -3.595  -5.496
  436    HB2  ASP  54           2HB      ASP  54  -2.018  -2.705  -7.742
  437    HB3  ASP  54           1HB      ASP  54  -1.601  -4.416  -7.800
  438    H    ILE  55           H        ILE  55  -2.079  -1.465  -5.081
  439    HA   ILE  55           HA       ILE  55  -4.832  -0.977  -4.278
  440    HB   ILE  55           HB       ILE  55  -2.258   0.443  -3.644
  441   HG12  ILE  55          2HG1      ILE  55  -4.295  -0.711  -1.745
  442   HG13  ILE  55          1HG1      ILE  55  -3.017  -1.699  -2.445
  443   HG21  ILE  55          1HG2      ILE  55  -3.799   2.212  -3.909
  444   HG22  ILE  55          2HG2      ILE  55  -3.708   1.904  -2.175
  445   HG23  ILE  55          3HG2      ILE  55  -5.086   1.312  -3.105
  446   HD11  ILE  55          3HD1      ILE  55  -2.476  -0.867  -0.199
  447   HD12  ILE  55          1HD1      ILE  55  -2.571   0.785  -0.809
  448   HD13  ILE  55          2HD1      ILE  55  -1.334  -0.312  -1.423
  449    HA   PRO  56           HA       PRO  56  -3.305   2.653  -7.387
  450    HB2  PRO  56           2HB      PRO  56  -2.490   0.575  -9.370
  451    HB3  PRO  56           1HB      PRO  56  -1.839   2.197  -9.109
  452    HG2  PRO  56           2HG      PRO  56  -0.524   0.052  -8.241
  453    HG3  PRO  56           1HG      PRO  56  -0.577   1.541  -7.279
  454    HD2  PRO  56           2HD      PRO  56  -2.024  -1.031  -6.874
  455    HD3  PRO  56           1HD      PRO  56  -1.420   0.129  -5.673
  456    H    ASP  57           H        ASP  57  -3.975   2.467 -10.037
  457    HA   ASP  57           HA       ASP  57  -5.751   2.372 -11.454
  458    HB2  ASP  57           2HB      ASP  57  -6.077  -0.176  -9.905
  459    HB3  ASP  57           1HB      ASP  57  -7.312   0.312 -11.062
  460    H    HIS  58           H        HIS  58  -8.315   2.088 -11.394
  461    HA   HIS  58           HA       HIS  58  -9.397   4.204 -10.072
  462    HB2  HIS  58           2HB      HIS  58 -10.670   1.606 -10.920
  463    HB3  HIS  58           1HB      HIS  58 -11.612   2.924 -10.232
  464    HD1  HIS  58           1HD      HIS  58 -12.473   2.287 -12.937
  465    HD2  HIS  58           2HD      HIS  58  -9.219   4.785 -12.276
  466    HE1  HIS  58           1HE      HIS  58 -12.220   3.632 -15.047
  467    HE2  HIS  58           2HE      HIS  58 -10.192   5.075 -14.655
  468    H    ASP  59           H        ASP  59  -8.450   1.211  -8.705
  469    HA   ASP  59           HA       ASP  59 -10.142   1.130  -6.456
  470    HB2  ASP  59           2HB      ASP  59  -7.462  -0.054  -7.101
  471    HB3  ASP  59           1HB      ASP  59  -8.120  -0.197  -5.474
  472    H    ALA  60           H        ALA  60  -6.929   2.549  -6.948
  473    HA   ALA  60           HA       ALA  60  -6.749   3.538  -4.273
  474    HB1  ALA  60           1HB      ALA  60  -5.116   4.340  -6.674
  475    HB2  ALA  60           2HB      ALA  60  -4.766   2.956  -5.638
  476    HB3  ALA  60           3HB      ALA  60  -4.702   4.591  -4.978
  477    H    GLU  61           H        GLU  61  -8.009   4.706  -7.267
  478    HA   GLU  61           HA       GLU  61  -8.047   7.470  -6.533
  479    HB2  GLU  61           2HB      GLU  61  -8.935   5.842  -8.827
  480    HB3  GLU  61           1HB      GLU  61  -9.884   7.291  -8.526
  481    HG2  GLU  61           2HG      GLU  61  -8.042   7.618 -10.141
  482    HG3  GLU  61           1HG      GLU  61  -7.952   8.681  -8.737
  483    H    LYS  62           H        LYS  62 -10.304   4.783  -6.390
  484    HA   LYS  62           HA       LYS  62 -12.546   6.378  -5.626
  485    HB2  LYS  62           2HB      LYS  62 -12.092   3.400  -5.406
  486    HB3  LYS  62           1HB      LYS  62 -13.631   4.209  -5.144
  487    HG2  LYS  62           2HG      LYS  62 -12.834   5.095  -7.639
  488    HG3  LYS  62           1HG      LYS  62 -12.358   3.396  -7.613
  489    HD2  LYS  62           2HD      LYS  62 -14.475   2.731  -7.818
  490    HD3  LYS  62           1HD      LYS  62 -14.983   3.750  -6.469
  491    HE2  LYS  62           2HE      LYS  62 -15.810   4.098  -9.011
  492    HE3  LYS  62           1HE      LYS  62 -15.716   5.397  -7.822
  493    HZ1  LYS  62           3HZ      LYS  62 -14.560   5.516 -10.204
  494    HZ2  LYS  62           1HZ      LYS  62 -13.283   4.850  -9.316
  495    HZ3  LYS  62           2HZ      LYS  62 -13.957   6.329  -8.848
  496    H    ILE  63           H        ILE  63  -9.865   6.152  -4.027
  497    HA   ILE  63           HA       ILE  63 -11.050   5.588  -1.415
  498    HB   ILE  63           HB       ILE  63  -8.684   4.676  -2.453
  499   HG12  ILE  63          2HG1      ILE  63  -8.538   4.852   0.435
  500   HG13  ILE  63          1HG1      ILE  63 -10.172   4.455  -0.088
  501   HG21  ILE  63          1HG2      ILE  63  -8.075   7.004  -0.638
  502   HG22  ILE  63          2HG2      ILE  63  -7.625   6.838  -2.335
  503   HG23  ILE  63          3HG2      ILE  63  -6.911   5.772  -1.125
  504   HD11  ILE  63          3HD1      ILE  63  -7.737   2.848  -0.136
  505   HD12  ILE  63          1HD1      ILE  63  -8.681   2.779  -1.624
  506   HD13  ILE  63          2HD1      ILE  63  -9.429   2.354  -0.085
  507    H    GLN  64           H        GLN  64 -11.561   7.259  -0.163
  508    HA   GLN  64           HA       GLN  64 -10.190   9.794  -0.592
  509    HB2  GLN  64           2HB      GLN  64 -13.008   9.436   0.416
  510    HB3  GLN  64           1HB      GLN  64 -12.215  10.957   0.031
  511    HG2  GLN  64           2HG      GLN  64 -13.208  10.783  -1.947
  512    HG3  GLN  64           1HG      GLN  64 -11.985   9.566  -2.313
  513   HE21  GLN  64          1HE2      GLN  64 -12.548   7.320  -1.705
  514   HE22  GLN  64          2HE2      GLN  64 -14.186   6.812  -1.914
  515    H    SER  65           H        SER  65 -11.152   7.385   1.660
  516    HA   SER  65           HA       SER  65 -10.280   9.046   3.921
  517    HB2  SER  65           2HB      SER  65 -12.275   6.934   3.600
  518    HB3  SER  65           1HB      SER  65 -11.224   6.676   4.993
  519    HG   SER  65           HG       SER  65 -13.194   8.032   5.270
  520    H    ILE  66           H        ILE  66  -8.554   8.495   5.167
  521    HA   ILE  66           HA       ILE  66  -6.517   6.916   4.056
  522    HB   ILE  66           HB       ILE  66  -6.631   7.542   6.988
  523   HG12  ILE  66          2HG1      ILE  66  -7.108   9.450   5.011
  524   HG13  ILE  66          1HG1      ILE  66  -6.613   9.763   6.672
  525   HG21  ILE  66          1HG2      ILE  66  -4.344   7.630   5.030
  526   HG22  ILE  66          2HG2      ILE  66  -4.753   6.228   6.018
  527   HG23  ILE  66          3HG2      ILE  66  -4.254   7.733   6.788
  528   HD11  ILE  66          3HD1      ILE  66  -4.768   9.410   4.322
  529   HD12  ILE  66          1HD1      ILE  66  -4.277   9.734   5.985
  530   HD13  ILE  66          2HD1      ILE  66  -5.201  10.939   5.086
  531    HA   PRO  67           HA       PRO  67  -7.754   3.658   7.452
  532    HB2  PRO  67           2HB      PRO  67 -10.339   3.783   8.298
  533    HB3  PRO  67           1HB      PRO  67  -9.010   4.605   9.122
  534    HG2  PRO  67           2HG      PRO  67 -11.008   5.707   7.186
  535    HG3  PRO  67           1HG      PRO  67 -10.398   6.418   8.691
  536    HD2  PRO  67           2HD      PRO  67  -9.489   7.173   6.261
  537    HD3  PRO  67           1HD      PRO  67  -8.449   7.155   7.700
  538    H    ASP  68           H        ASP  68 -10.253   4.795   5.221
  539    HA   ASP  68           HA       ASP  68 -11.468   2.318   4.717
  540    HB2  ASP  68           2HB      ASP  68 -12.154   4.761   4.030
  541    HB3  ASP  68           1HB      ASP  68 -11.253   4.387   2.564
  542    H    ALA  69           H        ALA  69  -8.564   3.768   3.494
  543    HA   ALA  69           HA       ALA  69  -8.235   1.982   1.301
  544    HB1  ALA  69           1HB      ALA  69  -5.955   3.472   2.510
  545    HB2  ALA  69           2HB      ALA  69  -7.229   4.352   1.665
  546    HB3  ALA  69           3HB      ALA  69  -6.292   3.123   0.815
  547    H    VAL  70           H        VAL  70  -6.760   2.275   4.486
  548    HA   VAL  70           HA       VAL  70  -5.133  -0.026   4.242
  549    HB   VAL  70           HB       VAL  70  -5.974   1.679   6.555
  550   HG11  VAL  70          1HG1      VAL  70  -5.931  -0.749   7.244
  551   HG12  VAL  70          2HG1      VAL  70  -4.836   0.317   8.123
  552   HG13  VAL  70          3HG1      VAL  70  -4.211  -0.740   6.857
  553   HG21  VAL  70          3HG2      VAL  70  -4.032   2.693   6.179
  554   HG22  VAL  70          1HG2      VAL  70  -3.852   1.704   4.731
  555   HG23  VAL  70          2HG2      VAL  70  -3.160   1.161   6.260
  556    H    GLU  71           H        GLU  71  -8.441   0.441   4.973
  557    HA   GLU  71           HA       GLU  71  -8.808  -1.995   6.422
  558    HB2  GLU  71           2HB      GLU  71 -10.544   0.205   5.457
  559    HB3  GLU  71           1HB      GLU  71 -11.311  -1.355   5.715
  560    HG2  GLU  71           2HG      GLU  71 -10.571  -1.376   8.016
  561    HG3  GLU  71           1HG      GLU  71  -9.701   0.139   7.773
  562    H    TYR  72           H        TYR  72  -9.290  -0.912   3.100
  563    HA   TYR  72           HA       TYR  72 -10.601  -3.255   2.212
  564    HB2  TYR  72           2HB      TYR  72 -10.860  -2.078   0.326
  565    HB3  TYR  72           1HB      TYR  72  -9.999  -0.766   1.124
  566    HD1  TYR  72           2HD      TYR  72  -9.564  -3.705  -1.088
  567    HD2  TYR  72           1HD      TYR  72  -7.847  -0.109   0.401
  568    HE1  TYR  72           2HE      TYR  72  -7.772  -3.873  -2.765
  569    HE2  TYR  72           1HE      TYR  72  -6.051  -0.266  -1.273
  570    HH   TYR  72           HH       TYR  72  -5.819  -3.039  -3.464
  571    H    ILE  73           H        ILE  73  -7.267  -2.151   1.943
  572    HA   ILE  73           HA       ILE  73  -6.286  -4.434   0.623
  573    HB   ILE  73           HB       ILE  73  -4.057  -3.604   1.802
  574   HG12  ILE  73          2HG1      ILE  73  -4.969  -0.903   1.677
  575   HG13  ILE  73          1HG1      ILE  73  -6.012  -1.792   2.781
  576   HG21  ILE  73          1HG2      ILE  73  -5.387  -3.102  -0.637
  577   HG22  ILE  73          2HG2      ILE  73  -3.659  -3.021  -0.300
  578   HG23  ILE  73          3HG2      ILE  73  -4.661  -1.583  -0.112
  579   HD11  ILE  73          3HD1      ILE  73  -3.355  -2.531   3.364
  580   HD12  ILE  73          1HD1      ILE  73  -4.486  -1.605   4.351
  581   HD13  ILE  73          2HD1      ILE  73  -3.409  -0.772   3.230
  582    H    ALA  74           H        ALA  74  -6.736  -3.640   3.983
  583    HA   ALA  74           HA       ALA  74  -5.198  -5.678   5.139
  584    HB1  ALA  74           1HB      ALA  74  -7.625  -4.218   6.151
  585    HB2  ALA  74           2HB      ALA  74  -5.932  -3.877   6.510
  586    HB3  ALA  74           3HB      ALA  74  -6.686  -5.346   7.130
  587    H    GLN  75           H        GLN  75  -8.511  -5.611   4.008
  588    HA   GLN  75           HA       GLN  75  -9.094  -8.258   4.924
  589    HB2  GLN  75           2HB      GLN  75 -10.631  -6.509   3.002
  590    HB3  GLN  75           1HB      GLN  75 -11.232  -7.970   3.773
  591    HG2  GLN  75           2HG      GLN  75 -11.263  -5.285   4.728
  592    HG3  GLN  75           1HG      GLN  75 -12.000  -6.726   5.426
  593   HE21  GLN  75          1HE2      GLN  75 -10.413  -4.300   6.448
  594   HE22  GLN  75          2HE2      GLN  75  -9.266  -5.005   7.529
  595    H    ASN  76           H        ASN  76  -7.606  -6.874   2.197
  596    HA   ASN  76           HA       ASN  76  -8.266  -8.736   0.201
  597    HB2  ASN  76           2HB      ASN  76  -6.249  -6.643   0.593
  598    HB3  ASN  76           1HB      ASN  76  -5.701  -7.970  -0.426
  599   HD21  ASN  76          1HD2      ASN  76  -7.687  -5.210  -0.184
  600   HD22  ASN  76          2HD2      ASN  76  -8.348  -5.260  -1.779
  601    HA   PRO  77           HA       PRO  77  -4.359 -11.220   1.463
  602    HB2  PRO  77           2HB      PRO  77  -2.969 -10.492   3.653
  603    HB3  PRO  77           1HB      PRO  77  -2.683  -9.754   2.073
  604    HG2  PRO  77           2HG      PRO  77  -4.272  -8.718   4.389
  605    HG3  PRO  77           1HG      PRO  77  -3.142  -7.853   3.330
  606    HD2  PRO  77           2HD      PRO  77  -5.853  -7.751   3.037
  607    HD3  PRO  77           1HD      PRO  77  -4.716  -7.557   1.687
  608    H    MET  78           H        MET  78  -6.154  -9.891   4.211
  609    HA   MET  78           HA       MET  78  -5.979 -12.250   5.792
  610    HB2  MET  78           2HB      MET  78  -6.993  -9.604   6.095
  611    HB3  MET  78           1HB      MET  78  -8.277 -10.729   6.514
  612    HG2  MET  78           2HG      MET  78  -6.043 -11.764   7.772
  613    HG3  MET  78           1HG      MET  78  -5.882 -10.021   7.970
  614    HE1  MET  78           3HE      MET  78  -7.445 -13.154   8.556
  615    HE2  MET  78           1HE      MET  78  -9.121 -12.839   9.007
  616    HE3  MET  78           2HE      MET  78  -7.879 -12.951  10.253
  617    H    ALA  79           H        ALA  79  -7.918 -11.309   3.147
  618    HA   ALA  79           HA       ALA  79 -10.037 -13.168   3.760
  619    HB1  ALA  79           1HB      ALA  79 -10.519 -10.935   2.771
  620    HB2  ALA  79           2HB      ALA  79 -11.185 -12.288   1.857
  621    HB3  ALA  79           3HB      ALA  79  -9.722 -11.479   1.294
  622    H    LYS  80           H        LYS  80  -7.224 -12.913   1.767
  623    HA   LYS  80           HA       LYS  80  -7.783 -14.912  -0.119
  624    HB2  LYS  80           2HB      LYS  80  -5.009 -14.440   0.919
  625    HB3  LYS  80           1HB      LYS  80  -5.529 -14.802  -0.721
  626    HG2  LYS  80           2HG      LYS  80  -6.717 -12.492  -0.565
  627    HG3  LYS  80           1HG      LYS  80  -5.573 -12.209   0.750
  628    HD2  LYS  80           2HD      LYS  80  -4.117 -11.579  -0.819
  629    HD3  LYS  80           1HD      LYS  80  -4.013 -13.282  -1.269
  630    HE2  LYS  80           2HE      LYS  80  -4.521 -11.605  -3.126
  631    HE3  LYS  80           1HE      LYS  80  -5.551 -13.033  -3.016
  632    HZ1  LYS  80           3HZ      LYS  80  -7.277 -11.781  -2.061
  633    HZ2  LYS  80           1HZ      LYS  80  -6.713 -10.843  -3.351
  634    HZ3  LYS  80           2HZ      LYS  80  -6.278 -10.449  -1.765
  635   H282  PNS 101          8H2       PNS 101   0.670  13.398 -11.839
  636   H281  PNS 101          9H2       PNS 101   1.575  12.596 -10.552
  637   H303  PNS 101          0H3       PNS 101  -1.008  14.516  -8.240
  638   H302  PNS 101          1H3       PNS 101  -0.308  12.897  -8.277
  639   H301  PNS 101          2H3       PNS 101  -1.606  13.322  -9.393
  640   H313  PNS 101          3H3       PNS 101   1.417  14.445  -8.108
  641   H312  PNS 101          4H3       PNS 101   1.721  15.638  -9.371
  642   H311  PNS 101          5H3       PNS 101   2.378  14.008  -9.521
  643    H32  PNS 101           6H3      PNS 101  -1.073  14.798 -11.194
  644    H33  PNS 101           7H3      PNS 101  -1.926  15.818  -9.731
  645    H36  PNS 101           8H3      PNS 101   2.265  15.995 -11.064
  646   H372  PNS 101          9H3       PNS 101   1.903  14.474 -13.541
  647   H371  PNS 101          0H4       PNS 101   2.543  13.656 -12.116
  648   H382  PNS 101          1H4       PNS 101   4.485  14.235 -13.180
  649   H381  PNS 101          2H4       PNS 101   3.801  15.715 -13.855
  650    H41  PNS 101           3H4      PNS 101   3.881  14.465 -10.605
  651   H422  PNS 101          4H4       PNS 101   6.183  16.180  -9.958
  652   H421  PNS 101          5H4       PNS 101   5.187  15.321  -8.783
  653   H431  PNS 101          7H4       PNS 101   6.386  13.433  -8.982
  654   H432  PNS 101          6H4       PNS 101   6.479  13.571 -10.743
  655    H44  PNS 101           8H4      PNS 101   8.385  15.495 -10.136
  Start of MODEL   15
    1    H1   MET   1           1HT      MET   1  -5.810  -7.580   7.217
    2    H2   MET   1           2HT      MET   1  -7.060  -6.944   8.206
    3    H3   MET   1           3HT      MET   1  -7.020  -8.621   7.842
    4    HA   MET   1           HA       MET   1  -6.256  -8.398  10.002
    5    HB2  MET   1           2HB      MET   1  -4.686  -9.358   7.851
    6    HB3  MET   1           1HB      MET   1  -3.578  -8.589   8.979
    7    HG2  MET   1           2HG      MET   1  -4.858  -9.980  10.764
    8    HG3  MET   1           1HG      MET   1  -5.348 -10.954   9.378
    9    HE1  MET   1           2HE      MET   1  -2.592 -11.576   7.512
   10    HE2  MET   1           3HE      MET   1  -1.291 -10.646   8.255
   11    HE3  MET   1           1HE      MET   1  -2.809  -9.856   7.830
   12    H    ASN   2           H        ASN   2  -4.550  -7.561  11.470
   13    HA   ASN   2           HA       ASN   2  -4.470  -4.732  11.370
   14    HB2  ASN   2           2HB      ASN   2  -2.655  -5.377  13.309
   15    HB3  ASN   2           1HB      ASN   2  -4.393  -5.241  13.565
   16   HD21  ASN   2          1HD2      ASN   2  -5.394  -6.934  14.384
   17   HD22  ASN   2          2HD2      ASN   2  -4.782  -8.549  14.431
   18    H    ASP   3           H        ASP   3  -2.236  -7.247  10.523
   19    HA   ASP   3           HA       ASP   3   0.168  -5.913  10.501
   20    HB2  ASP   3           2HB      ASP   3  -0.950  -8.248   9.124
   21    HB3  ASP   3           1HB      ASP   3   0.366  -7.468   8.251
   22    H    VAL   4           H        VAL   4  -2.520  -5.524   8.339
   23    HA   VAL   4           HA       VAL   4  -1.069  -4.274   6.242
   24    HB   VAL   4           HB       VAL   4  -3.256  -3.521   5.395
   25   HG11  VAL   4          1HG1      VAL   4  -2.303  -5.827   5.018
   26   HG12  VAL   4          2HG1      VAL   4  -4.046  -5.667   4.794
   27   HG13  VAL   4          3HG1      VAL   4  -3.409  -6.395   6.270
   28   HG21  VAL   4          3HG2      VAL   4  -5.153  -4.794   6.862
   29   HG22  VAL   4          1HG2      VAL   4  -4.771  -3.077   6.983
   30   HG23  VAL   4          2HG2      VAL   4  -4.065  -4.219   8.125
   31    H    LEU   5           H        LEU   5  -3.243  -2.843   8.728
   32    HA   LEU   5           HA       LEU   5  -2.552  -0.197   8.010
   33    HB2  LEU   5           2HB      LEU   5  -3.379  -0.088  10.666
   34    HB3  LEU   5           1HB      LEU   5  -4.343   0.227   9.244
   35    HG   LEU   5           HG       LEU   5  -5.420  -1.336  10.805
   36   HD11  LEU   5          1HD1      LEU   5  -4.888  -1.786   8.007
   37   HD12  LEU   5          2HD1      LEU   5  -6.401  -1.919   8.904
   38   HD13  LEU   5          3HD1      LEU   5  -5.284  -3.283   8.851
   39   HD21  LEU   5          3HD2      LEU   5  -3.829  -3.650  10.159
   40   HD22  LEU   5          1HD2      LEU   5  -4.359  -3.050  11.731
   41   HD23  LEU   5          2HD2      LEU   5  -2.872  -2.435  11.008
   42    H    THR   6           H        THR   6  -1.280  -2.491  10.294
   43    HA   THR   6           HA       THR   6   0.292  -0.782  11.836
   44    HB   THR   6           HB       THR   6  -0.141  -3.535  11.673
   45    HG1  THR   6           1HG      THR   6   1.677  -2.205  13.387
   46   HG21  THR   6          3HG2      THR   6   2.304  -4.248  12.107
   47   HG22  THR   6          1HG2      THR   6   2.704  -2.850  11.111
   48   HG23  THR   6          2HG2      THR   6   1.709  -4.148  10.449
   49    H    ARG   7           H        ARG   7   1.322  -2.776   9.094
   50    HA   ARG   7           HA       ARG   7   3.863  -1.494   8.940
   51    HB2  ARG   7           2HB      ARG   7   3.579  -3.857   8.337
   52    HB3  ARG   7           1HB      ARG   7   2.524  -3.392   7.009
   53    HG2  ARG   7           2HG      ARG   7   5.196  -2.148   7.036
   54    HG3  ARG   7           1HG      ARG   7   5.141  -3.884   6.725
   55    HD2  ARG   7           2HD      ARG   7   3.088  -2.783   5.181
   56    HD3  ARG   7           1HD      ARG   7   4.455  -1.686   4.993
   57    HE   ARG   7           HE       ARG   7   4.259  -4.408   4.044
   58   HH11  ARG   7          1HH1      ARG   7   6.368  -1.748   4.821
   59   HH12  ARG   7          2HH1      ARG   7   7.660  -2.309   3.812
   60   HH21  ARG   7          1HH2      ARG   7   5.953  -5.156   2.713
   61   HH22  ARG   7          2HH2      ARG   7   7.424  -4.247   2.613
   62    H    VAL   8           H        VAL   8   0.920  -1.491   6.986
   63    HA   VAL   8           HA       VAL   8   1.818   0.183   4.949
   64    HB   VAL   8           HB       VAL   8  -0.441  -1.177   5.250
   65   HG11  VAL   8          1HG1      VAL   8  -2.343   0.256   5.660
   66   HG12  VAL   8          2HG1      VAL   8  -1.282   1.642   5.913
   67   HG13  VAL   8          3HG1      VAL   8  -1.261   0.295   7.052
   68   HG21  VAL   8          3HG2      VAL   8  -0.776   1.308   3.665
   69   HG22  VAL   8          1HG2      VAL   8  -1.033  -0.375   3.204
   70   HG23  VAL   8          2HG2      VAL   8   0.603   0.276   3.286
   71    H    LEU   9           H        LEU   9   0.018   1.000   7.915
   72    HA   LEU   9           HA       LEU   9  -0.116   3.766   7.473
   73    HB2  LEU   9           2HB      LEU   9  -1.076   3.869   9.510
   74    HB3  LEU   9           1HB      LEU   9  -1.103   2.126   9.365
   75    HG   LEU   9           HG       LEU   9   1.287   2.366  10.514
   76   HD11  LEU   9          1HD1      LEU   9   0.680   4.969  10.473
   77   HD12  LEU   9          2HD1      LEU   9   1.662   4.230  11.738
   78   HD13  LEU   9          3HD1      LEU   9  -0.054   4.528  12.015
   79   HD21  LEU   9          3HD2      LEU   9   0.141   2.060  12.694
   80   HD22  LEU   9          1HD2      LEU   9  -0.491   1.033  11.408
   81   HD23  LEU   9          2HD2      LEU   9  -1.383   2.469  11.905
   82    H    GLU  10           H        GLU  10   2.322   1.823   9.165
   83    HA   GLU  10           HA       GLU  10   3.923   3.978  10.009
   84    HB2  GLU  10           2HB      GLU  10   5.539   2.372  10.606
   85    HB3  GLU  10           1HB      GLU  10   3.993   1.560  10.816
   86    HG2  GLU  10           2HG      GLU  10   4.522  -0.005   9.340
   87    HG3  GLU  10           1HG      GLU  10   5.016   1.190   8.141
   88    H    VAL  11           H        VAL  11   3.794   2.122   7.070
   89    HA   VAL  11           HA       VAL  11   6.219   2.869   5.940
   90    HB   VAL  11           HB       VAL  11   3.688   1.831   4.898
   91   HG11  VAL  11          1HG1      VAL  11   5.194   2.007   2.615
   92   HG12  VAL  11          2HG1      VAL  11   5.415   3.589   3.359
   93   HG13  VAL  11          3HG1      VAL  11   3.790   3.002   3.000
   94   HG21  VAL  11          3HG2      VAL  11   5.824   0.520   3.731
   95   HG22  VAL  11          1HG2      VAL  11   4.917  -0.006   5.150
   96   HG23  VAL  11          2HG2      VAL  11   6.396   0.934   5.347
   97    H    VAL  12           H        VAL  12   3.021   4.253   5.377
   98    HA   VAL  12           HA       VAL  12   3.910   6.393   3.767
   99    HB   VAL  12           HB       VAL  12   1.742   6.960   3.593
  100   HG11  VAL  12          1HG1      VAL  12   0.368   5.139   3.685
  101   HG12  VAL  12          2HG1      VAL  12   0.909   4.673   5.298
  102   HG13  VAL  12          3HG1      VAL  12   1.927   4.342   3.897
  103   HG21  VAL  12          3HG2      VAL  12   1.373   6.587   6.564
  104   HG22  VAL  12          1HG2      VAL  12   0.234   7.344   5.452
  105   HG23  VAL  12          2HG2      VAL  12   1.790   8.108   5.774
  106    H    LYS  13           H        LYS  13   3.017   6.264   7.207
  107    HA   LYS  13           HA       LYS  13   3.460   8.916   7.867
  108    HB2  LYS  13           2HB      LYS  13   3.754   6.378   9.459
  109    HB3  LYS  13           1HB      LYS  13   4.040   7.955  10.179
  110    HG2  LYS  13           2HG      LYS  13   1.599   6.601   9.887
  111    HG3  LYS  13           1HG      LYS  13   1.875   8.230  10.521
  112    HD2  LYS  13           2HD      LYS  13   1.877   8.012   7.586
  113    HD3  LYS  13           1HD      LYS  13   0.332   7.662   8.362
  114    HE2  LYS  13           2HE      LYS  13   1.347   9.942   9.643
  115    HE3  LYS  13           1HE      LYS  13   1.620  10.193   7.919
  116    HZ1  LYS  13           3HZ      LYS  13  -0.708  10.647   9.231
  117    HZ2  LYS  13           1HZ      LYS  13  -0.985   9.142   8.509
  118    HZ3  LYS  13           2HZ      LYS  13  -0.547  10.470   7.557
  119    H    ASN  14           H        ASN  14   5.764   6.225   7.775
  120    HA   ASN  14           HA       ASN  14   7.952   7.922   8.534
  121    HB2  ASN  14           2HB      ASN  14   7.913   5.041   7.623
  122    HB3  ASN  14           1HB      ASN  14   9.328   5.886   8.244
  123   HD21  ASN  14          1HD2      ASN  14   6.956   3.800   9.043
  124   HD22  ASN  14          2HD2      ASN  14   6.894   4.056  10.750
  125    H    PHE  15           H        PHE  15   6.276   7.500   5.748
  126    HA   PHE  15           HA       PHE  15   8.366   7.350   3.837
  127    HB2  PHE  15           2HB      PHE  15   5.503   7.457   3.813
  128    HB3  PHE  15           1HB      PHE  15   6.131   8.654   2.685
  129    HD1  PHE  15           2HD      PHE  15   8.070   5.655   3.372
  130    HD2  PHE  15           1HD      PHE  15   5.170   7.424   0.808
  131    HE1  PHE  15           2HE      PHE  15   8.459   3.880   1.713
  132    HE2  PHE  15           1HE      PHE  15   5.554   5.652  -0.855
  133    HZ   PHE  15           HZ       PHE  15   7.201   3.878  -0.404
  134    H    GLU  16           H        GLU  16   6.967   9.873   5.698
  135    HA   GLU  16           HA       GLU  16   8.258  11.881   6.039
  136    HB2  GLU  16           2HB      GLU  16   9.478  12.900   4.319
  137    HB3  GLU  16           1HB      GLU  16   9.726  11.182   4.051
  138    HG2  GLU  16           2HG      GLU  16   8.984  11.400   1.988
  139    HG3  GLU  16           1HG      GLU  16   7.429  11.951   2.603
  140    H    LYS  17           H        LYS  17   5.480  10.932   4.774
  141    HA   LYS  17           HA       LYS  17   4.481  13.354   3.649
  142    HB2  LYS  17           2HB      LYS  17   3.523  10.645   4.070
  143    HB3  LYS  17           1HB      LYS  17   2.281  11.841   4.419
  144    HG2  LYS  17           2HG      LYS  17   1.908  11.513   2.198
  145    HG3  LYS  17           1HG      LYS  17   3.064  12.843   2.118
  146    HD2  LYS  17           2HD      LYS  17   4.159  10.088   2.154
  147    HD3  LYS  17           1HD      LYS  17   3.339  10.613   0.683
  148    HE2  LYS  17           2HE      LYS  17   5.873  11.561   1.895
  149    HE3  LYS  17           1HE      LYS  17   5.448  11.327   0.200
  150    HZ1  LYS  17           3HZ      LYS  17   5.571  13.613   0.422
  151    HZ2  LYS  17           1HZ      LYS  17   4.848  13.622   1.953
  152    HZ3  LYS  17           2HZ      LYS  17   3.911  13.326   0.576
  153    H    VAL  18           H        VAL  18   3.995  11.656   6.738
  154    HA   VAL  18           HA       VAL  18   3.952  13.930   8.329
  155    HB   VAL  18           HB       VAL  18   1.378  13.797   8.830
  156   HG11  VAL  18          1HG1      VAL  18   2.989  15.601   7.602
  157   HG12  VAL  18          2HG1      VAL  18   1.278  15.856   7.945
  158   HG13  VAL  18          3HG1      VAL  18   1.784  15.299   6.350
  159   HG21  VAL  18          3HG2      VAL  18   1.260  11.946   7.008
  160   HG22  VAL  18          1HG2      VAL  18   1.222  13.319   5.909
  161   HG23  VAL  18          2HG2      VAL  18  -0.027  13.148   7.134
  162    H    ASP  19           H        ASP  19   3.125  13.512  10.533
  163    HA   ASP  19           HA       ASP  19   3.800  10.877  11.360
  164    HB2  ASP  19           2HB      ASP  19   3.402  13.454  12.604
  165    HB3  ASP  19           1HB      ASP  19   2.604  12.188  13.531
  166    H    ALA  20           H        ALA  20   2.515   9.226  12.037
  167    HA   ALA  20           HA       ALA  20  -0.149   9.118  11.120
  168    HB1  ALA  20           1HB      ALA  20   0.211   7.080  13.030
  169    HB2  ALA  20           2HB      ALA  20   1.763   7.303  12.221
  170    HB3  ALA  20           3HB      ALA  20   0.317   6.955  11.274
  171    H    SER  21           H        SER  21   1.219  10.297  14.015
  172    HA   SER  21           HA       SER  21  -0.927   9.833  15.789
  173    HB2  SER  21           2HB      SER  21   1.550  11.409  15.787
  174    HB3  SER  21           1HB      SER  21   0.251  12.122  16.742
  175    HG   SER  21           HG       SER  21   0.547   9.417  17.105
  176    H    LYS  22           H        LYS  22  -0.494  12.030  13.207
  177    HA   LYS  22           HA       LYS  22  -2.467  13.916  14.155
  178    HB2  LYS  22           2HB      LYS  22  -1.657  15.328  12.590
  179    HB3  LYS  22           1HB      LYS  22  -0.308  14.200  12.542
  180    HG2  LYS  22           2HG      LYS  22  -1.785  12.991  10.746
  181    HG3  LYS  22           1HG      LYS  22  -2.534  14.583  10.603
  182    HD2  LYS  22           2HD      LYS  22  -0.303  13.765   9.257
  183    HD3  LYS  22           1HD      LYS  22  -0.756  15.444   9.544
  184    HE2  LYS  22           2HE      LYS  22   1.004  13.808  11.363
  185    HE3  LYS  22           1HE      LYS  22   1.599  14.928  10.138
  186    HZ1  LYS  22           3HZ      LYS  22   1.284  16.625  11.507
  187    HZ2  LYS  22           1HZ      LYS  22   0.927  15.523  12.741
  188    HZ3  LYS  22           2HZ      LYS  22  -0.320  16.183  11.809
  189    H    VAL  23           H        VAL  23  -2.399  11.014  12.396
  190    HA   VAL  23           HA       VAL  23  -4.607  11.463  10.672
  191    HB   VAL  23           HB       VAL  23  -4.619   9.077  10.293
  192   HG11  VAL  23          1HG1      VAL  23  -2.563   8.905   9.263
  193   HG12  VAL  23          2HG1      VAL  23  -1.712   9.694  10.591
  194   HG13  VAL  23          3HG1      VAL  23  -2.703  10.649   9.487
  195   HG21  VAL  23          3HG2      VAL  23  -4.196   7.672  11.961
  196   HG22  VAL  23          1HG2      VAL  23  -3.583   8.989  12.960
  197   HG23  VAL  23          2HG2      VAL  23  -2.494   8.125  11.875
  198    H    THR  24           H        THR  24  -6.699  11.517  11.131
  199    HA   THR  24           HA       THR  24  -7.614  10.386  13.655
  200    HB   THR  24           HB       THR  24  -7.882  13.000  12.663
  201    HG1  THR  24           1HG      THR  24  -9.607  12.531  14.639
  202   HG21  THR  24          3HG2      THR  24  -9.914  11.856  11.461
  203   HG22  THR  24          1HG2      THR  24 -10.070  13.438  12.224
  204   HG23  THR  24          2HG2      THR  24 -10.645  11.995  13.059
  205    HA   PRO  25           HA       PRO  25 -10.530   7.710  11.746
  206    HB2  PRO  25           2HB      PRO  25 -12.980   8.544  12.720
  207    HB3  PRO  25           1HB      PRO  25 -11.855   7.494  13.587
  208    HG2  PRO  25           2HG      PRO  25 -12.291  10.440  13.850
  209    HG3  PRO  25           1HG      PRO  25 -11.993   9.231  15.113
  210    HD2  PRO  25           2HD      PRO  25 -10.053  10.879  14.265
  211    HD3  PRO  25           1HD      PRO  25  -9.708   9.195  14.716
  212    H    GLU  26           H        GLU  26 -11.480  11.112  11.658
  213    HA   GLU  26           HA       GLU  26 -12.822  10.660   9.104
  214    HB2  GLU  26           2HB      GLU  26 -13.569  12.155  11.336
  215    HB3  GLU  26           1HB      GLU  26 -13.059  13.351  10.153
  216    HG2  GLU  26           2HG      GLU  26 -15.350  11.471  10.091
  217    HG3  GLU  26           1HG      GLU  26 -15.262  13.168   9.619
  218    H    SER  27           H        SER  27  -9.841  11.119   9.916
  219    HA   SER  27           HA       SER  27  -9.031  13.534   8.713
  220    HB2  SER  27           2HB      SER  27  -7.722  11.107   9.738
  221    HB3  SER  27           1HB      SER  27  -6.838  11.929   8.454
  222    HG   SER  27           HG       SER  27  -7.882  13.348  10.659
  223    H    HIS  28           H        HIS  28  -8.652  14.088   6.659
  224    HA   HIS  28           HA       HIS  28  -9.425  12.290   4.571
  225    HB2  HIS  28           2HB      HIS  28  -8.801  15.176   4.794
  226    HB3  HIS  28           1HB      HIS  28  -8.504  14.435   3.225
  227    HD1  HIS  28           1HD      HIS  28 -11.056  12.444   3.635
  228    HD2  HIS  28           2HD      HIS  28 -10.997  16.597   3.767
  229    HE1  HIS  28           1HE      HIS  28 -13.409  13.166   3.117
  230    HE2  HIS  28           2HE      HIS  28 -13.368  15.680   3.288
  231    H    PHE  29           H        PHE  29  -8.118  11.586   2.837
  232    HA   PHE  29           HA       PHE  29  -5.498  10.825   3.570
  233    HB2  PHE  29           2HB      PHE  29  -7.264   9.835   1.816
  234    HB3  PHE  29           1HB      PHE  29  -6.275  10.772   0.701
  235    HD1  PHE  29           2HD      PHE  29  -3.857  10.193   2.834
  236    HD2  PHE  29           1HD      PHE  29  -6.484   7.889   0.405
  237    HE1  PHE  29           2HE      PHE  29  -2.201   8.374   2.775
  238    HE2  PHE  29           1HE      PHE  29  -4.834   6.065   0.342
  239    HZ   PHE  29           HZ       PHE  29  -2.688   6.307   1.527
  240    H    VAL  30           H        VAL  30  -4.454  11.253   0.773
  241    HA   VAL  30           HA       VAL  30  -2.594  13.092   1.007
  242    HB   VAL  30           HB       VAL  30  -2.385  13.209  -1.254
  243   HG11  VAL  30          1HG1      VAL  30  -3.207  11.230  -2.297
  244   HG12  VAL  30          2HG1      VAL  30  -4.553  11.121  -1.163
  245   HG13  VAL  30          3HG1      VAL  30  -2.903  10.847  -0.602
  246   HG21  VAL  30          3HG2      VAL  30  -3.900  14.607  -2.150
  247   HG22  VAL  30          1HG2      VAL  30  -5.209  13.996  -1.138
  248   HG23  VAL  30          2HG2      VAL  30  -4.747  13.127  -2.601
  249    H    LYS  31           H        LYS  31  -5.960  13.843   0.702
  250    HA   LYS  31           HA       LYS  31  -5.737  16.611   0.227
  251    HB2  LYS  31           2HB      LYS  31  -7.981  15.138   1.616
  252    HB3  LYS  31           1HB      LYS  31  -8.078  16.737   0.892
  253    HG2  LYS  31           2HG      LYS  31  -8.956  15.564  -0.820
  254    HG3  LYS  31           1HG      LYS  31  -7.255  15.365  -1.243
  255    HD2  LYS  31           2HD      LYS  31  -7.597  13.291   0.463
  256    HD3  LYS  31           1HD      LYS  31  -9.207  13.396  -0.253
  257    HE2  LYS  31           2HE      LYS  31  -8.248  13.240  -2.480
  258    HE3  LYS  31           1HE      LYS  31  -6.622  13.208  -1.797
  259    HZ1  LYS  31           3HZ      LYS  31  -8.671  11.172  -1.138
  260    HZ2  LYS  31           1HZ      LYS  31  -7.005  11.102  -0.855
  261    HZ3  LYS  31           2HZ      LYS  31  -7.600  10.998  -2.435
  262    H    ASP  32           H        ASP  32  -6.244  14.789   3.240
  263    HA   ASP  32           HA       ASP  32  -5.938  17.176   4.815
  264    HB2  ASP  32           2HB      ASP  32  -7.169  14.649   5.189
  265    HB3  ASP  32           1HB      ASP  32  -5.934  14.822   6.431
  266    H    LEU  33           H        LEU  33  -3.761  15.577   3.213
  267    HA   LEU  33           HA       LEU  33  -1.438  16.081   3.611
  268    HB2  LEU  33           2HB      LEU  33  -2.092  15.275   6.448
  269    HB3  LEU  33           1HB      LEU  33  -0.501  15.715   5.858
  270    HG   LEU  33           HG       LEU  33  -2.610  17.733   5.422
  271   HD11  LEU  33          1HD1      LEU  33  -2.730  16.549   7.842
  272   HD12  LEU  33          2HD1      LEU  33  -3.097  18.250   7.556
  273   HD13  LEU  33          3HD1      LEU  33  -1.504  17.780   8.148
  274   HD21  LEU  33          3HD2      LEU  33  -0.867  19.234   5.723
  275   HD22  LEU  33          1HD2      LEU  33  -0.066  17.850   4.979
  276   HD23  LEU  33          2HD2      LEU  33   0.060  18.113   6.719
  277    H    GLY  34           H        GLY  34  -2.827  13.897   2.534
  278    HA2  GLY  34           2HA      GLY  34  -1.531  11.524   3.663
  279    HA3  GLY  34           1HA      GLY  34  -2.803  11.529   2.450
  280    H    LEU  35           H        LEU  35  -1.129   9.889   1.629
  281    HA   LEU  35           HA       LEU  35   1.288  10.798   0.492
  282    HB2  LEU  35           2HB      LEU  35  -0.439   8.399  -0.087
  283    HB3  LEU  35           1HB      LEU  35   1.104   8.673  -0.872
  284    HG   LEU  35           HG       LEU  35   0.813   7.178   1.340
  285   HD11  LEU  35          1HD1      LEU  35   3.246   8.899   0.986
  286   HD12  LEU  35          2HD1      LEU  35   2.830   7.617  -0.151
  287   HD13  LEU  35          3HD1      LEU  35   3.147   7.227   1.540
  288   HD21  LEU  35          3HD2      LEU  35   0.165   8.662   2.960
  289   HD22  LEU  35          1HD2      LEU  35   1.050  10.005   2.239
  290   HD23  LEU  35          2HD2      LEU  35   1.918   8.756   3.130
  291    H    ASN  36           H        ASN  36   1.659  11.938  -1.301
  292    HA   ASN  36           HA       ASN  36  -0.458  12.911  -2.900
  293    HB2  ASN  36           2HB      ASN  36   1.151  14.180  -4.038
  294    HB3  ASN  36           1HB      ASN  36   1.814  14.010  -2.415
  295   HD21  ASN  36          1HD2      ASN  36   2.314  13.517  -5.712
  296   HD22  ASN  36          2HD2      ASN  36   3.799  12.645  -5.608
  297    H    SER  37           H        SER  37   0.673  12.821  -5.504
  298    HA   SER  37           HA       SER  37  -0.468  10.433  -6.453
  299    HB2  SER  37           2HB      SER  37  -0.208  11.337  -8.523
  300    HB3  SER  37           1HB      SER  37   0.148  12.798  -7.602
  301    H    LEU  38           H        LEU  38   2.915  11.457  -6.691
  302    HA   LEU  38           HA       LEU  38   3.870   8.921  -7.446
  303    HB2  LEU  38           2HB      LEU  38   5.952   9.851  -7.486
  304    HB3  LEU  38           1HB      LEU  38   4.976  11.292  -7.574
  305    HG   LEU  38           HG       LEU  38   6.851  10.440  -5.534
  306   HD11  LEU  38          1HD1      LEU  38   5.640  13.132  -6.071
  307   HD12  LEU  38          2HD1      LEU  38   6.986  12.464  -6.995
  308   HD13  LEU  38          3HD1      LEU  38   7.169  12.774  -5.268
  309   HD21  LEU  38          3HD2      LEU  38   4.079  11.171  -4.793
  310   HD22  LEU  38          1HD2      LEU  38   5.396  11.878  -3.858
  311   HD23  LEU  38          2HD2      LEU  38   5.233  10.126  -3.964
  312    H    ASP  39           H        ASP  39   2.844  10.117  -4.457
  313    HA   ASP  39           HA       ASP  39   4.444   8.354  -2.829
  314    HB2  ASP  39           2HB      ASP  39   2.177  10.248  -2.273
  315    HB3  ASP  39           1HB      ASP  39   2.733   9.115  -1.044
  316    H    VAL  40           H        VAL  40   0.966   8.647  -2.577
  317    HA   VAL  40           HA       VAL  40   0.206   6.265  -1.742
  318    HB   VAL  40           HB       VAL  40  -1.143   8.258  -3.043
  319   HG11  VAL  40          1HG1      VAL  40  -0.566   6.814  -5.157
  320   HG12  VAL  40          2HG1      VAL  40  -2.160   7.547  -4.976
  321   HG13  VAL  40          3HG1      VAL  40  -1.927   5.840  -4.600
  322   HG21  VAL  40          3HG2      VAL  40  -1.761   5.835  -1.586
  323   HG22  VAL  40          1HG2      VAL  40  -3.025   6.235  -2.749
  324   HG23  VAL  40          2HG2      VAL  40  -2.543   7.414  -1.529
  325    H    VAL  41           H        VAL  41   1.391   6.869  -5.013
  326    HA   VAL  41           HA       VAL  41   0.848   4.261  -5.991
  327    HB   VAL  41           HB       VAL  41   3.004   6.055  -7.071
  328   HG11  VAL  41          1HG1      VAL  41   2.037   3.569  -7.839
  329   HG12  VAL  41          2HG1      VAL  41   3.034   4.659  -8.805
  330   HG13  VAL  41          3HG1      VAL  41   1.277   4.702  -8.957
  331   HG21  VAL  41          3HG2      VAL  41   0.301   6.299  -8.216
  332   HG22  VAL  41          1HG2      VAL  41   1.541   7.527  -7.955
  333   HG23  VAL  41          2HG2      VAL  41   0.518   7.008  -6.616
  334    H    GLU  42           H        GLU  42   3.731   5.810  -4.616
  335    HA   GLU  42           HA       GLU  42   5.441   3.593  -4.985
  336    HB2  GLU  42           2HB      GLU  42   5.542   6.157  -3.535
  337    HB3  GLU  42           1HB      GLU  42   6.558   4.881  -2.875
  338    HG2  GLU  42           2HG      GLU  42   7.240   4.640  -5.427
  339    HG3  GLU  42           1HG      GLU  42   6.759   6.336  -5.443
  340    H    VAL  43           H        VAL  43   3.466   4.680  -2.306
  341    HA   VAL  43           HA       VAL  43   4.248   2.679  -0.474
  342    HB   VAL  43           HB       VAL  43   3.209   4.206   0.797
  343   HG11  VAL  43          1HG1      VAL  43   1.281   5.631  -0.216
  344   HG12  VAL  43          2HG1      VAL  43   1.870   4.990  -1.748
  345   HG13  VAL  43          3HG1      VAL  43   2.947   5.928  -0.713
  346   HG21  VAL  43          3HG2      VAL  43   1.705   2.248   0.947
  347   HG22  VAL  43          1HG2      VAL  43   0.680   3.014  -0.259
  348   HG23  VAL  43          2HG2      VAL  43   0.912   3.783   1.305
  349    H    VAL  44           H        VAL  44   1.529   3.004  -2.685
  350    HA   VAL  44           HA       VAL  44   0.144   0.676  -1.993
  351    HB   VAL  44           HB       VAL  44  -0.733   0.737  -4.351
  352   HG11  VAL  44          1HG1      VAL  44  -1.089   2.593  -2.231
  353   HG12  VAL  44          2HG1      VAL  44  -2.264   2.042  -3.425
  354   HG13  VAL  44          3HG1      VAL  44  -1.257   3.450  -3.762
  355   HG21  VAL  44          3HG2      VAL  44   1.236   2.996  -4.535
  356   HG22  VAL  44          1HG2      VAL  44  -0.153   2.861  -5.612
  357   HG23  VAL  44          2HG2      VAL  44   1.076   1.596  -5.594
  358    H    PHE  45           H        PHE  45   2.866   1.245  -4.124
  359    HA   PHE  45           HA       PHE  45   2.980  -1.337  -5.267
  360    HB2  PHE  45           2HB      PHE  45   4.490   1.103  -5.377
  361    HB3  PHE  45           1HB      PHE  45   5.591  -0.255  -5.162
  362    HD1  PHE  45           1HD      PHE  45   5.211  -2.272  -6.725
  363    HD2  PHE  45           2HD      PHE  45   3.755   1.649  -7.495
  364    HE1  PHE  45           1HE      PHE  45   5.041  -2.813  -9.124
  365    HE2  PHE  45           2HE      PHE  45   3.581   1.121  -9.894
  366    HZ   PHE  45           HZ       PHE  45   4.225  -1.113 -10.711
  367    H    ALA  46           H        ALA  46   4.174   0.091  -2.353
  368    HA   ALA  46           HA       ALA  46   6.001  -1.922  -1.602
  369    HB1  ALA  46           1HB      ALA  46   5.229  -0.841   0.768
  370    HB2  ALA  46           2HB      ALA  46   4.805   0.443  -0.365
  371    HB3  ALA  46           3HB      ALA  46   6.461  -0.160  -0.296
  372    H    ILE  47           H        ILE  47   3.251  -1.186   0.420
  373    HA   ILE  47           HA       ILE  47   2.874  -3.519   1.677
  374    HB   ILE  47           HB       ILE  47   0.318  -3.031   1.475
  375   HG12  ILE  47          2HG1      ILE  47   1.256  -1.311  -0.496
  376   HG13  ILE  47          1HG1      ILE  47  -0.350  -1.291   0.225
  377   HG21  ILE  47          1HG2      ILE  47   1.882  -0.792   2.680
  378   HG22  ILE  47          2HG2      ILE  47   2.064  -2.429   3.307
  379   HG23  ILE  47          3HG2      ILE  47   0.481  -1.652   3.316
  380   HD11  ILE  47          3HD1      ILE  47   0.154   0.481   1.609
  381   HD12  ILE  47          1HD1      ILE  47   1.046   0.879   0.141
  382   HD13  ILE  47          2HD1      ILE  47   1.892   0.187   1.524
  383    H    GLU  48           H        GLU  48   1.481  -2.779  -1.517
  384    HA   GLU  48           HA       GLU  48   0.162  -5.189  -1.929
  385    HB2  GLU  48           2HB      GLU  48   1.518  -3.423  -3.974
  386    HB3  GLU  48           1HB      GLU  48   0.353  -4.687  -4.346
  387    HG2  GLU  48           2HG      GLU  48  -0.298  -2.109  -4.067
  388    HG3  GLU  48           1HG      GLU  48  -1.407  -3.435  -3.729
  389    H    GLN  49           H        GLN  49   3.515  -4.326  -2.350
  390    HA   GLN  49           HA       GLN  49   4.399  -6.574  -3.764
  391    HB2  GLN  49           2HB      GLN  49   5.776  -4.736  -1.812
  392    HB3  GLN  49           1HB      GLN  49   6.622  -6.069  -2.585
  393    HG2  GLN  49           2HG      GLN  49   5.179  -4.447  -4.498
  394    HG3  GLN  49           1HG      GLN  49   6.336  -3.503  -3.561
  395   HE21  GLN  49          1HE2      GLN  49   6.551  -3.966  -6.311
  396   HE22  GLN  49          2HE2      GLN  49   7.963  -4.919  -6.596
  397    H    GLU  50           H        GLU  50   3.948  -6.019  -0.306
  398    HA   GLU  50           HA       GLU  50   4.488  -8.846   0.156
  399    HB2  GLU  50           2HB      GLU  50   6.021  -7.753   1.505
  400    HB3  GLU  50           1HB      GLU  50   4.929  -6.416   1.829
  401    HG2  GLU  50           2HG      GLU  50   5.426  -7.971   3.753
  402    HG3  GLU  50           1HG      GLU  50   3.726  -7.638   3.427
  403    H    PHE  51           H        PHE  51   1.996  -7.851  -0.818
  404    HA   PHE  51           HA       PHE  51   0.277  -8.737   1.346
  405    HB2  PHE  51           2HB      PHE  51   0.002  -6.222  -0.246
  406    HB3  PHE  51           1HB      PHE  51  -1.439  -7.028   0.365
  407    HD1  PHE  51           2HD      PHE  51   0.645  -7.944   2.787
  408    HD2  PHE  51           1HD      PHE  51  -0.974  -4.342   1.203
  409    HE1  PHE  51           2HE      PHE  51   0.966  -6.848   4.965
  410    HE2  PHE  51           1HE      PHE  51  -0.656  -3.239   3.379
  411    HZ   PHE  51           HZ       PHE  51   0.316  -4.492   5.264
  412    H    ILE  52           H        ILE  52   1.236  -9.047  -1.845
  413    HA   ILE  52           HA       ILE  52   0.538 -10.375  -3.552
  414    HB   ILE  52           HB       ILE  52  -1.755 -11.581  -2.180
  415   HG12  ILE  52          2HG1      ILE  52   0.503 -12.793  -0.962
  416   HG13  ILE  52          1HG1      ILE  52   0.613 -11.062  -0.667
  417   HG21  ILE  52          1HG2      ILE  52   0.111 -12.244  -4.160
  418   HG22  ILE  52          2HG2      ILE  52  -1.201 -13.246  -3.538
  419   HG23  ILE  52          3HG2      ILE  52   0.407 -13.354  -2.822
  420   HD11  ILE  52          3HD1      ILE  52  -1.418 -13.016   0.255
  421   HD12  ILE  52          1HD1      ILE  52  -1.907 -11.343  -0.006
  422   HD13  ILE  52          2HD1      ILE  52  -0.615 -11.715   1.134
  423    H    LEU  53           H        LEU  53  -0.571  -7.744  -3.245
  424    HA   LEU  53           HA       LEU  53  -2.633  -7.885  -5.168
  425    HB2  LEU  53           2HB      LEU  53  -3.574  -8.298  -2.626
  426    HB3  LEU  53           1HB      LEU  53  -3.792  -6.569  -2.821
  427    HG   LEU  53           HG       LEU  53  -5.828  -7.651  -3.453
  428   HD11  LEU  53          1HD1      LEU  53  -4.458  -6.953  -6.036
  429   HD12  LEU  53          2HD1      LEU  53  -4.946  -5.743  -4.850
  430   HD13  LEU  53          3HD1      LEU  53  -6.161  -6.765  -5.616
  431   HD21  LEU  53          3HD2      LEU  53  -5.559  -9.814  -4.028
  432   HD22  LEU  53          1HD2      LEU  53  -3.994  -9.528  -4.787
  433   HD23  LEU  53          2HD2      LEU  53  -5.479  -9.158  -5.663
  434    H    ASP  54           H        ASP  54  -2.747  -6.006  -6.267
  435    HA   ASP  54           HA       ASP  54  -1.085  -3.830  -5.348
  436    HB2  ASP  54           2HB      ASP  54  -1.195  -2.991  -7.603
  437    HB3  ASP  54           1HB      ASP  54  -0.876  -4.722  -7.670
  438    H    ILE  55           H        ILE  55  -1.789  -1.741  -4.989
  439    HA   ILE  55           HA       ILE  55  -4.632  -1.467  -4.471
  440    HB   ILE  55           HB       ILE  55  -2.292   0.270  -3.705
  441   HG12  ILE  55          2HG1      ILE  55  -4.179  -1.276  -1.927
  442   HG13  ILE  55          1HG1      ILE  55  -2.672  -1.956  -2.532
  443   HG21  ILE  55          1HG2      ILE  55  -3.945   1.856  -3.870
  444   HG22  ILE  55          2HG2      ILE  55  -4.166   1.312  -2.207
  445   HG23  ILE  55          3HG2      ILE  55  -5.231   0.714  -3.479
  446   HD11  ILE  55          3HD1      ILE  55  -2.090  -1.187  -0.440
  447   HD12  ILE  55          1HD1      ILE  55  -3.097   0.255  -0.577
  448   HD13  ILE  55          2HD1      ILE  55  -1.590   0.143  -1.486
  449    HA   PRO  56           HA       PRO  56  -3.040   2.153  -7.611
  450    HB2  PRO  56           2HB      PRO  56  -2.277  -0.060  -9.476
  451    HB3  PRO  56           1HB      PRO  56  -1.620   1.576  -9.347
  452    HG2  PRO  56           2HG      PRO  56  -0.300  -0.502  -8.328
  453    HG3  PRO  56           1HG      PRO  56  -0.335   1.059  -7.490
  454    HD2  PRO  56           2HD      PRO  56  -1.743  -1.473  -6.834
  455    HD3  PRO  56           1HD      PRO  56  -1.185  -0.177  -5.758
  456    H    ASP  57           H        ASP  57  -3.819   2.072 -10.148
  457    HA   ASP  57           HA       ASP  57  -5.583   1.891 -11.580
  458    HB2  ASP  57           2HB      ASP  57  -5.757  -0.618 -10.021
  459    HB3  ASP  57           1HB      ASP  57  -7.237  -0.121 -10.835
  460    H    HIS  58           H        HIS  58  -8.062   1.961 -11.596
  461    HA   HIS  58           HA       HIS  58  -9.037   4.081 -10.255
  462    HB2  HIS  58           2HB      HIS  58 -10.472   1.582 -11.135
  463    HB3  HIS  58           1HB      HIS  58 -11.335   2.952 -10.445
  464    HD1  HIS  58           1HD      HIS  58 -12.001   2.173 -13.278
  465    HD2  HIS  58           2HD      HIS  58  -9.005   4.892 -12.332
  466    HE1  HIS  58           1HE      HIS  58 -11.688   3.573 -15.343
  467    HE2  HIS  58           2HE      HIS  58  -9.811   5.154 -14.776
  468    H    ASP  59           H        ASP  59  -8.466   0.945  -8.922
  469    HA   ASP  59           HA       ASP  59 -10.139   1.114  -6.659
  470    HB2  ASP  59           2HB      ASP  59  -7.532  -0.381  -6.664
  471    HB3  ASP  59           1HB      ASP  59  -9.047  -0.808  -5.876
  472    H    ALA  60           H        ALA  60  -6.729   1.954  -7.167
  473    HA   ALA  60           HA       ALA  60  -6.265   2.771  -4.492
  474    HB1  ALA  60           1HB      ALA  60  -4.791   2.998  -7.062
  475    HB2  ALA  60           2HB      ALA  60  -4.287   2.286  -5.529
  476    HB3  ALA  60           3HB      ALA  60  -4.307   4.039  -5.724
  477    H    GLU  61           H        GLU  61  -7.571   4.328  -7.288
  478    HA   GLU  61           HA       GLU  61  -7.297   6.990  -6.227
  479    HB2  GLU  61           2HB      GLU  61  -8.432   5.796  -8.716
  480    HB3  GLU  61           1HB      GLU  61  -8.942   7.413  -8.250
  481    HG2  GLU  61           2HG      GLU  61  -7.164   7.795  -9.681
  482    HG3  GLU  61           1HG      GLU  61  -6.438   7.938  -8.081
  483    H    LYS  62           H        LYS  62  -9.656   4.458  -6.220
  484    HA   LYS  62           HA       LYS  62 -11.906   6.077  -5.570
  485    HB2  LYS  62           2HB      LYS  62 -11.355   3.124  -5.428
  486    HB3  LYS  62           1HB      LYS  62 -12.857   3.805  -4.819
  487    HG2  LYS  62           2HG      LYS  62 -13.452   4.614  -6.984
  488    HG3  LYS  62           1HG      LYS  62 -11.867   4.188  -7.633
  489    HD2  LYS  62           2HD      LYS  62 -12.333   1.825  -7.248
  490    HD3  LYS  62           1HD      LYS  62 -13.904   2.238  -6.558
  491    HE2  LYS  62           2HE      LYS  62 -13.501   1.571  -9.152
  492    HE3  LYS  62           1HE      LYS  62 -14.845   2.557  -8.575
  493    HZ1  LYS  62           3HZ      LYS  62 -13.377   3.392 -10.517
  494    HZ2  LYS  62           1HZ      LYS  62 -12.301   3.848  -9.293
  495    HZ3  LYS  62           2HZ      LYS  62 -13.869   4.482  -9.322
  496    H    ILE  63           H        ILE  63  -9.249   5.864  -3.872
  497    HA   ILE  63           HA       ILE  63 -10.548   5.497  -1.278
  498    HB   ILE  63           HB       ILE  63  -8.407   5.117  -0.307
  499   HG12  ILE  63          2HG1      ILE  63  -7.369   6.141  -2.938
  500   HG13  ILE  63          1HG1      ILE  63  -6.979   6.691  -1.312
  501   HG21  ILE  63          1HG2      ILE  63  -8.887   3.668  -2.885
  502   HG22  ILE  63          2HG2      ILE  63  -9.162   3.121  -1.230
  503   HG23  ILE  63          3HG2      ILE  63  -7.517   3.259  -1.851
  504   HD11  ILE  63          3HD1      ILE  63  -5.296   5.248  -2.712
  505   HD12  ILE  63          1HD1      ILE  63  -6.257   3.913  -2.075
  506   HD13  ILE  63          2HD1      ILE  63  -5.457   5.031  -0.969
  507    H    GLN  64           H        GLN  64 -11.038   7.255  -0.145
  508    HA   GLN  64           HA       GLN  64  -9.549   9.707  -0.658
  509    HB2  GLN  64           2HB      GLN  64 -12.446   9.412   0.129
  510    HB3  GLN  64           1HB      GLN  64 -11.600  10.944  -0.037
  511    HG2  GLN  64           2HG      GLN  64 -12.045   8.951  -2.247
  512    HG3  GLN  64           1HG      GLN  64 -12.983  10.421  -1.987
  513   HE21  GLN  64          1HE2      GLN  64  -9.620   9.362  -2.372
  514   HE22  GLN  64          2HE2      GLN  64  -9.126  10.704  -3.340
  515    H    SER  65           H        SER  65 -11.239   7.799   1.780
  516    HA   SER  65           HA       SER  65 -10.164   9.442   3.926
  517    HB2  SER  65           2HB      SER  65 -12.532   8.221   3.739
  518    HB3  SER  65           1HB      SER  65 -11.628   6.912   4.498
  519    HG   SER  65           HG       SER  65 -12.376   9.382   5.512
  520    H    ILE  66           H        ILE  66  -9.191   8.270   5.833
  521    HA   ILE  66           HA       ILE  66  -6.909   6.815   4.945
  522    HB   ILE  66           HB       ILE  66  -7.496   6.873   7.834
  523   HG12  ILE  66          2HG1      ILE  66  -6.493   9.419   7.395
  524   HG13  ILE  66          1HG1      ILE  66  -7.743   9.240   6.173
  525   HG21  ILE  66          1HG2      ILE  66  -5.254   6.659   6.126
  526   HG22  ILE  66          2HG2      ILE  66  -5.302   6.567   7.887
  527   HG23  ILE  66          3HG2      ILE  66  -5.054   8.122   7.093
  528   HD11  ILE  66          3HD1      ILE  66  -9.418   8.913   7.772
  529   HD12  ILE  66          1HD1      ILE  66  -8.433  10.235   8.394
  530   HD13  ILE  66          2HD1      ILE  66  -8.247   8.611   9.055
  531    HA   PRO  67           HA       PRO  67  -9.063   3.278   7.497
  532    HB2  PRO  67           2HB      PRO  67 -11.760   3.508   7.765
  533    HB3  PRO  67           1HB      PRO  67 -10.615   4.125   8.961
  534    HG2  PRO  67           2HG      PRO  67 -12.062   5.592   6.790
  535    HG3  PRO  67           1HG      PRO  67 -11.779   6.077   8.473
  536    HD2  PRO  67           2HD      PRO  67 -10.300   7.032   6.422
  537    HD3  PRO  67           1HD      PRO  67  -9.622   6.773   8.041
  538    H    ASP  68           H        ASP  68 -10.584   4.882   4.794
  539    HA   ASP  68           HA       ASP  68 -11.940   2.635   3.745
  540    HB2  ASP  68           2HB      ASP  68 -12.544   4.906   3.084
  541    HB3  ASP  68           1HB      ASP  68 -10.957   5.133   2.357
  542    H    ALA  69           H        ALA  69  -8.711   3.890   3.382
  543    HA   ALA  69           HA       ALA  69  -7.975   2.196   1.221
  544    HB1  ALA  69           1HB      ALA  69  -5.793   3.074   1.448
  545    HB2  ALA  69           2HB      ALA  69  -6.086   3.547   3.121
  546    HB3  ALA  69           3HB      ALA  69  -6.899   4.400   1.808
  547    H    VAL  70           H        VAL  70  -6.968   2.248   4.610
  548    HA   VAL  70           HA       VAL  70  -5.687  -0.263   4.538
  549    HB   VAL  70           HB       VAL  70  -6.396   1.692   6.614
  550   HG11  VAL  70          1HG1      VAL  70  -7.485  -0.015   7.761
  551   HG12  VAL  70          2HG1      VAL  70  -5.844  -0.077   8.403
  552   HG13  VAL  70          3HG1      VAL  70  -6.361  -1.247   7.189
  553   HG21  VAL  70          3HG2      VAL  70  -4.038  -0.115   6.102
  554   HG22  VAL  70          1HG2      VAL  70  -4.121   1.067   7.408
  555   HG23  VAL  70          2HG2      VAL  70  -4.167   1.604   5.729
  556    H    GLU  71           H        GLU  71  -8.974   0.621   4.725
  557    HA   GLU  71           HA       GLU  71  -9.962  -1.625   6.143
  558    HB2  GLU  71           2HB      GLU  71 -11.120   0.579   4.539
  559    HB3  GLU  71           1HB      GLU  71 -12.093  -0.878   4.679
  560    HG2  GLU  71           2HG      GLU  71 -10.920   0.317   7.140
  561    HG3  GLU  71           1HG      GLU  71 -12.330   1.074   6.400
  562    H    TYR  72           H        TYR  72  -9.566  -0.889   2.699
  563    HA   TYR  72           HA       TYR  72 -10.738  -3.293   1.790
  564    HB2  TYR  72           2HB      TYR  72 -10.597  -2.275  -0.192
  565    HB3  TYR  72           1HB      TYR  72  -9.819  -0.925   0.623
  566    HD1  TYR  72           2HD      TYR  72  -8.911  -4.289  -0.736
  567    HD2  TYR  72           1HD      TYR  72  -7.808  -0.214  -0.223
  568    HE1  TYR  72           2HE      TYR  72  -6.874  -4.680  -2.056
  569    HE2  TYR  72           1HE      TYR  72  -5.773  -0.591  -1.542
  570    HH   TYR  72           HH       TYR  72  -4.997  -3.803  -2.853
  571    H    ILE  73           H        ILE  73  -7.459  -2.313   2.532
  572    HA   ILE  73           HA       ILE  73  -6.193  -4.653   1.570
  573    HB   ILE  73           HB       ILE  73  -4.990  -3.206   3.843
  574   HG12  ILE  73          2HG1      ILE  73  -6.125  -1.485   2.343
  575   HG13  ILE  73          1HG1      ILE  73  -4.397  -1.277   2.602
  576   HG21  ILE  73          1HG2      ILE  73  -3.750  -3.900   1.206
  577   HG22  ILE  73          2HG2      ILE  73  -3.947  -5.096   2.488
  578   HG23  ILE  73          3HG2      ILE  73  -2.965  -3.658   2.767
  579   HD11  ILE  73          3HD1      ILE  73  -5.122  -0.917   0.267
  580   HD12  ILE  73          1HD1      ILE  73  -5.594  -2.616   0.195
  581   HD13  ILE  73          2HD1      ILE  73  -3.904  -2.180   0.447
  582    H    ALA  74           H        ALA  74  -7.613  -3.719   4.601
  583    HA   ALA  74           HA       ALA  74  -6.652  -5.728   6.263
  584    HB1  ALA  74           1HB      ALA  74  -8.402  -3.630   6.533
  585    HB2  ALA  74           2HB      ALA  74  -7.991  -4.799   7.788
  586    HB3  ALA  74           3HB      ALA  74  -9.428  -5.040   6.793
  587    H    GLN  75           H        GLN  75  -9.345  -5.740   4.020
  588    HA   GLN  75           HA       GLN  75 -10.259  -8.327   4.807
  589    HB2  GLN  75           2HB      GLN  75 -10.966  -6.955   2.234
  590    HB3  GLN  75           1HB      GLN  75 -11.929  -8.100   3.158
  591    HG2  GLN  75           2HG      GLN  75 -11.707  -5.207   3.402
  592    HG3  GLN  75           1HG      GLN  75 -13.001  -6.295   3.902
  593   HE21  GLN  75          1HE2      GLN  75 -11.719  -3.994   5.253
  594   HE22  GLN  75          2HE2      GLN  75 -11.194  -4.599   6.783
  595    H    ASN  76           H        ASN  76  -9.142  -7.209   1.636
  596    HA   ASN  76           HA       ASN  76  -8.718  -9.363   0.216
  597    HB2  ASN  76           2HB      ASN  76  -6.865  -7.077   0.708
  598    HB3  ASN  76           1HB      ASN  76  -6.249  -8.448  -0.211
  599   HD21  ASN  76          1HD2      ASN  76  -7.797  -5.547  -0.415
  600   HD22  ASN  76          2HD2      ASN  76  -8.510  -5.714  -1.980
  601    HA   PRO  77           HA       PRO  77  -4.731 -11.098   2.294
  602    HB2  PRO  77           2HB      PRO  77  -3.848  -9.676   4.495
  603    HB3  PRO  77           1HB      PRO  77  -3.194  -9.515   2.862
  604    HG2  PRO  77           2HG      PRO  77  -5.202  -7.814   4.279
  605    HG3  PRO  77           1HG      PRO  77  -3.874  -7.328   3.207
  606    HD2  PRO  77           2HD      PRO  77  -6.413  -7.392   2.341
  607    HD3  PRO  77           1HD      PRO  77  -5.065  -7.860   1.286
  608    H    MET  78           H        MET  78  -7.040  -9.459   4.429
  609    HA   MET  78           HA       MET  78  -6.897 -11.008   6.688
  610    HB2  MET  78           2HB      MET  78  -8.442  -9.393   7.041
  611    HB3  MET  78           1HB      MET  78  -9.003  -9.425   5.375
  612    HG2  MET  78           2HG      MET  78 -10.844 -10.152   6.553
  613    HG3  MET  78           1HG      MET  78 -10.104 -11.659   6.017
  614    HE1  MET  78           3HE      MET  78 -10.544 -13.327   7.198
  615    HE2  MET  78           1HE      MET  78 -10.716 -13.520   8.943
  616    HE3  MET  78           2HE      MET  78  -9.119 -13.603   8.200
  617    H    ALA  79           H        ALA  79  -7.865 -12.001   3.562
  618    HA   ALA  79           HA       ALA  79  -8.323 -14.671   4.534
  619    HB1  ALA  79           1HB      ALA  79 -10.509 -12.963   3.836
  620    HB2  ALA  79           2HB      ALA  79 -10.539 -14.615   4.451
  621    HB3  ALA  79           3HB      ALA  79 -10.428 -14.322   2.715
  622    H    LYS  80           H        LYS  80  -6.528 -13.018   2.695
  623    HA   LYS  80           HA       LYS  80  -6.913 -13.892   0.049
  624    HB2  LYS  80           2HB      LYS  80  -4.601 -12.783   1.586
  625    HB3  LYS  80           1HB      LYS  80  -4.316 -13.465  -0.009
  626    HG2  LYS  80           2HG      LYS  80  -6.499 -11.821  -0.387
  627    HG3  LYS  80           1HG      LYS  80  -5.480 -10.925   0.742
  628    HD2  LYS  80           2HD      LYS  80  -3.554 -11.354  -0.815
  629    HD3  LYS  80           1HD      LYS  80  -4.723 -11.995  -1.971
  630    HE2  LYS  80           2HE      LYS  80  -4.493  -9.786  -2.641
  631    HE3  LYS  80           1HE      LYS  80  -5.940  -9.742  -1.636
  632    HZ1  LYS  80           3HZ      LYS  80  -4.401  -9.092   0.235
  633    HZ2  LYS  80           1HZ      LYS  80  -4.635  -7.928  -0.971
  634    HZ3  LYS  80           2HZ      LYS  80  -3.210  -8.838  -0.937
  635   H282  PNS 101          8H2       PNS 101   2.115  12.240 -11.536
  636   H281  PNS 101          9H2       PNS 101   3.825  12.124 -11.968
  637   H303  PNS 101          0H3       PNS 101   1.312  13.599 -10.423
  638   H302  PNS 101          1H3       PNS 101   2.187  15.053  -9.941
  639   H301  PNS 101          2H3       PNS 101   1.956  13.740  -8.787
  640   H313  PNS 101          3H3       PNS 101   4.342  13.757  -8.406
  641   H312  PNS 101          4H3       PNS 101   5.188  12.568  -9.398
  642   H311  PNS 101          5H3       PNS 101   3.696  12.123  -8.568
  643    H32  PNS 101           6H3      PNS 101   4.632  13.704 -11.825
  644    H33  PNS 101           7H3      PNS 101   2.672  14.702 -12.241
  645    H36  PNS 101           8H3      PNS 101   5.163  16.731  -9.840
  646   H372  PNS 101          9H3       PNS 101   7.085  17.188 -11.570
  647   H371  PNS 101          0H4       PNS 101   5.490  17.897 -11.822
  648   H382  PNS 101          1H4       PNS 101   5.116  15.465 -12.923
  649   H381  PNS 101          2H4       PNS 101   5.637  16.887 -13.824
  650    H41  PNS 101           3H4      PNS 101   7.039  14.637 -15.230
  651   H422  PNS 101          4H4       PNS 101   8.745  16.861 -15.218
  652   H421  PNS 101          5H4       PNS 101   7.786  16.297 -16.586
  653   H431  PNS 101          7H4       PNS 101   5.857  17.546 -15.772
  654   H432  PNS 101          6H4       PNS 101   6.790  18.088 -14.369
  655    H44  PNS 101           8H4      PNS 101   7.194  20.004 -15.925
  Start of MODEL   16
    1    H1   MET   1           1HT      MET   1  -3.771  -8.510   7.306
    2    H2   MET   1           2HT      MET   1  -4.286 -10.039   7.890
    3    H3   MET   1           3HT      MET   1  -2.980  -9.223   8.648
    4    HA   MET   1           HA       MET   1  -5.775  -8.308   8.547
    5    HB2  MET   1           2HB      MET   1  -5.317  -8.723  11.128
    6    HB3  MET   1           1HB      MET   1  -5.870 -10.017  10.074
    7    HG2  MET   1           2HG      MET   1  -2.957  -9.540  10.578
    8    HG3  MET   1           1HG      MET   1  -3.944 -10.505  11.675
    9    HE1  MET   1           2HE      MET   1  -1.533 -12.585   8.986
   10    HE2  MET   1           3HE      MET   1  -1.402 -11.633  10.464
   11    HE3  MET   1           1HE      MET   1  -1.473 -10.824   8.899
   12    H    ASN   2           H        ASN   2  -3.823  -7.809  11.295
   13    HA   ASN   2           HA       ASN   2  -3.997  -4.984  11.056
   14    HB2  ASN   2           2HB      ASN   2  -2.496  -6.709  13.029
   15    HB3  ASN   2           1HB      ASN   2  -2.672  -4.962  13.166
   16   HD21  ASN   2          1HD2      ASN   2  -3.882  -7.849  14.153
   17   HD22  ASN   2          2HD2      ASN   2  -5.466  -7.352  14.633
   18    H    ASP   3           H        ASP   3  -1.534  -7.346  10.415
   19    HA   ASP   3           HA       ASP   3   0.756  -5.821  10.401
   20    HB2  ASP   3           2HB      ASP   3   1.703  -7.438   8.880
   21    HB3  ASP   3           1HB      ASP   3   0.649  -8.281  10.014
   22    H    VAL   4           H        VAL   4  -1.888  -5.743   8.168
   23    HA   VAL   4           HA       VAL   4  -0.514  -4.469   6.033
   24    HB   VAL   4           HB       VAL   4  -2.744  -3.924   5.148
   25   HG11  VAL   4          1HG1      VAL   4  -1.625  -6.195   4.932
   26   HG12  VAL   4          2HG1      VAL   4  -3.361  -6.129   4.624
   27   HG13  VAL   4          3HG1      VAL   4  -2.761  -6.751   6.162
   28   HG21  VAL   4          3HG2      VAL   4  -4.599  -5.181   6.624
   29   HG22  VAL   4          1HG2      VAL   4  -4.237  -3.462   6.782
   30   HG23  VAL   4          2HG2      VAL   4  -3.530  -4.620   7.908
   31    H    LEU   5           H        LEU   5  -2.821  -3.172   8.436
   32    HA   LEU   5           HA       LEU   5  -2.417  -0.487   7.674
   33    HB2  LEU   5           2HB      LEU   5  -4.002   0.030   9.196
   34    HB3  LEU   5           1HB      LEU   5  -4.318  -1.687   9.094
   35    HG   LEU   5           HG       LEU   5  -4.328  -0.872  11.407
   36   HD11  LEU   5          1HD1      LEU   5  -3.168  -3.128  10.424
   37   HD12  LEU   5          2HD1      LEU   5  -3.515  -2.817  12.125
   38   HD13  LEU   5          3HD1      LEU   5  -1.905  -2.492  11.479
   39   HD21  LEU   5          3HD2      LEU   5  -2.693   0.348  12.352
   40   HD22  LEU   5          1HD2      LEU   5  -2.282   0.748  10.683
   41   HD23  LEU   5          2HD2      LEU   5  -1.412  -0.537  11.523
   42    H    THR   6           H        THR   6  -0.923  -2.560  10.043
   43    HA   THR   6           HA       THR   6   0.407  -0.598  11.528
   44    HB   THR   6           HB       THR   6   0.243  -3.385  11.550
   45    HG1  THR   6           1HG      THR   6   1.862  -1.773  13.222
   46   HG21  THR   6          3HG2      THR   6   2.728  -3.822  12.112
   47   HG22  THR   6          1HG2      THR   6   3.029  -2.462  11.030
   48   HG23  THR   6          2HG2      THR   6   2.190  -3.895  10.434
   49    H    ARG   7           H        ARG   7   1.715  -2.664   8.968
   50    HA   ARG   7           HA       ARG   7   4.129  -1.160   8.799
   51    HB2  ARG   7           2HB      ARG   7   4.060  -3.584   8.352
   52    HB3  ARG   7           1HB      ARG   7   3.053  -3.284   6.942
   53    HG2  ARG   7           2HG      ARG   7   5.524  -1.745   6.926
   54    HG3  ARG   7           1HG      ARG   7   5.785  -3.491   6.957
   55    HD2  ARG   7           2HD      ARG   7   3.684  -2.781   5.109
   56    HD3  ARG   7           1HD      ARG   7   5.172  -1.911   4.740
   57    HE   ARG   7           HE       ARG   7   5.315  -4.804   5.140
   58   HH11  ARG   7          1HH1      ARG   7   5.421  -2.063   2.996
   59   HH12  ARG   7          2HH1      ARG   7   6.146  -2.945   1.693
   60   HH21  ARG   7          1HH2      ARG   7   6.269  -5.977   3.431
   61   HH22  ARG   7          2HH2      ARG   7   6.627  -5.171   1.941
   62    H    VAL   8           H        VAL   8   1.183  -1.433   6.907
   63    HA   VAL   8           HA       VAL   8   2.018   0.137   4.729
   64    HB   VAL   8           HB       VAL   8  -0.048  -1.414   4.925
   65   HG11  VAL   8          1HG1      VAL   8  -0.998  -0.143   6.855
   66   HG12  VAL   8          2HG1      VAL   8  -2.118  -0.373   5.513
   67   HG13  VAL   8          3HG1      VAL   8  -1.330   1.187   5.747
   68   HG21  VAL   8          3HG2      VAL   8  -0.777   1.107   3.537
   69   HG22  VAL   8          1HG2      VAL   8  -0.803  -0.557   2.954
   70   HG23  VAL   8          2HG2      VAL   8   0.726   0.315   3.064
   71    H    LEU   9           H        LEU   9   0.056   0.979   7.591
   72    HA   LEU   9           HA       LEU   9  -0.219   3.708   6.913
   73    HB2  LEU   9           2HB      LEU   9  -1.581   3.700   8.668
   74    HB3  LEU   9           1HB      LEU   9  -1.152   2.028   8.933
   75    HG   LEU   9           HG       LEU   9   0.908   3.463  10.141
   76   HD11  LEU   9          1HD1      LEU   9  -0.914   5.359   9.822
   77   HD12  LEU   9          2HD1      LEU   9   0.075   5.246  11.278
   78   HD13  LEU   9          3HD1      LEU   9  -1.573   4.618  11.281
   79   HD21  LEU   9          3HD2      LEU   9   0.088   2.499  12.152
   80   HD22  LEU   9          1HD2      LEU   9  -0.249   1.358  10.850
   81   HD23  LEU   9          2HD2      LEU   9  -1.544   2.365  11.495
   82    H    GLU  10           H        GLU  10   2.074   2.013   9.016
   83    HA   GLU  10           HA       GLU  10   3.462   4.299   9.894
   84    HB2  GLU  10           2HB      GLU  10   5.062   2.818  10.792
   85    HB3  GLU  10           1HB      GLU  10   3.533   1.953  10.880
   86    HG2  GLU  10           2HG      GLU  10   4.240   0.339   9.521
   87    HG3  GLU  10           1HG      GLU  10   4.970   1.481   8.391
   88    H    VAL  11           H        VAL  11   3.785   2.260   7.094
   89    HA   VAL  11           HA       VAL  11   6.305   3.014   6.230
   90    HB   VAL  11           HB       VAL  11   3.935   1.895   4.921
   91   HG11  VAL  11          1HG1      VAL  11   5.767   1.980   2.868
   92   HG12  VAL  11          2HG1      VAL  11   5.821   3.607   3.544
   93   HG13  VAL  11          3HG1      VAL  11   4.290   2.935   2.981
   94   HG21  VAL  11          3HG2      VAL  11   6.638   0.862   4.411
   95   HG22  VAL  11          1HG2      VAL  11   5.154   0.004   4.831
   96   HG23  VAL  11          2HG2      VAL  11   6.096   0.807   6.088
   97    H    VAL  12           H        VAL  12   3.191   4.318   5.200
   98    HA   VAL  12           HA       VAL  12   4.326   6.421   3.660
   99    HB   VAL  12           HB       VAL  12   2.230   6.842   2.986
  100   HG11  VAL  12          1HG1      VAL  12   1.326   4.537   4.683
  101   HG12  VAL  12          2HG1      VAL  12   2.387   4.310   3.292
  102   HG13  VAL  12          3HG1      VAL  12   0.780   5.004   3.071
  103   HG21  VAL  12          3HG2      VAL  12   0.380   7.356   4.403
  104   HG22  VAL  12          1HG2      VAL  12   1.818   8.080   5.124
  105   HG23  VAL  12          2HG2      VAL  12   1.155   6.587   5.789
  106    H    LYS  13           H        LYS  13   2.866   6.293   6.893
  107    HA   LYS  13           HA       LYS  13   3.002   9.025   7.477
  108    HB2  LYS  13           2HB      LYS  13   3.112   6.621   9.301
  109    HB3  LYS  13           1HB      LYS  13   2.961   8.275   9.876
  110    HG2  LYS  13           2HG      LYS  13   0.963   6.507   8.648
  111    HG3  LYS  13           1HG      LYS  13   0.768   7.810   9.830
  112    HD2  LYS  13           2HD      LYS  13   1.320   9.359   7.817
  113    HD3  LYS  13           1HD      LYS  13   0.877   7.958   6.841
  114    HE2  LYS  13           2HE      LYS  13  -1.208   7.991   8.516
  115    HE3  LYS  13           1HE      LYS  13  -0.804   9.708   8.537
  116    HZ1  LYS  13           3HZ      LYS  13  -1.481   8.057   6.166
  117    HZ2  LYS  13           1HZ      LYS  13  -0.891   9.640   6.070
  118    HZ3  LYS  13           2HZ      LYS  13  -2.379   9.336   6.814
  119    H    ASN  14           H        ASN  14   5.444   6.538   7.589
  120    HA   ASN  14           HA       ASN  14   7.318   8.361   8.848
  121    HB2  ASN  14           2HB      ASN  14   7.662   5.429   8.211
  122    HB3  ASN  14           1HB      ASN  14   8.768   6.424   9.152
  123   HD21  ASN  14          1HD2      ASN  14   6.576   4.107   9.452
  124   HD22  ASN  14          2HD2      ASN  14   5.934   4.463  11.015
  125    H    PHE  15           H        PHE  15   6.296   7.603   5.837
  126    HA   PHE  15           HA       PHE  15   8.797   7.450   4.473
  127    HB2  PHE  15           2HB      PHE  15   7.315   6.499   3.064
  128    HB3  PHE  15           1HB      PHE  15   5.955   7.375   3.759
  129    HD1  PHE  15           2HD      PHE  15   5.723   9.850   3.118
  130    HD2  PHE  15           1HD      PHE  15   8.103   7.059   0.965
  131    HE1  PHE  15           2HE      PHE  15   5.649  11.316   1.140
  132    HE2  PHE  15           1HE      PHE  15   8.034   8.517  -1.016
  133    HZ   PHE  15           HZ       PHE  15   6.805  10.650  -0.930
  134    H    GLU  16           H        GLU  16   6.865   9.957   5.732
  135    HA   GLU  16           HA       GLU  16   8.001  12.110   5.966
  136    HB2  GLU  16           2HB      GLU  16   9.052  13.148   4.108
  137    HB3  GLU  16           1HB      GLU  16   9.619  11.486   4.134
  138    HG2  GLU  16           2HG      GLU  16   8.961  11.229   2.047
  139    HG3  GLU  16           1HG      GLU  16   7.301  11.576   2.526
  140    H    LYS  17           H        LYS  17   5.393  10.736   4.578
  141    HA   LYS  17           HA       LYS  17   4.151  12.919   3.279
  142    HB2  LYS  17           2HB      LYS  17   3.580  10.228   3.654
  143    HB3  LYS  17           1HB      LYS  17   2.287  11.073   4.490
  144    HG2  LYS  17           2HG      LYS  17   1.612  10.626   2.233
  145    HG3  LYS  17           1HG      LYS  17   1.840  12.364   2.439
  146    HD2  LYS  17           2HD      LYS  17   4.060  10.639   1.403
  147    HD3  LYS  17           1HD      LYS  17   2.789  11.217   0.324
  148    HE2  LYS  17           2HE      LYS  17   4.904  12.741   1.765
  149    HE3  LYS  17           1HE      LYS  17   4.352  12.886   0.097
  150    HZ1  LYS  17           3HZ      LYS  17   3.670  14.786   1.415
  151    HZ2  LYS  17           1HZ      LYS  17   2.851  13.779   2.501
  152    HZ3  LYS  17           2HZ      LYS  17   2.316  13.913   0.902
  153    H    VAL  18           H        VAL  18   3.786  11.578   6.553
  154    HA   VAL  18           HA       VAL  18   3.528  14.014   7.852
  155    HB   VAL  18           HB       VAL  18   0.901  13.518   8.324
  156   HG11  VAL  18          1HG1      VAL  18   1.380  15.717   7.994
  157   HG12  VAL  18          2HG1      VAL  18   0.625  15.369   6.438
  158   HG13  VAL  18          3HG1      VAL  18   2.383  15.402   6.578
  159   HG21  VAL  18          3HG2      VAL  18  -0.208  12.592   6.612
  160   HG22  VAL  18          1HG2      VAL  18   1.363  11.962   6.116
  161   HG23  VAL  18          2HG2      VAL  18   0.749  13.455   5.407
  162    H    ASP  19           H        ASP  19   3.046  13.805  10.091
  163    HA   ASP  19           HA       ASP  19   3.761  11.299  11.189
  164    HB2  ASP  19           2HB      ASP  19   3.447  13.988  12.120
  165    HB3  ASP  19           1HB      ASP  19   2.585  12.905  13.210
  166    H    ALA  20           H        ALA  20   2.541   9.636  11.842
  167    HA   ALA  20           HA       ALA  20  -0.143   9.382  11.155
  168    HB1  ALA  20           1HB      ALA  20   0.144   7.549  13.160
  169    HB2  ALA  20           2HB      ALA  20   1.813   7.815  12.658
  170    HB3  ALA  20           3HB      ALA  20   0.608   7.299  11.477
  171    H    SER  21           H        SER  21   1.229  11.060  13.759
  172    HA   SER  21           HA       SER  21  -0.789  10.734  15.705
  173    HB2  SER  21           2HB      SER  21   1.639  12.203  15.445
  174    HB3  SER  21           1HB      SER  21   0.374  13.324  15.950
  175    HG   SER  21           HG       SER  21   0.182  12.300  17.808
  176    H    LYS  22           H        LYS  22  -0.695  12.471  12.772
  177    HA   LYS  22           HA       LYS  22  -2.838  14.269  13.564
  178    HB2  LYS  22           2HB      LYS  22  -2.483  15.397  11.471
  179    HB3  LYS  22           1HB      LYS  22  -0.918  15.120  12.222
  180    HG2  LYS  22           2HG      LYS  22  -0.959  12.950  10.739
  181    HG3  LYS  22           1HG      LYS  22  -2.095  13.903   9.782
  182    HD2  LYS  22           2HD      LYS  22   0.799  14.175  10.083
  183    HD3  LYS  22           1HD      LYS  22  -0.263  14.727   8.786
  184    HE2  LYS  22           2HE      LYS  22  -0.988  16.587  10.308
  185    HE3  LYS  22           1HE      LYS  22   0.287  16.087  11.417
  186    HZ1  LYS  22           3HZ      LYS  22   1.149  17.830  10.100
  187    HZ2  LYS  22           1HZ      LYS  22   0.599  17.129   8.660
  188    HZ3  LYS  22           2HZ      LYS  22   1.863  16.411   9.523
  189    H    VAL  23           H        VAL  23  -2.446  11.224  12.189
  190    HA   VAL  23           HA       VAL  23  -4.723  11.295  10.444
  191    HB   VAL  23           HB       VAL  23  -3.568   8.729  11.438
  192   HG11  VAL  23          1HG1      VAL  23  -3.868   8.179   8.987
  193   HG12  VAL  23          2HG1      VAL  23  -4.689   9.733   8.834
  194   HG13  VAL  23          3HG1      VAL  23  -5.346   8.489   9.899
  195   HG21  VAL  23          3HG2      VAL  23  -1.649  10.249  11.024
  196   HG22  VAL  23          1HG2      VAL  23  -2.219  10.457   9.368
  197   HG23  VAL  23          2HG2      VAL  23  -1.700   8.868   9.929
  198    H    THR  24           H        THR  24  -6.775  11.018  11.007
  199    HA   THR  24           HA       THR  24  -7.365   9.820  13.595
  200    HB   THR  24           HB       THR  24  -7.973  12.339  12.910
  201    HG1  THR  24           1HG      THR  24  -8.826  10.573  14.730
  202   HG21  THR  24          3HG2      THR  24 -10.115  10.673  11.727
  203   HG22  THR  24          1HG2      THR  24  -9.489  12.244  11.228
  204   HG23  THR  24          2HG2      THR  24 -10.583  12.127  12.606
  205    HA   PRO  25           HA       PRO  25  -9.706   6.539  11.863
  206    HB2  PRO  25           2HB      PRO  25 -12.059   7.425  13.450
  207    HB3  PRO  25           1HB      PRO  25 -11.251   5.855  13.416
  208    HG2  PRO  25           2HG      PRO  25 -10.925   7.511  15.479
  209    HG3  PRO  25           1HG      PRO  25  -9.574   6.537  14.866
  210    HD2  PRO  25           2HD      PRO  25 -10.147   9.445  14.478
  211    HD3  PRO  25           1HD      PRO  25  -8.591   8.621  14.705
  212    H    GLU  26           H        GLU  26 -11.414   9.634  12.052
  213    HA   GLU  26           HA       GLU  26 -12.936   8.919   9.665
  214    HB2  GLU  26           2HB      GLU  26 -14.589  10.396  10.312
  215    HB3  GLU  26           1HB      GLU  26 -13.999   9.833  11.870
  216    HG2  GLU  26           2HG      GLU  26 -13.694  11.945  12.441
  217    HG3  GLU  26           1HG      GLU  26 -12.408  12.033  11.238
  218    H    SER  27           H        SER  27 -10.066  10.099  10.145
  219    HA   SER  27           HA       SER  27 -10.169  12.583   8.734
  220    HB2  SER  27           2HB      SER  27  -8.311  11.294  10.390
  221    HB3  SER  27           1HB      SER  27  -7.532  11.412   8.814
  222    HG   SER  27           HG       SER  27  -7.095  13.352   9.565
  223    H    HIS  28           H        HIS  28  -9.787  12.975   6.622
  224    HA   HIS  28           HA       HIS  28  -9.862  10.759   4.812
  225    HB2  HIS  28           2HB      HIS  28  -9.938  13.741   4.501
  226    HB3  HIS  28           1HB      HIS  28  -9.691  12.709   3.096
  227    HD1  HIS  28           1HD      HIS  28 -11.662  10.763   2.873
  228    HD2  HIS  28           2HD      HIS  28 -12.546  14.205   5.026
  229    HE1  HIS  28           1HE      HIS  28 -14.173  10.868   2.972
  230    HE2  HIS  28           2HE      HIS  28 -14.685  13.005   4.204
  231    H    PHE  29           H        PHE  29  -8.302  10.254   3.226
  232    HA   PHE  29           HA       PHE  29  -5.624  10.449   4.100
  233    HB2  PHE  29           2HB      PHE  29  -6.751   8.624   2.650
  234    HB3  PHE  29           1HB      PHE  29  -6.389   9.693   1.299
  235    HD1  PHE  29           2HD      PHE  29  -3.749  10.746   2.398
  236    HD2  PHE  29           1HD      PHE  29  -5.351   6.819   2.046
  237    HE1  PHE  29           2HE      PHE  29  -1.468   9.830   2.288
  238    HE2  PHE  29           1HE      PHE  29  -3.073   5.896   1.935
  239    HZ   PHE  29           HZ       PHE  29  -1.128   7.402   2.056
  240    H    VAL  30           H        VAL  30  -6.537  11.269   0.818
  241    HA   VAL  30           HA       VAL  30  -4.549  13.280   0.640
  242    HB   VAL  30           HB       VAL  30  -5.760  13.793  -1.585
  243   HG11  VAL  30          1HG1      VAL  30  -4.756  11.800  -2.639
  244   HG12  VAL  30          2HG1      VAL  30  -4.532  11.093  -1.038
  245   HG13  VAL  30          3HG1      VAL  30  -3.677  12.573  -1.477
  246   HG21  VAL  30          3HG2      VAL  30  -7.277  12.148  -2.401
  247   HG22  VAL  30          1HG2      VAL  30  -7.878  12.677  -0.829
  248   HG23  VAL  30          2HG2      VAL  30  -7.038  11.134  -0.978
  249    H    LYS  31           H        LYS  31  -7.953  13.283   1.260
  250    HA   LYS  31           HA       LYS  31  -8.365  16.058   0.829
  251    HB2  LYS  31           2HB      LYS  31 -10.099  14.361   2.593
  252    HB3  LYS  31           1HB      LYS  31 -10.561  15.715   1.572
  253    HG2  LYS  31           2HG      LYS  31 -10.046  14.325  -0.416
  254    HG3  LYS  31           1HG      LYS  31  -9.747  12.963   0.666
  255    HD2  LYS  31           2HD      LYS  31 -12.121  13.396  -0.461
  256    HD3  LYS  31           1HD      LYS  31 -11.952  12.679   1.144
  257    HE2  LYS  31           2HE      LYS  31 -12.347  14.804   2.193
  258    HE3  LYS  31           1HE      LYS  31 -12.324  15.627   0.633
  259    HZ1  LYS  31           3HZ      LYS  31 -14.302  14.323   0.012
  260    HZ2  LYS  31           1HZ      LYS  31 -14.578  15.329   1.344
  261    HZ3  LYS  31           2HZ      LYS  31 -14.349  13.668   1.571
  262    H    ASP  32           H        ASP  32  -7.066  14.249   3.443
  263    HA   ASP  32           HA       ASP  32  -7.491  16.457   5.282
  264    HB2  ASP  32           2HB      ASP  32  -8.019  13.956   5.818
  265    HB3  ASP  32           1HB      ASP  32  -6.288  13.859   6.129
  266    H    LEU  33           H        LEU  33  -5.192  15.584   3.122
  267    HA   LEU  33           HA       LEU  33  -3.258  17.328   4.137
  268    HB2  LEU  33           2HB      LEU  33  -3.155  14.696   5.264
  269    HB3  LEU  33           1HB      LEU  33  -1.713  14.979   4.308
  270    HG   LEU  33           HG       LEU  33  -2.595  17.015   6.321
  271   HD11  LEU  33          1HD1      LEU  33  -2.541  14.828   7.467
  272   HD12  LEU  33          2HD1      LEU  33  -1.283  15.930   8.029
  273   HD13  LEU  33          3HD1      LEU  33  -0.875  14.614   6.927
  274   HD21  LEU  33          3HD2      LEU  33  -0.849  17.923   5.181
  275   HD22  LEU  33          1HD2      LEU  33  -0.149  16.355   4.778
  276   HD23  LEU  33          2HD2      LEU  33   0.058  17.024   6.397
  277    H    GLY  34           H        GLY  34  -4.041  14.639   2.078
  278    HA2  GLY  34           2HA      GLY  34  -3.464  14.178  -0.099
  279    HA3  GLY  34           1HA      GLY  34  -2.962  15.855  -0.214
  280    H    LEU  35           H        LEU  35  -1.951  12.604   0.047
  281    HA   LEU  35           HA       LEU  35   0.751  13.146   0.814
  282    HB2  LEU  35           2HB      LEU  35   1.103  10.746   0.095
  283    HB3  LEU  35           1HB      LEU  35  -0.038  11.010   1.399
  284    HG   LEU  35           HG       LEU  35  -1.906  10.756  -0.175
  285   HD11  LEU  35          1HD1      LEU  35  -1.253   9.734  -2.442
  286   HD12  LEU  35          2HD1      LEU  35   0.322  10.473  -2.156
  287   HD13  LEU  35          3HD1      LEU  35  -1.123  11.481  -2.241
  288   HD21  LEU  35          3HD2      LEU  35  -1.885   8.479  -0.110
  289   HD22  LEU  35          1HD2      LEU  35  -0.540   8.806   0.985
  290   HD23  LEU  35          2HD2      LEU  35  -0.224   8.366  -0.693
  291    H    ASN  36           H        ASN  36   2.616  12.915  -0.504
  292    HA   ASN  36           HA       ASN  36   2.445  14.172  -3.009
  293    HB2  ASN  36           2HB      ASN  36   4.454  14.048  -1.428
  294    HB3  ASN  36           1HB      ASN  36   4.771  12.470  -2.128
  295   HD21  ASN  36          1HD2      ASN  36   5.108  12.366  -4.395
  296   HD22  ASN  36          2HD2      ASN  36   5.833  13.694  -5.229
  297    H    SER  37           H        SER  37   3.313  13.249  -5.068
  298    HA   SER  37           HA       SER  37   1.784  11.020  -5.858
  299    HB2  SER  37           2HB      SER  37   2.219  12.451  -7.626
  300    HB3  SER  37           1HB      SER  37   3.900  12.689  -7.150
  301    H    LEU  38           H        LEU  38   5.300  11.358  -5.782
  302    HA   LEU  38           HA       LEU  38   5.953   8.706  -6.215
  303    HB2  LEU  38           2HB      LEU  38   8.132   9.224  -5.514
  304    HB3  LEU  38           1HB      LEU  38   7.495  10.706  -6.186
  305    HG   LEU  38           HG       LEU  38   8.588  10.233  -3.595
  306   HD11  LEU  38          1HD1      LEU  38   7.845  12.502  -5.336
  307   HD12  LEU  38          2HD1      LEU  38   9.378  12.127  -4.551
  308   HD13  LEU  38          3HD1      LEU  38   8.061  12.836  -3.618
  309   HD21  LEU  38          3HD2      LEU  38   5.705  10.975  -3.696
  310   HD22  LEU  38          1HD2      LEU  38   6.747  11.695  -2.472
  311   HD23  LEU  38          2HD2      LEU  38   6.558   9.944  -2.549
  312    H    ASP  39           H        ASP  39   4.385  10.023  -3.554
  313    HA   ASP  39           HA       ASP  39   5.356   8.173  -1.576
  314    HB2  ASP  39           2HB      ASP  39   4.622  10.214  -0.668
  315    HB3  ASP  39           1HB      ASP  39   3.154  10.220  -1.641
  316    H    VAL  40           H        VAL  40   1.948   8.619  -1.837
  317    HA   VAL  40           HA       VAL  40   1.029   6.182  -1.346
  318    HB   VAL  40           HB       VAL  40  -0.104   8.415  -2.521
  319   HG11  VAL  40          1HG1      VAL  40   0.441   6.994  -4.693
  320   HG12  VAL  40          2HG1      VAL  40  -1.041   7.938  -4.544
  321   HG13  VAL  40          3HG1      VAL  40  -1.069   6.200  -4.246
  322   HG21  VAL  40          3HG2      VAL  40  -0.969   6.786  -0.770
  323   HG22  VAL  40          1HG2      VAL  40  -1.572   5.823  -2.118
  324   HG23  VAL  40          2HG2      VAL  40  -2.160   7.468  -1.878
  325    H    VAL  41           H        VAL  41   2.588   7.104  -4.344
  326    HA   VAL  41           HA       VAL  41   1.911   4.800  -5.832
  327    HB   VAL  41           HB       VAL  41   3.940   5.420  -7.221
  328   HG11  VAL  41          1HG1      VAL  41   1.833   6.165  -7.967
  329   HG12  VAL  41          2HG1      VAL  41   2.876   7.588  -7.995
  330   HG13  VAL  41          3HG1      VAL  41   1.716   7.369  -6.684
  331   HG21  VAL  41          3HG2      VAL  41   4.452   7.991  -6.547
  332   HG22  VAL  41          1HG2      VAL  41   5.458   6.623  -6.071
  333   HG23  VAL  41          2HG2      VAL  41   4.255   7.264  -4.951
  334    H    GLU  42           H        GLU  42   4.868   5.653  -4.025
  335    HA   GLU  42           HA       GLU  42   6.144   3.176  -4.487
  336    HB2  GLU  42           2HB      GLU  42   6.600   5.503  -2.696
  337    HB3  GLU  42           1HB      GLU  42   7.401   3.994  -2.283
  338    HG2  GLU  42           2HG      GLU  42   8.044   4.107  -4.865
  339    HG3  GLU  42           1HG      GLU  42   7.858   5.831  -4.551
  340    H    VAL  43           H        VAL  43   4.096   4.389  -1.935
  341    HA   VAL  43           HA       VAL  43   4.402   2.203  -0.175
  342    HB   VAL  43           HB       VAL  43   3.331   3.603   1.172
  343   HG11  VAL  43          1HG1      VAL  43   2.326   5.719   0.311
  344   HG12  VAL  43          2HG1      VAL  43   2.652   5.140  -1.321
  345   HG13  VAL  43          3HG1      VAL  43   3.987   5.435  -0.207
  346   HG21  VAL  43          3HG2      VAL  43   1.348   2.476   1.117
  347   HG22  VAL  43          1HG2      VAL  43   1.089   2.815  -0.588
  348   HG23  VAL  43          2HG2      VAL  43   0.821   4.079   0.604
  349    H    VAL  44           H        VAL  44   2.157   2.915  -2.770
  350    HA   VAL  44           HA       VAL  44   0.339   0.821  -2.300
  351    HB   VAL  44           HB       VAL  44  -0.219   1.035  -4.741
  352   HG11  VAL  44          1HG1      VAL  44  -0.614   2.862  -2.626
  353   HG12  VAL  44          2HG1      VAL  44  -1.643   2.574  -4.027
  354   HG13  VAL  44          3HG1      VAL  44  -0.382   3.803  -4.098
  355   HG21  VAL  44          3HG2      VAL  44   0.844   2.619  -6.118
  356   HG22  VAL  44          1HG2      VAL  44   2.154   1.732  -5.339
  357   HG23  VAL  44          2HG2      VAL  44   1.711   3.338  -4.761
  358    H    PHE  45           H        PHE  45   3.408   0.985  -3.968
  359    HA   PHE  45           HA       PHE  45   3.254  -1.584  -5.173
  360    HB2  PHE  45           2HB      PHE  45   5.068   0.619  -5.151
  361    HB3  PHE  45           1HB      PHE  45   5.968  -0.840  -4.752
  362    HD1  PHE  45           1HD      PHE  45   5.644  -2.858  -6.295
  363    HD2  PHE  45           2HD      PHE  45   4.588   1.122  -7.355
  364    HE1  PHE  45           1HE      PHE  45   5.716  -3.480  -8.679
  365    HE2  PHE  45           2HE      PHE  45   4.656   0.512  -9.741
  366    HZ   PHE  45           HZ       PHE  45   5.221  -1.793 -10.404
  367    H    ALA  46           H        ALA  46   4.309  -0.345  -2.120
  368    HA   ALA  46           HA       ALA  46   5.811  -2.529  -1.205
  369    HB1  ALA  46           1HB      ALA  46   4.291  -1.075   0.835
  370    HB2  ALA  46           2HB      ALA  46   5.259  -0.062  -0.236
  371    HB3  ALA  46           3HB      ALA  46   6.027  -1.350   0.691
  372    H    ILE  47           H        ILE  47   2.698  -1.630   0.168
  373    HA   ILE  47           HA       ILE  47   2.039  -4.014   1.326
  374    HB   ILE  47           HB       ILE  47  -0.285  -3.348   1.275
  375   HG12  ILE  47          2HG1      ILE  47  -0.048  -2.586  -1.215
  376   HG13  ILE  47          1HG1      ILE  47  -1.211  -1.780  -0.168
  377   HG21  ILE  47          1HG2      ILE  47   1.863  -1.661   2.118
  378   HG22  ILE  47          2HG2      ILE  47   0.287  -1.917   2.868
  379   HG23  ILE  47          3HG2      ILE  47   0.486  -0.667   1.641
  380   HD11  ILE  47          3HD1      ILE  47   1.103  -0.718  -1.538
  381   HD12  ILE  47          1HD1      ILE  47   1.102  -0.320   0.181
  382   HD13  ILE  47          2HD1      ILE  47  -0.278   0.118  -0.827
  383    H    GLU  48           H        GLU  48   1.456  -3.041  -2.030
  384    HA   GLU  48           HA       GLU  48  -0.103  -5.191  -2.842
  385    HB2  GLU  48           2HB      GLU  48   1.873  -3.462  -4.305
  386    HB3  GLU  48           1HB      GLU  48   1.019  -4.762  -5.126
  387    HG2  GLU  48           2HG      GLU  48  -1.114  -3.736  -4.552
  388    HG3  GLU  48           1HG      GLU  48  -0.268  -2.439  -3.709
  389    H    GLN  49           H        GLN  49   3.347  -4.917  -2.428
  390    HA   GLN  49           HA       GLN  49   4.101  -7.322  -3.681
  391    HB2  GLN  49           2HB      GLN  49   5.407  -5.673  -1.520
  392    HB3  GLN  49           1HB      GLN  49   6.155  -7.113  -2.198
  393    HG2  GLN  49           2HG      GLN  49   5.968  -4.421  -3.272
  394    HG3  GLN  49           1HG      GLN  49   7.085  -5.728  -3.666
  395   HE21  GLN  49          1HE2      GLN  49   4.853  -3.761  -4.946
  396   HE22  GLN  49          2HE2      GLN  49   4.285  -4.739  -6.253
  397    H    GLU  50           H        GLU  50   3.521  -6.576  -0.243
  398    HA   GLU  50           HA       GLU  50   3.455  -9.426   0.312
  399    HB2  GLU  50           2HB      GLU  50   3.806  -8.905   2.603
  400    HB3  GLU  50           1HB      GLU  50   4.909  -7.893   1.680
  401    HG2  GLU  50           2HG      GLU  50   3.639  -5.967   2.057
  402    HG3  GLU  50           1HG      GLU  50   2.229  -6.892   2.571
  403    H    PHE  51           H        PHE  51   1.267  -8.217  -1.067
  404    HA   PHE  51           HA       PHE  51  -0.843  -8.745   0.862
  405    HB2  PHE  51           2HB      PHE  51  -0.578  -6.380  -0.943
  406    HB3  PHE  51           1HB      PHE  51  -2.181  -6.981  -0.538
  407    HD1  PHE  51           1HD      PHE  51   0.973  -6.473   1.397
  408    HD2  PHE  51           2HD      PHE  51  -3.192  -5.678   1.041
  409    HE1  PHE  51           1HE      PHE  51   1.039  -5.209   3.506
  410    HE2  PHE  51           2HE      PHE  51  -3.134  -4.412   3.150
  411    HZ   PHE  51           HZ       PHE  51  -1.017  -4.176   4.386
  412    H    ILE  52           H        ILE  52   0.398  -9.076  -2.338
  413    HA   ILE  52           HA       ILE  52  -0.201 -10.415  -4.077
  414    HB   ILE  52           HB       ILE  52  -2.324 -11.613  -2.314
  415   HG12  ILE  52          2HG1      ILE  52  -0.065 -13.252  -2.209
  416   HG13  ILE  52          1HG1      ILE  52   0.541 -11.619  -1.959
  417   HG21  ILE  52          1HG2      ILE  52  -2.582 -12.459  -4.461
  418   HG22  ILE  52          2HG2      ILE  52  -1.566 -13.667  -3.675
  419   HG23  ILE  52          3HG2      ILE  52  -0.845 -12.483  -4.764
  420   HD11  ILE  52          3HD1      ILE  52  -1.450 -13.138  -0.323
  421   HD12  ILE  52          1HD1      ILE  52  -1.284 -11.385  -0.207
  422   HD13  ILE  52          2HD1      ILE  52   0.085 -12.429   0.178
  423    H    LEU  53           H        LEU  53  -1.388  -7.845  -3.759
  424    HA   LEU  53           HA       LEU  53  -3.451  -8.024  -5.690
  425    HB2  LEU  53           2HB      LEU  53  -4.314  -8.298  -3.047
  426    HB3  LEU  53           1HB      LEU  53  -4.665  -6.630  -3.462
  427    HG   LEU  53           HG       LEU  53  -6.387  -8.621  -3.905
  428   HD11  LEU  53          1HD1      LEU  53  -6.276  -5.987  -4.487
  429   HD12  LEU  53          2HD1      LEU  53  -7.616  -7.044  -4.932
  430   HD13  LEU  53          3HD1      LEU  53  -6.355  -6.676  -6.109
  431   HD21  LEU  53          3HD2      LEU  53  -4.469  -9.443  -5.582
  432   HD22  LEU  53          1HD2      LEU  53  -5.367  -8.382  -6.667
  433   HD23  LEU  53          2HD2      LEU  53  -6.185  -9.725  -5.869
  434    H    ASP  54           H        ASP  54  -3.683  -6.111  -6.764
  435    HA   ASP  54           HA       ASP  54  -1.826  -4.035  -6.115
  436    HB2  ASP  54           2HB      ASP  54  -3.888  -4.102  -8.322
  437    HB3  ASP  54           1HB      ASP  54  -2.498  -3.026  -8.218
  438    H    ILE  55           H        ILE  55  -2.259  -1.948  -5.487
  439    HA   ILE  55           HA       ILE  55  -4.951  -1.480  -4.452
  440    HB   ILE  55           HB       ILE  55  -2.460  -1.228  -3.208
  441   HG12  ILE  55          2HG1      ILE  55  -4.919  -1.614  -2.374
  442   HG13  ILE  55          1HG1      ILE  55  -3.728  -0.891  -1.299
  443   HG21  ILE  55          1HG2      ILE  55  -3.625   1.444  -3.935
  444   HG22  ILE  55          2HG2      ILE  55  -1.967   0.876  -4.127
  445   HG23  ILE  55          3HG2      ILE  55  -2.601   1.218  -2.518
  446   HD11  ILE  55          3HD1      ILE  55  -6.215   0.170  -2.246
  447   HD12  ILE  55          1HD1      ILE  55  -4.883   1.244  -2.674
  448   HD13  ILE  55          2HD1      ILE  55  -5.137   0.783  -0.991
  449    HA   PRO  56           HA       PRO  56  -3.255   2.634  -6.704
  450    HB2  PRO  56           2HB      PRO  56  -2.085   1.069  -8.959
  451    HB3  PRO  56           1HB      PRO  56  -1.556   2.606  -8.260
  452    HG2  PRO  56           2HG      PRO  56  -0.244   0.357  -7.720
  453    HG3  PRO  56           1HG      PRO  56  -0.507   1.580  -6.461
  454    HD2  PRO  56           2HD      PRO  56  -1.871  -1.041  -6.878
  455    HD3  PRO  56           1HD      PRO  56  -1.448  -0.215  -5.364
  456    H    ASP  57           H        ASP  57  -3.522   2.872  -9.478
  457    HA   ASP  57           HA       ASP  57  -5.056   2.903 -11.160
  458    HB2  ASP  57           2HB      ASP  57  -6.158   0.407  -9.849
  459    HB3  ASP  57           1HB      ASP  57  -6.538   0.976 -11.471
  460    H    HIS  58           H        HIS  58  -7.813   2.156 -11.066
  461    HA   HIS  58           HA       HIS  58  -8.930   4.477  -9.960
  462    HB2  HIS  58           2HB      HIS  58 -10.083   1.912 -11.006
  463    HB3  HIS  58           1HB      HIS  58 -11.130   3.107 -10.248
  464    HD1  HIS  58           1HD      HIS  58 -11.983   2.826 -12.939
  465    HD2  HIS  58           2HD      HIS  58  -8.620   5.119 -12.104
  466    HE1  HIS  58           1HE      HIS  58 -11.684   4.331 -14.931
  467    HE2  HIS  58           2HE      HIS  58  -9.593   5.648 -14.441
  468    H    ASP  59           H        ASP  59  -8.136   1.459  -8.538
  469    HA   ASP  59           HA       ASP  59  -9.994   1.485  -6.402
  470    HB2  ASP  59           2HB      ASP  59  -7.367   0.190  -5.968
  471    HB3  ASP  59           1HB      ASP  59  -8.991  -0.445  -5.724
  472    H    ALA  60           H        ALA  60  -6.632   2.571  -6.701
  473    HA   ALA  60           HA       ALA  60  -6.467   3.475  -4.002
  474    HB1  ALA  60           1HB      ALA  60  -4.677   4.282  -6.281
  475    HB2  ALA  60           2HB      ALA  60  -4.517   2.757  -5.408
  476    HB3  ALA  60           3HB      ALA  60  -4.303   4.287  -4.558
  477    H    GLU  61           H        GLU  61  -7.521   4.844  -6.988
  478    HA   GLU  61           HA       GLU  61  -7.378   7.572  -6.093
  479    HB2  GLU  61           2HB      GLU  61  -8.815   6.430  -8.492
  480    HB3  GLU  61           1HB      GLU  61  -8.440   8.124  -8.210
  481    HG2  GLU  61           2HG      GLU  61  -6.252   6.094  -8.327
  482    HG3  GLU  61           1HG      GLU  61  -6.960   6.737  -9.808
  483    H    LYS  62           H        LYS  62  -9.822   5.064  -6.362
  484    HA   LYS  62           HA       LYS  62 -12.022   6.766  -5.735
  485    HB2  LYS  62           2HB      LYS  62 -11.716   3.764  -5.720
  486    HB3  LYS  62           1HB      LYS  62 -13.233   4.585  -5.381
  487    HG2  LYS  62           2HG      LYS  62 -12.255   5.651  -7.797
  488    HG3  LYS  62           1HG      LYS  62 -12.084   3.897  -7.895
  489    HD2  LYS  62           2HD      LYS  62 -14.328   3.541  -7.849
  490    HD3  LYS  62           1HD      LYS  62 -14.635   4.933  -6.808
  491    HE2  LYS  62           2HE      LYS  62 -13.635   5.608  -9.479
  492    HE3  LYS  62           1HE      LYS  62 -15.206   4.810  -9.472
  493    HZ1  LYS  62           3HZ      LYS  62 -15.470   7.191  -9.346
  494    HZ2  LYS  62           1HZ      LYS  62 -14.488   7.271  -7.970
  495    HZ3  LYS  62           2HZ      LYS  62 -15.987   6.490  -7.896
  496    H    ILE  63           H        ILE  63  -9.532   6.255  -3.883
  497    HA   ILE  63           HA       ILE  63 -11.034   5.698  -1.437
  498    HB   ILE  63           HB       ILE  63  -8.571   4.719  -2.302
  499   HG12  ILE  63          2HG1      ILE  63  -8.923   4.456   0.559
  500   HG13  ILE  63          1HG1      ILE  63 -10.458   4.262  -0.280
  501   HG21  ILE  63          1HG2      ILE  63  -8.230   6.828  -0.190
  502   HG22  ILE  63          2HG2      ILE  63  -7.349   6.640  -1.706
  503   HG23  ILE  63          3HG2      ILE  63  -7.094   5.494  -0.390
  504   HD11  ILE  63          3HD1      ILE  63  -9.604   2.109  -0.152
  505   HD12  ILE  63          1HD1      ILE  63  -7.963   2.634  -0.529
  506   HD13  ILE  63          2HD1      ILE  63  -9.196   2.622  -1.790
  507    H    GLN  64           H        GLN  64 -11.534   7.357  -0.167
  508    HA   GLN  64           HA       GLN  64  -9.918   9.777  -0.334
  509    HB2  GLN  64           2HB      GLN  64 -12.868   9.553   0.250
  510    HB3  GLN  64           1HB      GLN  64 -11.946  11.051   0.247
  511    HG2  GLN  64           2HG      GLN  64 -12.647  11.233  -1.862
  512    HG3  GLN  64           1HG      GLN  64 -11.372  10.069  -2.218
  513   HE21  GLN  64          1HE2      GLN  64 -12.008   7.769  -2.121
  514   HE22  GLN  64          2HE2      GLN  64 -13.586   7.340  -2.678
  515    H    SER  65           H        SER  65 -11.549   7.503   1.735
  516    HA   SER  65           HA       SER  65 -10.732   8.964   4.131
  517    HB2  SER  65           2HB      SER  65 -12.280   6.372   4.027
  518    HB3  SER  65           1HB      SER  65 -12.182   7.522   5.360
  519    HG   SER  65           HG       SER  65 -13.723   8.640   4.476
  520    H    ILE  66           H        ILE  66  -9.321   8.147   5.655
  521    HA   ILE  66           HA       ILE  66  -7.209   6.540   4.718
  522    HB   ILE  66           HB       ILE  66  -7.790   7.039   7.628
  523   HG12  ILE  66          2HG1      ILE  66  -7.886   9.092   5.960
  524   HG13  ILE  66          1HG1      ILE  66  -7.053   9.220   7.507
  525   HG21  ILE  66          1HG2      ILE  66  -5.236   6.694   6.064
  526   HG22  ILE  66          2HG2      ILE  66  -5.958   5.530   7.175
  527   HG23  ILE  66          3HG2      ILE  66  -5.331   7.061   7.786
  528   HD11  ILE  66          3HD1      ILE  66  -5.635  10.194   5.907
  529   HD12  ILE  66          1HD1      ILE  66  -5.856   8.855   4.781
  530   HD13  ILE  66          2HD1      ILE  66  -4.940   8.614   6.269
  531    HA   PRO  67           HA       PRO  67  -9.133   3.147   7.641
  532    HB2  PRO  67           2HB      PRO  67 -11.821   3.374   8.039
  533    HB3  PRO  67           1HB      PRO  67 -10.614   4.041   9.143
  534    HG2  PRO  67           2HG      PRO  67 -12.184   5.415   6.999
  535    HG3  PRO  67           1HG      PRO  67 -11.803   5.972   8.639
  536    HD2  PRO  67           2HD      PRO  67 -10.450   6.844   6.473
  537    HD3  PRO  67           1HD      PRO  67  -9.669   6.634   8.053
  538    H    ASP  68           H        ASP  68 -11.133   4.561   5.091
  539    HA   ASP  68           HA       ASP  68 -12.317   2.151   4.229
  540    HB2  ASP  68           2HB      ASP  68 -13.140   3.369   2.386
  541    HB3  ASP  68           1HB      ASP  68 -13.036   4.550   3.688
  542    H    ALA  69           H        ALA  69  -9.250   3.624   3.622
  543    HA   ALA  69           HA       ALA  69  -8.608   2.118   1.297
  544    HB1  ALA  69           1HB      ALA  69  -6.720   3.534   3.157
  545    HB2  ALA  69           2HB      ALA  69  -7.590   4.310   1.834
  546    HB3  ALA  69           3HB      ALA  69  -6.406   3.049   1.491
  547    H    VAL  70           H        VAL  70  -7.133   2.060   4.507
  548    HA   VAL  70           HA       VAL  70  -5.863  -0.430   4.142
  549    HB   VAL  70           HB       VAL  70  -6.445   1.240   6.566
  550   HG11  VAL  70          1HG1      VAL  70  -6.528  -0.718   7.710
  551   HG12  VAL  70          2HG1      VAL  70  -4.774  -0.564   7.601
  552   HG13  VAL  70          3HG1      VAL  70  -5.640  -1.607   6.472
  553   HG21  VAL  70          3HG2      VAL  70  -3.972   0.443   5.049
  554   HG22  VAL  70          1HG2      VAL  70  -3.915   1.211   6.636
  555   HG23  VAL  70          2HG2      VAL  70  -4.643   2.059   5.272
  556    H    GLU  71           H        GLU  71  -9.088   0.376   4.838
  557    HA   GLU  71           HA       GLU  71  -9.808  -1.897   6.372
  558    HB2  GLU  71           2HB      GLU  71 -11.253   0.269   4.944
  559    HB3  GLU  71           1HB      GLU  71 -12.152  -1.203   5.281
  560    HG2  GLU  71           2HG      GLU  71 -10.615   0.092   7.476
  561    HG3  GLU  71           1HG      GLU  71 -12.154   0.786   6.970
  562    H    TYR  72           H        TYR  72 -10.008  -1.112   2.920
  563    HA   TYR  72           HA       TYR  72 -11.225  -3.539   2.152
  564    HB2  TYR  72           2HB      TYR  72 -11.376  -2.506   0.175
  565    HB3  TYR  72           1HB      TYR  72 -10.522  -1.144   0.892
  566    HD1  TYR  72           1HD      TYR  72  -8.123  -0.846   0.518
  567    HD2  TYR  72           2HD      TYR  72 -10.256  -4.038  -1.314
  568    HE1  TYR  72           1HE      TYR  72  -6.251  -1.195  -1.039
  569    HE2  TYR  72           2HE      TYR  72  -8.391  -4.396  -2.876
  570    HH   TYR  72           HH       TYR  72  -5.704  -3.825  -2.697
  571    H    ILE  73           H        ILE  73  -7.873  -2.434   2.036
  572    HA   ILE  73           HA       ILE  73  -6.836  -4.857   1.014
  573    HB   ILE  73           HB       ILE  73  -4.640  -3.907   2.094
  574   HG12  ILE  73          2HG1      ILE  73  -6.530  -2.053   3.037
  575   HG13  ILE  73          1HG1      ILE  73  -4.777  -1.940   3.146
  576   HG21  ILE  73          1HG2      ILE  73  -5.164  -2.035   0.037
  577   HG22  ILE  73          2HG2      ILE  73  -6.009  -3.528  -0.368
  578   HG23  ILE  73          3HG2      ILE  73  -4.273  -3.554  -0.060
  579   HD11  ILE  73          3HD1      ILE  73  -5.822   0.067   2.190
  580   HD12  ILE  73          1HD1      ILE  73  -6.424  -0.910   0.850
  581   HD13  ILE  73          2HD1      ILE  73  -4.687  -0.707   1.083
  582    H    ALA  74           H        ALA  74  -7.577  -3.733   4.200
  583    HA   ALA  74           HA       ALA  74  -6.009  -5.539   5.679
  584    HB1  ALA  74           1HB      ALA  74  -8.302  -3.767   6.245
  585    HB2  ALA  74           2HB      ALA  74  -6.751  -3.915   7.071
  586    HB3  ALA  74           3HB      ALA  74  -8.027  -5.095   7.373
  587    H    GLN  75           H        GLN  75  -9.242  -5.761   4.347
  588    HA   GLN  75           HA       GLN  75  -9.781  -8.296   5.541
  589    HB2  GLN  75           2HB      GLN  75 -11.243  -6.874   3.321
  590    HB3  GLN  75           1HB      GLN  75 -11.839  -8.265   4.215
  591    HG2  GLN  75           2HG      GLN  75 -11.838  -5.438   4.921
  592    HG3  GLN  75           1HG      GLN  75 -12.874  -6.751   5.480
  593   HE21  GLN  75          1HE2      GLN  75 -10.629  -4.548   6.418
  594   HE22  GLN  75          2HE2      GLN  75 -10.055  -5.310   7.857
  595    H    ASN  76           H        ASN  76  -9.100  -7.178   2.261
  596    HA   ASN  76           HA       ASN  76  -9.239  -9.471   0.818
  597    HB2  ASN  76           2HB      ASN  76  -7.568  -7.051   0.665
  598    HB3  ASN  76           1HB      ASN  76  -6.887  -8.454  -0.153
  599   HD21  ASN  76          1HD2      ASN  76  -9.213  -5.975  -0.249
  600   HD22  ASN  76          2HD2      ASN  76  -9.968  -6.420  -1.737
  601    HA   PRO  77           HA       PRO  77  -4.761 -11.025   1.770
  602    HB2  PRO  77           2HB      PRO  77  -3.455  -9.470   3.681
  603    HB3  PRO  77           1HB      PRO  77  -3.162  -9.422   1.941
  604    HG2  PRO  77           2HG      PRO  77  -4.845  -7.629   3.631
  605    HG3  PRO  77           1HG      PRO  77  -3.818  -7.226   2.242
  606    HD2  PRO  77           2HD      PRO  77  -6.479  -7.365   1.994
  607    HD3  PRO  77           1HD      PRO  77  -5.406  -7.945   0.703
  608    H    MET  78           H        MET  78  -6.500  -9.385   4.402
  609    HA   MET  78           HA       MET  78  -5.726 -10.984   6.529
  610    HB2  MET  78           2HB      MET  78  -6.998  -9.150   7.157
  611    HB3  MET  78           1HB      MET  78  -8.207  -9.431   5.910
  612    HG2  MET  78           2HG      MET  78  -8.612 -11.625   7.351
  613    HG3  MET  78           1HG      MET  78  -7.966 -10.589   8.622
  614    HE1  MET  78           3HE      MET  78 -12.025 -11.167   7.896
  615    HE2  MET  78           1HE      MET  78 -11.222 -11.106   9.464
  616    HE3  MET  78           2HE      MET  78 -10.563 -12.112   8.175
  617    H    ALA  79           H        ALA  79  -7.611 -11.811   3.806
  618    HA   ALA  79           HA       ALA  79  -8.442 -14.291   5.083
  619    HB1  ALA  79           1HB      ALA  79 -10.044 -12.452   3.822
  620    HB2  ALA  79           2HB      ALA  79 -10.469 -14.128   4.168
  621    HB3  ALA  79           3HB      ALA  79  -9.803 -13.694   2.594
  622    H    LYS  80           H        LYS  80  -7.471 -12.948   1.973
  623    HA   LYS  80           HA       LYS  80  -6.948 -15.401   0.707
  624    HB2  LYS  80           2HB      LYS  80  -5.406 -13.867  -0.748
  625    HB3  LYS  80           1HB      LYS  80  -7.152 -13.659  -0.796
  626    HG2  LYS  80           2HG      LYS  80  -6.943 -11.549  -0.173
  627    HG3  LYS  80           1HG      LYS  80  -6.096 -12.038   1.295
  628    HD2  LYS  80           2HD      LYS  80  -4.905 -11.430  -1.404
  629    HD3  LYS  80           1HD      LYS  80  -4.660 -10.552   0.107
  630    HE2  LYS  80           2HE      LYS  80  -3.967 -13.429   0.105
  631    HE3  LYS  80           1HE      LYS  80  -2.927 -12.364  -0.838
  632    HZ1  LYS  80           3HZ      LYS  80  -2.020 -12.477   1.323
  633    HZ2  LYS  80           1HZ      LYS  80  -3.519 -12.211   2.062
  634    HZ3  LYS  80           2HZ      LYS  80  -2.759 -10.960   1.213
  635   H282  PNS 101          8H2       PNS 101   7.178  11.993 -10.787
  636   H281  PNS 101          9H2       PNS 101   7.175  12.093  -9.024
  637   H303  PNS 101          0H3       PNS 101   5.073  15.295  -9.334
  638   H302  PNS 101          1H3       PNS 101   5.726  14.261  -8.062
  639   H301  PNS 101          2H3       PNS 101   4.524  13.625  -9.186
  640   H313  PNS 101          3H3       PNS 101   7.555  15.335  -8.949
  641   H312  PNS 101          4H3       PNS 101   8.274  14.866 -10.489
  642   H311  PNS 101          5H3       PNS 101   8.392  13.791  -9.096
  643    H32  PNS 101           6H3      PNS 101   7.013  13.870 -11.928
  644    H33  PNS 101           7H3      PNS 101   5.612  12.799 -12.677
  645    H36  PNS 101           8H3      PNS 101   6.805  16.487 -10.130
  646   H372  PNS 101          9H3       PNS 101   5.227  18.240 -10.152
  647   H371  PNS 101          0H4       PNS 101   4.271  16.793  -9.837
  648   H382  PNS 101          1H4       PNS 101   3.410  18.335 -11.645
  649   H381  PNS 101          2H4       PNS 101   4.797  17.831 -12.609
  650    H41  PNS 101           3H4      PNS 101   4.162  15.151 -10.877
  651   H422  PNS 101          4H4       PNS 101   1.270  15.098 -11.443
  652   H421  PNS 101          5H4       PNS 101   2.200  13.721 -10.854
  653   H431  PNS 101          7H4       PNS 101   1.026  14.539  -8.977
  654   H432  PNS 101          6H4       PNS 101   2.683  15.132  -8.786
  655    H44  PNS 101           8H4      PNS 101   0.952  17.091  -8.384
  Start of MODEL   17
    1    H1   MET   1           1HT      MET   1  -3.810  -8.085   7.778
    2    H2   MET   1           2HT      MET   1  -4.610  -9.496   8.337
    3    H3   MET   1           3HT      MET   1  -3.152  -8.981   9.081
    4    HA   MET   1           HA       MET   1  -5.700  -7.508   9.070
    5    HB2  MET   1           2HB      MET   1  -4.987  -8.199  11.667
    6    HB3  MET   1           1HB      MET   1  -6.253  -8.943  10.701
    7    HG2  MET   1           2HG      MET   1  -4.792 -10.678   9.981
    8    HG3  MET   1           1HG      MET   1  -3.394  -9.869  10.688
    9    HE1  MET   1           2HE      MET   1  -3.888 -13.113  11.789
   10    HE2  MET   1           3HE      MET   1  -3.082 -12.448  13.209
   11    HE3  MET   1           1HE      MET   1  -2.652 -11.870  11.599
   12    H    ASN   2           H        ASN   2  -3.172  -7.744  11.496
   13    HA   ASN   2           HA       ASN   2  -3.004  -4.920  11.746
   14    HB2  ASN   2           2HB      ASN   2  -0.826  -5.852  13.113
   15    HB3  ASN   2           1HB      ASN   2  -2.449  -5.709  13.782
   16   HD21  ASN   2          1HD2      ASN   2  -2.553  -7.413  15.100
   17   HD22  ASN   2          2HD2      ASN   2  -2.332  -9.058  14.615
   18    H    ASP   3           H        ASP   3  -1.148  -7.347  10.104
   19    HA   ASP   3           HA       ASP   3   1.252  -6.077   9.682
   20    HB2  ASP   3           2HB      ASP   3   0.882  -7.333   7.287
   21    HB3  ASP   3           1HB      ASP   3   1.441  -8.122   8.759
   22    H    VAL   4           H        VAL   4  -1.820  -5.418   8.172
   23    HA   VAL   4           HA       VAL   4  -0.793  -3.907   6.000
   24    HB   VAL   4           HB       VAL   4  -3.080  -3.109   5.672
   25   HG11  VAL   4          1HG1      VAL   4  -2.319  -5.385   4.935
   26   HG12  VAL   4          2HG1      VAL   4  -4.063  -5.203   5.132
   27   HG13  VAL   4          3HG1      VAL   4  -3.118  -6.037   6.365
   28   HG21  VAL   4          3HG2      VAL   4  -4.756  -4.327   7.336
   29   HG22  VAL   4          1HG2      VAL   4  -4.111  -2.717   7.660
   30   HG23  VAL   4          2HG2      VAL   4  -3.394  -4.128   8.438
   31    H    LEU   5           H        LEU   5  -2.443  -2.817   8.990
   32    HA   LEU   5           HA       LEU   5  -1.901  -0.093   8.479
   33    HB2  LEU   5           2HB      LEU   5  -2.634   0.310  10.796
   34    HB3  LEU   5           1HB      LEU   5  -3.768  -0.635   9.861
   35    HG   LEU   5           HG       LEU   5  -3.502  -1.378  12.217
   36   HD11  LEU   5          1HD1      LEU   5  -3.928  -2.822  10.003
   37   HD12  LEU   5          2HD1      LEU   5  -3.976  -3.492  11.634
   38   HD13  LEU   5          3HD1      LEU   5  -2.523  -3.665  10.650
   39   HD21  LEU   5          3HD2      LEU   5  -1.547  -1.982  13.131
   40   HD22  LEU   5          1HD2      LEU   5  -0.837  -1.020  11.837
   41   HD23  LEU   5          2HD2      LEU   5  -0.982  -2.767  11.659
   42    H    THR   6           H        THR   6  -0.196  -2.565  10.236
   43    HA   THR   6           HA       THR   6   1.583  -0.929  11.653
   44    HB   THR   6           HB       THR   6   1.487  -3.153  12.361
   45    HG1  THR   6           1HG      THR   6   3.609  -2.573  12.450
   46   HG21  THR   6          3HG2      THR   6   2.531  -4.602  10.115
   47   HG22  THR   6          1HG2      THR   6   1.030  -3.777   9.693
   48   HG23  THR   6          2HG2      THR   6   1.071  -4.889  11.063
   49    H    ARG   7           H        ARG   7   2.157  -2.693   8.633
   50    HA   ARG   7           HA       ARG   7   4.629  -1.355   8.159
   51    HB2  ARG   7           2HB      ARG   7   4.656  -3.493   7.283
   52    HB3  ARG   7           1HB      ARG   7   2.997  -3.390   6.709
   53    HG2  ARG   7           2HG      ARG   7   4.451  -1.445   5.294
   54    HG3  ARG   7           1HG      ARG   7   5.431  -2.913   5.295
   55    HD2  ARG   7           2HD      ARG   7   2.892  -2.337   3.952
   56    HD3  ARG   7           1HD      ARG   7   4.157  -3.493   3.539
   57    HE   ARG   7           HE       ARG   7   1.744  -4.150   4.700
   58   HH11  ARG   7          1HH1      ARG   7   5.120  -4.628   5.407
   59   HH12  ARG   7          2HH1      ARG   7   4.867  -6.129   6.235
   60   HH21  ARG   7          1HH2      ARG   7   1.400  -6.125   5.789
   61   HH22  ARG   7          2HH2      ARG   7   2.752  -6.979   6.451
   62    H    VAL   8           H        VAL   8   1.390  -1.241   6.754
   63    HA   VAL   8           HA       VAL   8   1.953   0.622   4.743
   64    HB   VAL   8           HB       VAL   8  -0.182  -0.849   5.172
   65   HG11  VAL   8          1HG1      VAL   8  -2.051   0.377   6.085
   66   HG12  VAL   8          2HG1      VAL   8  -1.031   1.787   6.368
   67   HG13  VAL   8          3HG1      VAL   8  -0.759   0.303   7.282
   68   HG21  VAL   8          3HG2      VAL   8  -0.901   1.796   4.053
   69   HG22  VAL   8          1HG2      VAL   8  -1.102   0.182   3.372
   70   HG23  VAL   8          2HG2      VAL   8   0.476   0.967   3.328
   71    H    LEU   9           H        LEU   9   0.583   1.096   7.996
   72    HA   LEU   9           HA       LEU   9   0.305   3.879   7.856
   73    HB2  LEU   9           2HB      LEU   9  -0.114   3.831  10.131
   74    HB3  LEU   9           1HB      LEU   9  -0.533   2.203   9.640
   75    HG   LEU   9           HG       LEU   9   1.846   1.562  10.358
   76   HD11  LEU   9          1HD1      LEU   9   1.789   4.392  11.034
   77   HD12  LEU   9          2HD1      LEU   9   3.157   3.289  10.878
   78   HD13  LEU   9          3HD1      LEU   9   2.253   3.363  12.391
   79   HD21  LEU   9          3HD2      LEU   9   1.125   1.589  12.810
   80   HD22  LEU   9          1HD2      LEU   9   0.076   0.759  11.660
   81   HD23  LEU   9          2HD2      LEU   9  -0.349   2.370  12.238
   82    H    GLU  10           H        GLU  10   3.010   1.888   8.987
   83    HA   GLU  10           HA       GLU  10   4.664   4.023   9.780
   84    HB2  GLU  10           2HB      GLU  10   6.461   2.395   9.823
   85    HB3  GLU  10           1HB      GLU  10   5.002   1.682  10.499
   86    HG2  GLU  10           2HG      GLU  10   4.724   0.242   8.748
   87    HG3  GLU  10           1HG      GLU  10   5.565   1.290   7.608
   88    H    VAL  11           H        VAL  11   4.120   2.414   6.753
   89    HA   VAL  11           HA       VAL  11   6.314   3.300   5.301
   90    HB   VAL  11           HB       VAL  11   3.664   2.275   4.652
   91   HG11  VAL  11          1HG1      VAL  11   3.836   4.352   3.275
   92   HG12  VAL  11          2HG1      VAL  11   3.689   2.862   2.341
   93   HG13  VAL  11          3HG1      VAL  11   5.260   3.649   2.508
   94   HG21  VAL  11          3HG2      VAL  11   5.411   1.187   2.892
   95   HG22  VAL  11          1HG2      VAL  11   5.088   0.549   4.505
   96   HG23  VAL  11          2HG2      VAL  11   6.480   1.598   4.233
   97    H    VAL  12           H        VAL  12   3.074   4.697   5.424
   98    HA   VAL  12           HA       VAL  12   3.741   7.007   3.921
   99    HB   VAL  12           HB       VAL  12   1.560   7.565   4.067
  100   HG11  VAL  12          1HG1      VAL  12   1.041   4.969   5.451
  101   HG12  VAL  12          2HG1      VAL  12   1.784   4.981   3.851
  102   HG13  VAL  12          3HG1      VAL  12   0.195   5.705   4.091
  103   HG21  VAL  12          3HG2      VAL  12   0.225   7.431   6.165
  104   HG22  VAL  12          1HG2      VAL  12   1.666   8.438   6.300
  105   HG23  VAL  12          2HG2      VAL  12   1.658   6.813   6.985
  106    H    LYS  13           H        LYS  13   3.322   6.443   7.406
  107    HA   LYS  13           HA       LYS  13   3.706   9.029   8.315
  108    HB2  LYS  13           2HB      LYS  13   4.071   8.118  10.436
  109    HB3  LYS  13           1HB      LYS  13   3.105   6.892   9.627
  110    HG2  LYS  13           2HG      LYS  13   5.145   5.621   9.137
  111    HG3  LYS  13           1HG      LYS  13   6.093   6.840  10.002
  112    HD2  LYS  13           2HD      LYS  13   3.965   5.029  11.139
  113    HD3  LYS  13           1HD      LYS  13   5.696   4.988  11.480
  114    HE2  LYS  13           2HE      LYS  13   4.683   7.615  11.995
  115    HE3  LYS  13           1HE      LYS  13   3.689   6.427  12.839
  116    HZ1  LYS  13           3HZ      LYS  13   5.514   7.121  14.225
  117    HZ2  LYS  13           1HZ      LYS  13   6.640   6.699  13.035
  118    HZ3  LYS  13           2HZ      LYS  13   5.726   5.497  13.799
  119    H    ASN  14           H        ASN  14   6.155   6.513   7.754
  120    HA   ASN  14           HA       ASN  14   8.295   8.355   8.278
  121    HB2  ASN  14           2HB      ASN  14   8.503   5.557   7.168
  122    HB3  ASN  14           1HB      ASN  14   9.773   6.490   7.955
  123   HD21  ASN  14          1HD2      ASN  14   7.617   4.069   8.382
  124   HD22  ASN  14          2HD2      ASN  14   7.471   4.103  10.104
  125    H    PHE  15           H        PHE  15   6.309   7.867   5.712
  126    HA   PHE  15           HA       PHE  15   8.101   7.862   3.530
  127    HB2  PHE  15           2HB      PHE  15   5.232   8.095   3.934
  128    HB3  PHE  15           1HB      PHE  15   5.796   9.153   2.647
  129    HD1  PHE  15           2HD      PHE  15   7.523   6.024   3.388
  130    HD2  PHE  15           1HD      PHE  15   4.591   7.917   0.953
  131    HE1  PHE  15           2HE      PHE  15   7.576   4.110   1.843
  132    HE2  PHE  15           1HE      PHE  15   4.638   6.006  -0.596
  133    HZ   PHE  15           HZ       PHE  15   6.133   4.100  -0.152
  134    H    GLU  16           H        GLU  16   6.939  10.308   5.653
  135    HA   GLU  16           HA       GLU  16   8.205  12.324   5.927
  136    HB2  GLU  16           2HB      GLU  16   9.345  13.350   4.176
  137    HB3  GLU  16           1HB      GLU  16   9.513  11.642   3.801
  138    HG2  GLU  16           2HG      GLU  16   8.634  11.997   1.813
  139    HG3  GLU  16           1HG      GLU  16   7.145  12.556   2.571
  140    H    LYS  17           H        LYS  17   5.462  11.414   4.205
  141    HA   LYS  17           HA       LYS  17   4.402  13.932   3.501
  142    HB2  LYS  17           2HB      LYS  17   3.548  11.191   3.451
  143    HB3  LYS  17           1HB      LYS  17   2.258  12.199   4.091
  144    HG2  LYS  17           2HG      LYS  17   1.951  12.035   1.743
  145    HG3  LYS  17           1HG      LYS  17   2.518  13.670   2.092
  146    HD2  LYS  17           2HD      LYS  17   4.515  11.558   1.426
  147    HD3  LYS  17           1HD      LYS  17   3.558  12.270   0.125
  148    HE2  LYS  17           2HE      LYS  17   5.367  13.706   2.060
  149    HE3  LYS  17           1HE      LYS  17   5.611  13.496   0.327
  150    HZ1  LYS  17           3HZ      LYS  17   4.759  15.602   0.412
  151    HZ2  LYS  17           1HZ      LYS  17   3.758  15.283   1.739
  152    HZ3  LYS  17           2HZ      LYS  17   3.332  14.719   0.202
  153    H    VAL  18           H        VAL  18   3.863  11.854   6.342
  154    HA   VAL  18           HA       VAL  18   3.739  13.904   8.204
  155    HB   VAL  18           HB       VAL  18   1.008  13.332   8.379
  156   HG11  VAL  18          1HG1      VAL  18   1.701  15.409   9.111
  157   HG12  VAL  18          2HG1      VAL  18   0.890  15.814   7.598
  158   HG13  VAL  18          3HG1      VAL  18   2.650  15.722   7.658
  159   HG21  VAL  18          3HG2      VAL  18   0.051  13.377   6.347
  160   HG22  VAL  18          1HG2      VAL  18   1.631  12.835   5.779
  161   HG23  VAL  18          2HG2      VAL  18   1.211  14.547   5.716
  162    H    ASP  19           H        ASP  19   2.774  13.194  10.305
  163    HA   ASP  19           HA       ASP  19   3.584  10.558  10.901
  164    HB2  ASP  19           2HB      ASP  19   2.106  11.237  13.072
  165    HB3  ASP  19           1HB      ASP  19   3.769  11.760  12.814
  166    H    ALA  20           H        ALA  20   2.511   8.861  10.093
  167    HA   ALA  20           HA       ALA  20  -0.183   8.779   9.378
  168    HB1  ALA  20           1HB      ALA  20   1.396   6.371  10.240
  169    HB2  ALA  20           2HB      ALA  20   1.657   7.181   8.694
  170    HB3  ALA  20           3HB      ALA  20   0.090   6.456   9.058
  171    H    SER  21           H        SER  21   1.261   8.631  12.467
  172    HA   SER  21           HA       SER  21  -0.668   7.081  13.826
  173    HB2  SER  21           2HB      SER  21   1.528   8.920  14.594
  174    HB3  SER  21           1HB      SER  21   0.263   8.668  15.796
  175    HG   SER  21           HG       SER  21   1.115   6.356  14.598
  176    H    LYS  22           H        LYS  22  -0.716  10.259  12.585
  177    HA   LYS  22           HA       LYS  22  -2.735  11.263  14.367
  178    HB2  LYS  22           2HB      LYS  22  -2.761  13.221  12.870
  179    HB3  LYS  22           1HB      LYS  22  -1.134  12.813  13.399
  180    HG2  LYS  22           2HG      LYS  22  -0.510  12.827  11.278
  181    HG3  LYS  22           1HG      LYS  22  -1.523  11.406  11.014
  182    HD2  LYS  22           2HD      LYS  22  -2.028  13.234   9.438
  183    HD3  LYS  22           1HD      LYS  22  -3.410  12.815  10.451
  184    HE2  LYS  22           2HE      LYS  22  -2.532  14.713  11.987
  185    HE3  LYS  22           1HE      LYS  22  -1.649  15.233  10.552
  186    HZ1  LYS  22           3HZ      LYS  22  -3.959  15.032   9.434
  187    HZ2  LYS  22           1HZ      LYS  22  -3.605  16.397  10.371
  188    HZ3  LYS  22           2HZ      LYS  22  -4.553  15.152  11.013
  189    H    VAL  23           H        VAL  23  -2.683   9.303  11.607
  190    HA   VAL  23           HA       VAL  23  -5.004  10.007  10.247
  191    HB   VAL  23           HB       VAL  23  -5.022   7.829   9.305
  192   HG11  VAL  23          1HG1      VAL  23  -3.173   8.462   8.240
  193   HG12  VAL  23          2HG1      VAL  23  -2.265   7.509   9.414
  194   HG13  VAL  23          3HG1      VAL  23  -2.524   9.231   9.689
  195   HG21  VAL  23          3HG2      VAL  23  -4.149   7.036  11.933
  196   HG22  VAL  23          1HG2      VAL  23  -3.131   6.311  10.688
  197   HG23  VAL  23          2HG2      VAL  23  -4.877   6.066  10.653
  198    H    THR  24           H        THR  24  -7.069   9.994  10.772
  199    HA   THR  24           HA       THR  24  -7.931   8.419  13.063
  200    HB   THR  24           HB       THR  24  -9.595  10.665  12.171
  201    HG1  THR  24           1HG      THR  24  -7.456  11.506  12.032
  202   HG21  THR  24          3HG2      THR  24 -10.480  10.208  14.148
  203   HG22  THR  24          1HG2      THR  24  -9.044  10.946  14.857
  204   HG23  THR  24          2HG2      THR  24  -9.106   9.201  14.608
  205    HA   PRO  25           HA       PRO  25 -10.868   6.087  10.783
  206    HB2  PRO  25           2HB      PRO  25 -13.032   7.158  12.517
  207    HB3  PRO  25           1HB      PRO  25 -12.574   5.482  12.195
  208    HG2  PRO  25           2HG      PRO  25 -11.978   6.634  14.522
  209    HG3  PRO  25           1HG      PRO  25 -10.843   5.520  13.737
  210    HD2  PRO  25           2HD      PRO  25 -10.777   8.504  13.884
  211    HD3  PRO  25           1HD      PRO  25  -9.438   7.341  13.957
  212    H    GLU  26           H        GLU  26 -11.854   9.393  11.551
  213    HA   GLU  26           HA       GLU  26 -13.454   9.485   9.114
  214    HB2  GLU  26           2HB      GLU  26 -14.181  10.303  11.539
  215    HB3  GLU  26           1HB      GLU  26 -13.376  11.775  11.010
  216    HG2  GLU  26           2HG      GLU  26 -14.974  12.272   9.498
  217    HG3  GLU  26           1HG      GLU  26 -15.297  10.582   9.117
  218    H    SER  27           H        SER  27 -10.384  10.125  10.095
  219    HA   SER  27           HA       SER  27  -9.813  12.653   9.030
  220    HB2  SER  27           2HB      SER  27  -8.315  11.186  10.487
  221    HB3  SER  27           1HB      SER  27  -7.889  10.327   9.007
  222    HG   SER  27           HG       SER  27  -7.716  13.057   8.800
  223    H    HIS  28           H        HIS  28  -9.411  13.386   7.019
  224    HA   HIS  28           HA       HIS  28 -10.127  11.721   4.805
  225    HB2  HIS  28           2HB      HIS  28  -9.391  14.615   5.106
  226    HB3  HIS  28           1HB      HIS  28  -9.515  13.882   3.510
  227    HD1  HIS  28           1HD      HIS  28 -11.952  12.698   3.052
  228    HD2  HIS  28           2HD      HIS  28 -11.744  15.552   6.066
  229    HE1  HIS  28           1HE      HIS  28 -14.326  13.420   3.458
  230    HE2  HIS  28           2HE      HIS  28 -14.185  15.083   5.347
  231    H    PHE  29           H        PHE  29  -8.818  11.197   3.019
  232    HA   PHE  29           HA       PHE  29  -6.155  10.499   3.659
  233    HB2  PHE  29           2HB      PHE  29  -7.806   9.417   1.963
  234    HB3  PHE  29           1HB      PHE  29  -7.174  10.616   0.840
  235    HD1  PHE  29           2HD      PHE  29  -4.487  10.124   2.824
  236    HD2  PHE  29           1HD      PHE  29  -6.831   7.980  -0.009
  237    HE1  PHE  29           2HE      PHE  29  -2.568   8.660   2.348
  238    HE2  PHE  29           1HE      PHE  29  -4.916   6.512  -0.488
  239    HZ   PHE  29           HZ       PHE  29  -2.780   6.852   0.691
  240    H    VAL  30           H        VAL  30  -5.575  11.330   0.654
  241    HA   VAL  30           HA       VAL  30  -3.616  13.109   0.942
  242    HB   VAL  30           HB       VAL  30  -3.878  13.840  -1.296
  243   HG11  VAL  30          1HG1      VAL  30  -4.175  11.802  -2.493
  244   HG12  VAL  30          2HG1      VAL  30  -5.195  11.133  -1.219
  245   HG13  VAL  30          3HG1      VAL  30  -3.475  11.394  -0.925
  246   HG21  VAL  30          3HG2      VAL  30  -6.164  13.249  -2.438
  247   HG22  VAL  30          1HG2      VAL  30  -5.976  14.749  -1.529
  248   HG23  VAL  30          2HG2      VAL  30  -6.777  13.363  -0.788
  249    H    LYS  31           H        LYS  31  -6.992  13.849   1.173
  250    HA   LYS  31           HA       LYS  31  -6.790  16.664   1.084
  251    HB2  LYS  31           2HB      LYS  31  -8.939  15.285   2.642
  252    HB3  LYS  31           1HB      LYS  31  -9.048  16.713   1.623
  253    HG2  LYS  31           2HG      LYS  31  -8.995  13.832   0.833
  254    HG3  LYS  31           1HG      LYS  31 -10.148  15.092   0.391
  255    HD2  LYS  31           2HD      LYS  31  -7.282  15.289  -0.456
  256    HD3  LYS  31           1HD      LYS  31  -8.416  14.285  -1.362
  257    HE2  LYS  31           2HE      LYS  31  -8.302  16.478  -2.363
  258    HE3  LYS  31           1HE      LYS  31  -9.889  16.243  -1.631
  259    HZ1  LYS  31           3HZ      LYS  31  -8.162  17.382   0.270
  260    HZ2  LYS  31           1HZ      LYS  31  -9.566  18.041  -0.405
  261    HZ3  LYS  31           2HZ      LYS  31  -8.070  18.297  -1.150
  262    H    ASP  32           H        ASP  32  -7.011  14.390   3.808
  263    HA   ASP  32           HA       ASP  32  -6.535  16.504   5.701
  264    HB2  ASP  32           2HB      ASP  32  -7.884  14.098   5.829
  265    HB3  ASP  32           1HB      ASP  32  -6.416  13.785   6.750
  266    H    LEU  33           H        LEU  33  -4.542  15.195   3.658
  267    HA   LEU  33           HA       LEU  33  -2.187  15.658   3.894
  268    HB2  LEU  33           2HB      LEU  33  -2.602  14.440   6.625
  269    HB3  LEU  33           1HB      LEU  33  -1.040  14.867   5.955
  270    HG   LEU  33           HG       LEU  33  -1.264  17.026   6.501
  271   HD11  LEU  33          1HD1      LEU  33  -3.204  16.990   4.680
  272   HD12  LEU  33          2HD1      LEU  33  -2.880  18.396   5.693
  273   HD13  LEU  33          3HD1      LEU  33  -4.187  17.290   6.113
  274   HD21  LEU  33          3HD2      LEU  33  -3.746  16.687   8.030
  275   HD22  LEU  33          1HD2      LEU  33  -2.153  17.235   8.552
  276   HD23  LEU  33          2HD2      LEU  33  -2.483  15.510   8.388
  277    H    GLY  34           H        GLY  34  -3.641  13.691   2.576
  278    HA2  GLY  34           2HA      GLY  34  -2.645  11.078   3.224
  279    HA3  GLY  34           1HA      GLY  34  -3.538  11.525   1.778
  280    H    LEU  35           H        LEU  35  -1.589   9.765   1.411
  281    HA   LEU  35           HA       LEU  35   0.983  10.828   0.946
  282    HB2  LEU  35           2HB      LEU  35  -0.455   8.367   0.013
  283    HB3  LEU  35           1HB      LEU  35   1.135   8.762  -0.612
  284    HG   LEU  35           HG       LEU  35   1.766   7.407   1.100
  285   HD11  LEU  35          1HD1      LEU  35   2.564   8.669   2.947
  286   HD12  LEU  35          2HD1      LEU  35   1.323   9.903   2.724
  287   HD13  LEU  35          3HD1      LEU  35   2.616   9.726   1.536
  288   HD21  LEU  35          3HD2      LEU  35   0.324   6.572   2.576
  289   HD22  LEU  35          1HD2      LEU  35  -0.897   7.602   1.832
  290   HD23  LEU  35          2HD2      LEU  35  -0.018   8.162   3.254
  291    H    ASN  36           H        ASN  36   1.774  11.998  -0.683
  292    HA   ASN  36           HA       ASN  36   0.105  13.108  -2.658
  293    HB2  ASN  36           2HB      ASN  36   2.271  14.070  -1.703
  294    HB3  ASN  36           1HB      ASN  36   3.116  12.995  -2.811
  295   HD21  ASN  36          1HD2      ASN  36   3.318  13.554  -4.894
  296   HD22  ASN  36          2HD2      ASN  36   2.663  14.992  -5.592
  297    H    SER  37           H        SER  37   1.189  13.067  -5.065
  298    HA   SER  37           HA       SER  37   0.376  10.683  -6.218
  299    HB2  SER  37           2HB      SER  37   1.064  13.097  -7.208
  300    HB3  SER  37           1HB      SER  37   2.497  12.171  -7.654
  301    H    LEU  38           H        LEU  38   3.709  11.818  -5.937
  302    HA   LEU  38           HA       LEU  38   4.962   9.444  -6.665
  303    HB2  LEU  38           2HB      LEU  38   6.937  10.441  -6.040
  304    HB3  LEU  38           1HB      LEU  38   5.904  11.842  -6.256
  305    HG   LEU  38           HG       LEU  38   7.243  12.094  -4.254
  306   HD11  LEU  38          1HD1      LEU  38   4.476  12.353  -4.401
  307   HD12  LEU  38          2HD1      LEU  38   5.559  13.133  -3.248
  308   HD13  LEU  38          3HD1      LEU  38   4.782  11.605  -2.833
  309   HD21  LEU  38          3HD2      LEU  38   6.846   9.351  -3.960
  310   HD22  LEU  38          1HD2      LEU  38   5.990  10.089  -2.606
  311   HD23  LEU  38          2HD2      LEU  38   7.703  10.429  -2.858
  312    H    ASP  39           H        ASP  39   3.671  10.507  -3.619
  313    HA   ASP  39           HA       ASP  39   4.827   8.421  -2.047
  314    HB2  ASP  39           2HB      ASP  39   2.788  10.549  -1.606
  315    HB3  ASP  39           1HB      ASP  39   2.818   9.187  -0.491
  316    H    VAL  40           H        VAL  40   1.376   9.011  -2.322
  317    HA   VAL  40           HA       VAL  40   0.250   6.726  -1.715
  318    HB   VAL  40           HB       VAL  40  -0.587   8.811  -3.313
  319   HG11  VAL  40          1HG1      VAL  40   0.184   7.215  -5.225
  320   HG12  VAL  40          2HG1      VAL  40  -1.356   8.065  -5.356
  321   HG13  VAL  40          3HG1      VAL  40  -1.322   6.371  -4.869
  322   HG21  VAL  40          3HG2      VAL  40  -1.726   6.599  -1.857
  323   HG22  VAL  40          1HG2      VAL  40  -2.701   6.992  -3.274
  324   HG23  VAL  40          2HG2      VAL  40  -2.344   8.238  -2.077
  325    H    VAL  41           H        VAL  41   2.098   7.165  -4.687
  326    HA   VAL  41           HA       VAL  41   1.541   4.596  -5.751
  327    HB   VAL  41           HB       VAL  41   2.260   6.088  -7.377
  328   HG11  VAL  41          1HG1      VAL  41   3.495   7.885  -6.942
  329   HG12  VAL  41          2HG1      VAL  41   4.871   6.891  -6.467
  330   HG13  VAL  41          3HG1      VAL  41   3.640   7.316  -5.280
  331   HG21  VAL  41          3HG2      VAL  41   4.966   4.977  -7.066
  332   HG22  VAL  41          1HG2      VAL  41   3.841   4.871  -8.421
  333   HG23  VAL  41          2HG2      VAL  41   3.655   3.798  -7.034
  334    H    GLU  42           H        GLU  42   4.246   5.931  -3.882
  335    HA   GLU  42           HA       GLU  42   5.796   3.573  -3.900
  336    HB2  GLU  42           2HB      GLU  42   5.815   6.126  -2.386
  337    HB3  GLU  42           1HB      GLU  42   6.680   4.770  -1.675
  338    HG2  GLU  42           2HG      GLU  42   7.638   4.624  -4.162
  339    HG3  GLU  42           1HG      GLU  42   7.285   6.350  -4.091
  340    H    VAL  43           H        VAL  43   3.456   4.882  -1.648
  341    HA   VAL  43           HA       VAL  43   3.716   2.872   0.318
  342    HB   VAL  43           HB       VAL  43   2.526   4.429   1.387
  343   HG11  VAL  43          1HG1      VAL  43   1.133   6.138   0.077
  344   HG12  VAL  43          2HG1      VAL  43   1.850   5.410  -1.359
  345   HG13  VAL  43          3HG1      VAL  43   2.882   6.156  -0.139
  346   HG21  VAL  43          3HG2      VAL  43   0.812   2.698   1.145
  347   HG22  VAL  43          1HG2      VAL  43   0.240   3.506  -0.307
  348   HG23  VAL  43          2HG2      VAL  43   0.115   4.317   1.247
  349    H    VAL  44           H        VAL  44   1.365   3.388  -2.261
  350    HA   VAL  44           HA       VAL  44  -0.189   1.101  -1.844
  351    HB   VAL  44           HB       VAL  44  -0.824   1.301  -4.243
  352   HG11  VAL  44          1HG1      VAL  44  -1.221   3.174  -2.156
  353   HG12  VAL  44          2HG1      VAL  44  -2.301   2.770  -3.490
  354   HG13  VAL  44          3HG1      VAL  44  -1.116   4.064  -3.675
  355   HG21  VAL  44          3HG2      VAL  44   0.100   3.440  -5.361
  356   HG22  VAL  44          1HG2      VAL  44   1.085   1.977  -5.381
  357   HG23  VAL  44          2HG2      VAL  44   1.437   3.262  -4.225
  358    H    PHE  45           H        PHE  45   2.849   1.609  -3.477
  359    HA   PHE  45           HA       PHE  45   2.973  -0.949  -4.720
  360    HB2  PHE  45           2HB      PHE  45   4.536   1.451  -4.671
  361    HB3  PHE  45           1HB      PHE  45   5.587   0.078  -4.335
  362    HD1  PHE  45           1HD      PHE  45   5.408  -1.922  -5.932
  363    HD2  PHE  45           2HD      PHE  45   3.985   1.979  -6.855
  364    HE1  PHE  45           1HE      PHE  45   5.491  -2.467  -8.332
  365    HE2  PHE  45           2HE      PHE  45   4.064   1.445  -9.258
  366    HZ   PHE  45           HZ       PHE  45   4.818  -0.781  -9.998
  367    H    ALA  46           H        ALA  46   3.940   0.417  -1.688
  368    HA   ALA  46           HA       ALA  46   5.618  -1.666  -0.802
  369    HB1  ALA  46           1HB      ALA  46   4.159   0.544   0.580
  370    HB2  ALA  46           2HB      ALA  46   5.895   0.326   0.356
  371    HB3  ALA  46           3HB      ALA  46   5.020  -0.687   1.504
  372    H    ILE  47           H        ILE  47   2.298  -0.863   0.096
  373    HA   ILE  47           HA       ILE  47   1.748  -3.110   1.634
  374    HB   ILE  47           HB       ILE  47  -0.695  -2.659   0.642
  375   HG12  ILE  47          2HG1      ILE  47   0.827  -0.833  -0.803
  376   HG13  ILE  47          1HG1      ILE  47  -0.925  -0.818  -0.620
  377   HG21  ILE  47          1HG2      ILE  47   0.470  -0.575   2.444
  378   HG22  ILE  47          2HG2      ILE  47   0.369  -2.256   2.966
  379   HG23  ILE  47          3HG2      ILE  47  -1.098  -1.379   2.530
  380   HD11  ILE  47          3HD1      ILE  47  -0.824   0.758   1.123
  381   HD12  ILE  47          1HD1      ILE  47   0.280   1.337  -0.124
  382   HD13  ILE  47          2HD1      ILE  47   0.915   0.545   1.318
  383    H    GLU  48           H        GLU  48   1.520  -2.635  -1.857
  384    HA   GLU  48           HA       GLU  48   0.162  -4.955  -2.551
  385    HB2  GLU  48           2HB      GLU  48   1.469  -2.903  -3.915
  386    HB3  GLU  48           1HB      GLU  48   2.308  -4.365  -4.416
  387    HG2  GLU  48           2HG      GLU  48  -0.672  -4.293  -4.452
  388    HG3  GLU  48           1HG      GLU  48   0.239  -3.506  -5.740
  389    H    GLN  49           H        GLN  49   3.510  -4.435  -1.741
  390    HA   GLN  49           HA       GLN  49   4.466  -6.988  -2.501
  391    HB2  GLN  49           2HB      GLN  49   5.521  -4.618  -1.253
  392    HB3  GLN  49           1HB      GLN  49   6.052  -6.042  -0.372
  393    HG2  GLN  49           2HG      GLN  49   7.710  -6.022  -1.881
  394    HG3  GLN  49           1HG      GLN  49   6.526  -6.858  -2.884
  395   HE21  GLN  49          1HE2      GLN  49   5.889  -5.947  -4.735
  396   HE22  GLN  49          2HE2      GLN  49   6.340  -4.368  -5.269
  397    H    GLU  50           H        GLU  50   3.206  -5.661   0.522
  398    HA   GLU  50           HA       GLU  50   3.342  -8.315   1.707
  399    HB2  GLU  50           2HB      GLU  50   4.142  -5.922   2.747
  400    HB3  GLU  50           1HB      GLU  50   2.533  -6.087   3.436
  401    HG2  GLU  50           2HG      GLU  50   4.700  -7.054   4.615
  402    HG3  GLU  50           1HG      GLU  50   3.120  -7.824   4.754
  403    H    PHE  51           H        PHE  51   1.335  -7.669  -0.220
  404    HA   PHE  51           HA       PHE  51  -1.023  -8.070   1.427
  405    HB2  PHE  51           2HB      PHE  51  -0.543  -5.867  -0.431
  406    HB3  PHE  51           1HB      PHE  51  -2.052  -6.717  -0.735
  407    HD1  PHE  51           2HD      PHE  51  -3.746  -6.894   1.082
  408    HD2  PHE  51           1HD      PHE  51  -0.301  -4.417   1.413
  409    HE1  PHE  51           2HE      PHE  51  -4.821  -5.647   2.910
  410    HE2  PHE  51           1HE      PHE  51  -1.369  -3.167   3.242
  411    HZ   PHE  51           HZ       PHE  51  -3.634  -3.782   3.993
  412    H    ILE  52           H        ILE  52   0.726  -8.724  -1.492
  413    HA   ILE  52           HA       ILE  52   0.535 -10.378  -3.043
  414    HB   ILE  52           HB       ILE  52  -1.728 -11.753  -1.745
  415   HG12  ILE  52          2HG1      ILE  52   0.588 -12.442  -0.238
  416   HG13  ILE  52          1HG1      ILE  52   0.375 -10.697  -0.144
  417   HG21  ILE  52          1HG2      ILE  52  -0.851 -13.421  -2.911
  418   HG22  ILE  52          2HG2      ILE  52   0.634 -13.314  -1.967
  419   HG23  ILE  52          3HG2      ILE  52   0.456 -12.362  -3.440
  420   HD11  ILE  52          3HD1      ILE  52  -1.455 -12.868   0.773
  421   HD12  ILE  52          1HD1      ILE  52  -2.072 -11.253   0.425
  422   HD13  ILE  52          2HD1      ILE  52  -0.833 -11.477   1.660
  423    H    LEU  53           H        LEU  53  -1.043  -7.967  -3.225
  424    HA   LEU  53           HA       LEU  53  -2.770  -8.740  -5.347
  425    HB2  LEU  53           2HB      LEU  53  -4.025  -8.970  -3.011
  426    HB3  LEU  53           1HB      LEU  53  -4.244  -7.245  -3.243
  427    HG   LEU  53           HG       LEU  53  -5.736  -7.515  -4.935
  428   HD11  LEU  53          1HD1      LEU  53  -5.712  -9.328  -6.557
  429   HD12  LEU  53          2HD1      LEU  53  -4.416 -10.126  -5.666
  430   HD13  LEU  53          3HD1      LEU  53  -4.124  -8.570  -6.442
  431   HD21  LEU  53          3HD2      LEU  53  -5.905 -10.220  -3.609
  432   HD22  LEU  53          1HD2      LEU  53  -7.179  -9.451  -4.554
  433   HD23  LEU  53          2HD2      LEU  53  -6.656  -8.733  -3.031
  434    H    ASP  54           H        ASP  54  -3.660  -6.883  -6.493
  435    HA   ASP  54           HA       ASP  54  -1.844  -4.673  -6.421
  436    HB2  ASP  54           2HB      ASP  54  -3.265  -3.855  -8.359
  437    HB3  ASP  54           1HB      ASP  54  -2.470  -5.410  -8.589
  438    H    ILE  55           H        ILE  55  -2.281  -2.552  -5.910
  439    HA   ILE  55           HA       ILE  55  -4.863  -2.031  -4.632
  440    HB   ILE  55           HB       ILE  55  -2.124  -1.151  -3.752
  441   HG12  ILE  55          2HG1      ILE  55  -2.426  -3.071  -2.577
  442   HG13  ILE  55          1HG1      ILE  55  -3.408  -2.039  -1.543
  443   HG21  ILE  55          1HG2      ILE  55  -4.297   0.499  -3.736
  444   HG22  ILE  55          2HG2      ILE  55  -2.930   0.608  -2.626
  445   HG23  ILE  55          3HG2      ILE  55  -4.393  -0.250  -2.142
  446   HD11  ILE  55          3HD1      ILE  55  -4.263  -4.069  -3.549
  447   HD12  ILE  55          1HD1      ILE  55  -5.340  -2.738  -3.124
  448   HD13  ILE  55          2HD1      ILE  55  -4.778  -3.852  -1.877
  449    HA   PRO  56           HA       PRO  56  -3.048   2.149  -6.565
  450    HB2  PRO  56           2HB      PRO  56  -1.478   0.807  -8.713
  451    HB3  PRO  56           1HB      PRO  56  -1.130   2.296  -7.826
  452    HG2  PRO  56           2HG      PRO  56   0.193   0.059  -7.269
  453    HG3  PRO  56           1HG      PRO  56  -0.315   1.157  -5.972
  454    HD2  PRO  56           2HD      PRO  56  -1.497  -1.451  -6.822
  455    HD3  PRO  56           1HD      PRO  56  -1.306  -0.777  -5.190
  456    H    ASP  57           H        ASP  57  -2.941   2.588  -9.306
  457    HA   ASP  57           HA       ASP  57  -4.209   2.662 -11.196
  458    HB2  ASP  57           2HB      ASP  57  -5.336   0.019 -10.246
  459    HB3  ASP  57           1HB      ASP  57  -5.486   0.689 -11.868
  460    H    HIS  58           H        HIS  58  -6.925   1.614 -11.455
  461    HA   HIS  58           HA       HIS  58  -8.356   3.823 -10.486
  462    HB2  HIS  58           2HB      HIS  58  -8.989   1.317 -11.898
  463    HB3  HIS  58           1HB      HIS  58 -10.313   1.974 -10.941
  464    HD1  HIS  58           1HD      HIS  58 -11.767   2.870 -12.780
  465    HD2  HIS  58           2HD      HIS  58  -7.834   4.178 -13.071
  466    HE1  HIS  58           1HE      HIS  58 -11.770   4.609 -14.596
  467    HE2  HIS  58           2HE      HIS  58  -9.396   5.449 -14.695
  468    H    ASP  59           H        ASP  59  -7.591   0.764  -9.059
  469    HA   ASP  59           HA       ASP  59  -9.639   0.663  -7.122
  470    HB2  ASP  59           2HB      ASP  59  -6.854  -0.513  -7.005
  471    HB3  ASP  59           1HB      ASP  59  -8.207  -0.970  -5.975
  472    H    ALA  60           H        ALA  60  -6.336   1.954  -7.027
  473    HA   ALA  60           HA       ALA  60  -6.521   2.804  -4.314
  474    HB1  ALA  60           1HB      ALA  60  -4.563   3.731  -6.407
  475    HB2  ALA  60           2HB      ALA  60  -4.382   2.258  -5.452
  476    HB3  ALA  60           3HB      ALA  60  -4.379   3.831  -4.655
  477    H    GLU  61           H        GLU  61  -7.383   4.161  -7.359
  478    HA   GLU  61           HA       GLU  61  -7.471   6.883  -6.472
  479    HB2  GLU  61           2HB      GLU  61  -8.137   5.414  -8.959
  480    HB3  GLU  61           1HB      GLU  61  -8.986   6.930  -8.690
  481    HG2  GLU  61           2HG      GLU  61  -6.498   6.620  -9.831
  482    HG3  GLU  61           1HG      GLU  61  -7.207   8.125  -9.250
  483    H    LYS  62           H        LYS  62  -9.676   4.195  -6.597
  484    HA   LYS  62           HA       LYS  62 -12.052   5.724  -6.212
  485    HB2  LYS  62           2HB      LYS  62 -11.554   2.786  -5.713
  486    HB3  LYS  62           1HB      LYS  62 -13.130   3.561  -5.804
  487    HG2  LYS  62           2HG      LYS  62 -11.806   4.244  -8.175
  488    HG3  LYS  62           1HG      LYS  62 -11.483   2.530  -7.910
  489    HD2  LYS  62           2HD      LYS  62 -13.605   1.950  -8.339
  490    HD3  LYS  62           1HD      LYS  62 -14.255   3.288  -7.390
  491    HE2  LYS  62           2HE      LYS  62 -13.179   3.466 -10.203
  492    HE3  LYS  62           1HE      LYS  62 -14.882   3.474  -9.746
  493    HZ1  LYS  62           3HZ      LYS  62 -13.372   5.674 -10.079
  494    HZ2  LYS  62           1HZ      LYS  62 -13.286   5.466  -8.403
  495    HZ3  LYS  62           2HZ      LYS  62 -14.790   5.615  -9.161
  496    H    ILE  63           H        ILE  63  -9.623   5.759  -4.261
  497    HA   ILE  63           HA       ILE  63 -11.269   5.661  -1.848
  498    HB   ILE  63           HB       ILE  63  -9.296   3.830  -2.316
  499   HG12  ILE  63          2HG1      ILE  63  -9.507   4.438   0.519
  500   HG13  ILE  63          1HG1      ILE  63 -11.076   4.506  -0.277
  501   HG21  ILE  63          1HG2      ILE  63  -8.102   5.989  -0.581
  502   HG22  ILE  63          2HG2      ILE  63  -7.569   5.562  -2.207
  503   HG23  ILE  63          3HG2      ILE  63  -7.406   4.399  -0.891
  504   HD11  ILE  63          3HD1      ILE  63 -10.143   2.205  -1.294
  505   HD12  ILE  63          1HD1      ILE  63 -11.084   2.311   0.194
  506   HD13  ILE  63          2HD1      ILE  63  -9.324   2.210   0.268
  507    H    GLN  64           H        GLN  64 -11.317   7.567  -0.863
  508    HA   GLN  64           HA       GLN  64  -9.061   9.377  -1.212
  509    HB2  GLN  64           2HB      GLN  64 -11.955  10.125  -0.812
  510    HB3  GLN  64           1HB      GLN  64 -10.621  11.248  -1.033
  511    HG2  GLN  64           2HG      GLN  64 -11.220  11.229  -3.177
  512    HG3  GLN  64           1HG      GLN  64 -10.383   9.678  -3.241
  513   HE21  GLN  64          1HE2      GLN  64 -11.710   7.755  -2.788
  514   HE22  GLN  64          2HE2      GLN  64 -13.347   7.743  -3.338
  515    H    SER  65           H        SER  65 -10.728   7.513   0.967
  516    HA   SER  65           HA       SER  65  -9.941   9.219   3.239
  517    HB2  SER  65           2HB      SER  65 -11.946   6.956   3.308
  518    HB3  SER  65           1HB      SER  65 -11.659   8.178   4.546
  519    HG   SER  65           HG       SER  65 -13.091   8.342   2.179
  520    H    ILE  66           H        ILE  66  -9.000   8.223   5.062
  521    HA   ILE  66           HA       ILE  66  -7.038   6.288   4.431
  522    HB   ILE  66           HB       ILE  66  -7.507   6.604   7.280
  523   HG12  ILE  66          2HG1      ILE  66  -8.541   8.700   6.680
  524   HG13  ILE  66          1HG1      ILE  66  -6.936   9.042   7.310
  525   HG21  ILE  66          1HG2      ILE  66  -5.368   5.972   6.807
  526   HG22  ILE  66          2HG2      ILE  66  -5.139   7.719   6.880
  527   HG23  ILE  66          3HG2      ILE  66  -5.300   6.914   5.319
  528   HD11  ILE  66          3HD1      ILE  66  -6.579  10.248   5.493
  529   HD12  ILE  66          1HD1      ILE  66  -8.073   9.675   4.752
  530   HD13  ILE  66          2HD1      ILE  66  -6.585   8.747   4.567
  531    HA   PRO  67           HA       PRO  67  -9.969   3.596   7.412
  532    HB2  PRO  67           2HB      PRO  67 -12.490   4.587   6.174
  533    HB3  PRO  67           1HB      PRO  67 -12.167   4.112   7.845
  534    HG2  PRO  67           2HG      PRO  67 -12.386   6.681   7.181
  535    HG3  PRO  67           1HG      PRO  67 -11.190   6.146   8.375
  536    HD2  PRO  67           2HD      PRO  67 -10.800   6.946   5.525
  537    HD3  PRO  67           1HD      PRO  67  -9.750   7.223   6.930
  538    H    ASP  68           H        ASP  68 -11.906   4.290   4.511
  539    HA   ASP  68           HA       ASP  68 -12.230   1.679   3.682
  540    HB2  ASP  68           2HB      ASP  68 -12.679   4.298   2.573
  541    HB3  ASP  68           1HB      ASP  68 -12.056   3.223   1.325
  542    H    ALA  69           H        ALA  69  -9.400   3.532   3.685
  543    HA   ALA  69           HA       ALA  69  -8.066   2.367   1.471
  544    HB1  ALA  69           1HB      ALA  69  -6.723   4.077   1.887
  545    HB2  ALA  69           2HB      ALA  69  -6.148   3.237   3.327
  546    HB3  ALA  69           3HB      ALA  69  -7.508   4.354   3.441
  547    H    VAL  70           H        VAL  70  -6.626   2.179   4.632
  548    HA   VAL  70           HA       VAL  70  -5.569  -0.395   4.187
  549    HB   VAL  70           HB       VAL  70  -4.348   0.961   5.667
  550   HG11  VAL  70          1HG1      VAL  70  -6.853   1.938   6.438
  551   HG12  VAL  70          2HG1      VAL  70  -5.270   2.490   6.988
  552   HG13  VAL  70          3HG1      VAL  70  -6.139   1.255   7.899
  553   HG21  VAL  70          3HG2      VAL  70  -5.804  -1.076   7.351
  554   HG22  VAL  70          1HG2      VAL  70  -4.254  -0.333   7.743
  555   HG23  VAL  70          2HG2      VAL  70  -4.397  -1.384   6.336
  556    H    GLU  71           H        GLU  71  -8.642   0.601   5.267
  557    HA   GLU  71           HA       GLU  71  -9.244  -1.618   6.930
  558    HB2  GLU  71           2HB      GLU  71 -11.384  -0.740   7.115
  559    HB3  GLU  71           1HB      GLU  71 -10.412   0.689   6.794
  560    HG2  GLU  71           2HG      GLU  71 -11.086   0.683   4.484
  561    HG3  GLU  71           1HG      GLU  71 -11.958  -0.832   4.709
  562    H    TYR  72           H        TYR  72 -10.348  -0.796   3.632
  563    HA   TYR  72           HA       TYR  72 -11.625  -3.239   3.149
  564    HB2  TYR  72           2HB      TYR  72 -12.122  -2.371   1.122
  565    HB3  TYR  72           1HB      TYR  72 -11.454  -0.890   1.801
  566    HD1  TYR  72           1HD      TYR  72  -8.989  -0.401   1.381
  567    HD2  TYR  72           2HD      TYR  72 -11.158  -3.354  -0.774
  568    HE1  TYR  72           1HE      TYR  72  -7.286  -0.345  -0.391
  569    HE2  TYR  72           2HE      TYR  72  -9.465  -3.307  -2.557
  570    HH   TYR  72           HH       TYR  72  -7.732  -1.522  -3.403
  571    H    ILE  73           H        ILE  73  -8.384  -2.161   2.248
  572    HA   ILE  73           HA       ILE  73  -7.596  -4.518   0.953
  573    HB   ILE  73           HB       ILE  73  -5.219  -3.736   1.682
  574   HG12  ILE  73          2HG1      ILE  73  -6.985  -1.704   2.872
  575   HG13  ILE  73          1HG1      ILE  73  -5.328  -2.134   3.272
  576   HG21  ILE  73          1HG2      ILE  73  -5.188  -3.013  -0.411
  577   HG22  ILE  73          2HG2      ILE  73  -6.139  -1.594   0.022
  578   HG23  ILE  73          3HG2      ILE  73  -6.950  -3.092  -0.430
  579   HD11  ILE  73          3HD1      ILE  73  -5.544   0.176   2.493
  580   HD12  ILE  73          1HD1      ILE  73  -6.148  -0.417   0.945
  581   HD13  ILE  73          2HD1      ILE  73  -4.500  -0.790   1.449
  582    H    ALA  74           H        ALA  74  -7.277  -3.499   4.302
  583    HA   ALA  74           HA       ALA  74  -5.740  -5.587   5.284
  584    HB1  ALA  74           1HB      ALA  74  -7.940  -4.073   6.680
  585    HB2  ALA  74           2HB      ALA  74  -6.235  -3.628   6.617
  586    HB3  ALA  74           3HB      ALA  74  -6.736  -5.083   7.480
  587    H    GLN  75           H        GLN  75  -9.191  -5.414   4.719
  588    HA   GLN  75           HA       GLN  75  -9.717  -7.985   5.855
  589    HB2  GLN  75           2HB      GLN  75 -11.534  -6.398   4.049
  590    HB3  GLN  75           1HB      GLN  75 -11.992  -7.638   5.209
  591    HG2  GLN  75           2HG      GLN  75 -11.341  -4.790   5.627
  592    HG3  GLN  75           1HG      GLN  75 -12.531  -5.816   6.428
  593   HE21  GLN  75          1HE2      GLN  75 -10.440  -3.946   7.448
  594   HE22  GLN  75          2HE2      GLN  75  -9.532  -4.875   8.586
  595    H    ASN  76           H        ASN  76  -8.595  -6.832   2.866
  596    HA   ASN  76           HA       ASN  76  -9.660  -8.778   1.128
  597    HB2  ASN  76           2HB      ASN  76  -7.567  -6.729   1.021
  598    HB3  ASN  76           1HB      ASN  76  -7.221  -8.139   0.024
  599   HD21  ASN  76          1HD2      ASN  76  -9.109  -5.324   0.413
  600   HD22  ASN  76          2HD2      ASN  76 -10.023  -5.453  -1.047
  601    HA   PRO  77           HA       PRO  77  -5.604 -11.321   1.690
  602    HB2  PRO  77           2HB      PRO  77  -4.165  -9.955   3.867
  603    HB3  PRO  77           1HB      PRO  77  -3.563 -10.517   2.305
  604    HG2  PRO  77           2HG      PRO  77  -3.874  -7.905   2.839
  605    HG3  PRO  77           1HG      PRO  77  -4.165  -8.572   1.221
  606    HD2  PRO  77           2HD      PRO  77  -6.139  -7.803   3.339
  607    HD3  PRO  77           1HD      PRO  77  -6.209  -7.547   1.583
  608    H    MET  78           H        MET  78  -6.828  -9.723   4.606
  609    HA   MET  78           HA       MET  78  -6.441 -11.940   6.331
  610    HB2  MET  78           2HB      MET  78  -6.728 -10.092   7.621
  611    HB3  MET  78           1HB      MET  78  -7.805  -9.324   6.465
  612    HG2  MET  78           2HG      MET  78  -9.675 -10.286   7.349
  613    HG3  MET  78           1HG      MET  78  -8.800 -11.686   7.964
  614    HE1  MET  78           3HE      MET  78 -10.614 -10.302  10.825
  615    HE2  MET  78           1HE      MET  78  -9.289 -11.412  11.175
  616    HE3  MET  78           2HE      MET  78 -10.263 -11.634   9.722
  617    H    ALA  79           H        ALA  79  -8.745 -11.221   3.925
  618    HA   ALA  79           HA       ALA  79 -10.788 -12.949   4.981
  619    HB1  ALA  79           1HB      ALA  79 -10.570 -11.068   2.719
  620    HB2  ALA  79           2HB      ALA  79 -11.879 -11.301   3.879
  621    HB3  ALA  79           3HB      ALA  79 -11.686 -12.420   2.529
  622    H    LYS  80           H        LYS  80  -9.649 -12.874   1.670
  623    HA   LYS  80           HA       LYS  80 -10.089 -15.468   0.991
  624    HB2  LYS  80           2HB      LYS  80  -7.989 -15.143  -0.541
  625    HB3  LYS  80           1HB      LYS  80  -9.428 -14.166  -0.797
  626    HG2  LYS  80           2HG      LYS  80  -7.985 -12.457  -0.796
  627    HG3  LYS  80           1HG      LYS  80  -8.067 -12.619   0.960
  628    HD2  LYS  80           2HD      LYS  80  -5.837 -12.831   0.854
  629    HD3  LYS  80           1HD      LYS  80  -6.168 -14.473   0.300
  630    HE2  LYS  80           2HE      LYS  80  -4.572 -13.312  -1.160
  631    HE3  LYS  80           1HE      LYS  80  -6.055 -13.744  -2.011
  632    HZ1  LYS  80           3HZ      LYS  80  -5.791 -11.075  -0.798
  633    HZ2  LYS  80           1HZ      LYS  80  -6.734 -11.563  -2.117
  634    HZ3  LYS  80           2HZ      LYS  80  -5.060 -11.391  -2.290
  635   H282  PNS 101          8H2       PNS 101   4.642  11.880 -10.195
  636   H281  PNS 101          9H2       PNS 101   3.920  11.738  -8.590
  637   H303  PNS 101          0H3       PNS 101   3.260  15.436  -8.815
  638   H302  PNS 101          1H3       PNS 101   3.726  14.582  -7.344
  639   H301  PNS 101          2H3       PNS 101   2.486  13.907  -8.400
  640   H313  PNS 101          3H3       PNS 101   5.438  13.592  -7.248
  641   H312  PNS 101          4H3       PNS 101   6.365  14.436  -8.489
  642   H311  PNS 101          5H3       PNS 101   6.225  12.677  -8.535
  643    H32  PNS 101           6H3      PNS 101   4.877  13.636 -11.089
  644    H33  PNS 101           7H3      PNS 101   3.684  16.058 -10.763
  645    H36  PNS 101           8H3      PNS 101   5.459  16.667  -9.725
  646   H372  PNS 101          9H3       PNS 101   8.329  16.102  -9.655
  647   H371  PNS 101          0H4       PNS 101   7.478  17.333  -8.723
  648   H382  PNS 101          1H4       PNS 101   7.029  18.404 -11.048
  649   H381  PNS 101          2H4       PNS 101   8.600  18.610 -10.275
  650    H41  PNS 101           3H4      PNS 101   8.110  15.365 -11.830
  651   H422  PNS 101          4H4       PNS 101   7.524  16.353 -14.346
  652   H421  PNS 101          5H4       PNS 101   6.539  15.189 -13.461
  653   H431  PNS 101          7H4       PNS 101   5.287  16.958 -12.415
  654   H432  PNS 101          6H4       PNS 101   6.355  18.181 -13.117
  655    H44  PNS 101           8H4      PNS 101   4.474  16.414 -14.870
  Start of MODEL   18
    1    H1   MET   1           1HT      MET   1  -6.266  -7.061   8.657
    2    H2   MET   1           2HT      MET   1  -5.639  -8.649   8.471
    3    H3   MET   1           3HT      MET   1  -4.597  -7.292   8.345
    4    HA   MET   1           HA       MET   1  -6.120  -7.667  10.787
    5    HB2  MET   1           2HB      MET   1  -4.328  -9.148  11.638
    6    HB3  MET   1           1HB      MET   1  -5.248  -9.885  10.335
    7    HG2  MET   1           2HG      MET   1  -3.272  -8.793   8.904
    8    HG3  MET   1           1HG      MET   1  -2.423  -9.044  10.427
    9    HE1  MET   1           2HE      MET   1  -3.540 -11.393  11.714
   10    HE2  MET   1           3HE      MET   1  -1.817 -11.594  11.392
   11    HE3  MET   1           1HE      MET   1  -2.947 -12.885  10.984
   12    H    ASN   2           H        ASN   2  -3.696  -7.666  12.316
   13    HA   ASN   2           HA       ASN   2  -3.177  -4.872  12.341
   14    HB2  ASN   2           2HB      ASN   2  -1.247  -5.922  13.962
   15    HB3  ASN   2           1HB      ASN   2  -2.885  -5.531  14.477
   16   HD21  ASN   2          1HD2      ASN   2  -0.615  -8.016  13.833
   17   HD22  ASN   2          2HD2      ASN   2  -1.600  -9.350  14.316
   18    H    ASP   3           H        ASP   3  -1.537  -7.659  11.072
   19    HA   ASP   3           HA       ASP   3   1.029  -6.706  10.742
   20    HB2  ASP   3           2HB      ASP   3  -0.572  -8.843   9.638
   21    HB3  ASP   3           1HB      ASP   3   0.502  -8.171   8.415
   22    H    VAL   4           H        VAL   4  -1.807  -6.081   8.784
   23    HA   VAL   4           HA       VAL   4  -0.437  -4.786   6.663
   24    HB   VAL   4           HB       VAL   4  -2.738  -3.813   6.151
   25   HG11  VAL   4          1HG1      VAL   4  -1.672  -5.985   5.278
   26   HG12  VAL   4          2HG1      VAL   4  -3.413  -5.772   5.086
   27   HG13  VAL   4          3HG1      VAL   4  -2.787  -6.801   6.373
   28   HG21  VAL   4          3HG2      VAL   4  -4.629  -4.633   7.313
   29   HG22  VAL   4          1HG2      VAL   4  -3.510  -4.050   8.543
   30   HG23  VAL   4          2HG2      VAL   4  -3.656  -5.781   8.233
   31    H    LEU   5           H        LEU   5  -2.196  -3.546   9.491
   32    HA   LEU   5           HA       LEU   5  -1.774  -0.825   8.911
   33    HB2  LEU   5           2HB      LEU   5  -2.162  -1.909  11.656
   34    HB3  LEU   5           1HB      LEU   5  -2.655  -0.352  11.032
   35    HG   LEU   5           HG       LEU   5  -4.689  -1.338  11.001
   36   HD11  LEU   5          1HD1      LEU   5  -3.317  -1.844   8.468
   37   HD12  LEU   5          2HD1      LEU   5  -4.875  -1.082   8.788
   38   HD13  LEU   5          3HD1      LEU   5  -4.750  -2.839   8.728
   39   HD21  LEU   5          3HD2      LEU   5  -3.185  -3.925  10.846
   40   HD22  LEU   5          1HD2      LEU   5  -4.927  -3.861  10.578
   41   HD23  LEU   5          2HD2      LEU   5  -4.252  -3.332  12.119
   42    H    THR   6           H        THR   6   0.059  -3.200  10.669
   43    HA   THR   6           HA       THR   6   1.808  -1.526  12.037
   44    HB   THR   6           HB       THR   6   1.518  -4.277  11.669
   45    HG1  THR   6           1HG      THR   6   3.564  -2.974  13.127
   46   HG21  THR   6          3HG2      THR   6   4.045  -4.821  11.543
   47   HG22  THR   6          1HG2      THR   6   4.137  -3.315  10.629
   48   HG23  THR   6          2HG2      THR   6   3.116  -4.634  10.057
   49    H    ARG   7           H        ARG   7   2.373  -3.170   8.952
   50    HA   ARG   7           HA       ARG   7   4.749  -1.685   8.435
   51    HB2  ARG   7           2HB      ARG   7   4.158  -4.082   7.668
   52    HB3  ARG   7           1HB      ARG   7   3.267  -3.288   6.376
   53    HG2  ARG   7           2HG      ARG   7   6.129  -2.593   6.877
   54    HG3  ARG   7           1HG      ARG   7   5.704  -4.045   5.969
   55    HD2  ARG   7           2HD      ARG   7   4.648  -2.809   4.276
   56    HD3  ARG   7           1HD      ARG   7   4.566  -1.355   5.272
   57    HE   ARG   7           HE       ARG   7   7.143  -1.499   5.071
   58   HH11  ARG   7          1HH1      ARG   7   4.836  -2.339   2.601
   59   HH12  ARG   7          2HH1      ARG   7   5.901  -1.953   1.291
   60   HH21  ARG   7          1HH2      ARG   7   8.554  -0.986   3.354
   61   HH22  ARG   7          2HH2      ARG   7   8.017  -1.184   1.719
   62    H    VAL   8           H        VAL   8   1.470  -1.728   7.112
   63    HA   VAL   8           HA       VAL   8   1.849   0.187   5.123
   64    HB   VAL   8           HB       VAL   8  -0.248  -1.357   5.844
   65   HG11  VAL   8          1HG1      VAL   8  -0.872   0.058   7.716
   66   HG12  VAL   8          2HG1      VAL   8  -2.113   0.116   6.464
   67   HG13  VAL   8          3HG1      VAL   8  -0.982   1.456   6.646
   68   HG21  VAL   8          3HG2      VAL   8  -1.004   1.031   4.286
   69   HG22  VAL   8          1HG2      VAL   8  -1.136  -0.682   3.882
   70   HG23  VAL   8          2HG2      VAL   8   0.412   0.147   3.715
   71    H    LEU   9           H        LEU   9   0.619   0.589   8.441
   72    HA   LEU   9           HA       LEU   9   0.246   3.367   8.322
   73    HB2  LEU   9           2HB      LEU   9  -0.333   3.201  10.491
   74    HB3  LEU   9           1HB      LEU   9  -0.268   1.481  10.178
   75    HG   LEU   9           HG       LEU   9   2.278   1.847  10.903
   76   HD11  LEU   9          1HD1      LEU   9   1.729   4.329  11.211
   77   HD12  LEU   9          2HD1      LEU   9   2.603   3.510  12.505
   78   HD13  LEU   9          3HD1      LEU   9   0.875   3.821  12.668
   79   HD21  LEU   9          3HD2      LEU   9   1.579   1.201  13.194
   80   HD22  LEU   9          1HD2      LEU   9   0.812   0.250  11.924
   81   HD23  LEU   9          2HD2      LEU   9  -0.092   1.528  12.735
   82    H    GLU  10           H        GLU  10   3.062   1.468   9.349
   83    HA   GLU  10           HA       GLU  10   4.650   3.663  10.111
   84    HB2  GLU  10           2HB      GLU  10   6.470   2.136  10.220
   85    HB3  GLU  10           1HB      GLU  10   5.037   1.249  10.724
   86    HG2  GLU  10           2HG      GLU  10   5.358  -0.258   9.142
   87    HG3  GLU  10           1HG      GLU  10   5.376   0.990   7.897
   88    H    VAL  11           H        VAL  11   4.100   2.063   7.077
   89    HA   VAL  11           HA       VAL  11   6.234   3.039   5.605
   90    HB   VAL  11           HB       VAL  11   3.605   1.948   4.973
   91   HG11  VAL  11          1HG1      VAL  11   3.726   4.035   3.603
   92   HG12  VAL  11          2HG1      VAL  11   3.602   2.546   2.667
   93   HG13  VAL  11          3HG1      VAL  11   5.158   3.363   2.824
   94   HG21  VAL  11          3HG2      VAL  11   5.356   0.899   3.203
   95   HG22  VAL  11          1HG2      VAL  11   5.077   0.260   4.823
   96   HG23  VAL  11          2HG2      VAL  11   6.436   1.343   4.524
   97    H    VAL  12           H        VAL  12   2.977   4.372   5.873
   98    HA   VAL  12           HA       VAL  12   3.538   6.686   4.324
   99    HB   VAL  12           HB       VAL  12   1.392   7.563   5.321
  100   HG11  VAL  12          1HG1      VAL  12  -0.018   5.802   4.201
  101   HG12  VAL  12          2HG1      VAL  12   1.466   4.876   3.966
  102   HG13  VAL  12          3HG1      VAL  12   1.291   6.465   3.220
  103   HG21  VAL  12          3HG2      VAL  12   1.409   6.461   7.451
  104   HG22  VAL  12          1HG2      VAL  12   1.449   4.874   6.684
  105   HG23  VAL  12          2HG2      VAL  12   0.012   5.885   6.543
  106    H    LYS  13           H        LYS  13   3.104   6.228   7.837
  107    HA   LYS  13           HA       LYS  13   3.566   8.836   8.638
  108    HB2  LYS  13           2HB      LYS  13   3.639   8.025  10.772
  109    HB3  LYS  13           1HB      LYS  13   2.946   6.624   9.967
  110    HG2  LYS  13           2HG      LYS  13   4.912   5.416  10.080
  111    HG3  LYS  13           1HG      LYS  13   5.909   6.865  10.284
  112    HD2  LYS  13           2HD      LYS  13   4.135   5.508  12.299
  113    HD3  LYS  13           1HD      LYS  13   5.867   5.834  12.401
  114    HE2  LYS  13           2HE      LYS  13   4.767   8.338  12.058
  115    HE3  LYS  13           1HE      LYS  13   3.600   7.523  13.099
  116    HZ1  LYS  13           3HZ      LYS  13   5.225   8.590  14.458
  117    HZ2  LYS  13           1HZ      LYS  13   6.503   7.876  13.609
  118    HZ3  LYS  13           2HZ      LYS  13   5.484   6.922  14.565
  119    H    ASN  14           H        ASN  14   5.949   6.216   8.253
  120    HA   ASN  14           HA       ASN  14   8.125   8.018   8.768
  121    HB2  ASN  14           2HB      ASN  14   8.367   5.201   7.731
  122    HB3  ASN  14           1HB      ASN  14   9.549   6.125   8.653
  123   HD21  ASN  14          1HD2      ASN  14   7.331   3.724   8.830
  124   HD22  ASN  14          2HD2      ASN  14   7.007   3.747  10.526
  125    H    PHE  15           H        PHE  15   6.209   7.482   6.159
  126    HA   PHE  15           HA       PHE  15   8.080   7.351   4.045
  127    HB2  PHE  15           2HB      PHE  15   5.258   7.394   4.311
  128    HB3  PHE  15           1HB      PHE  15   5.696   8.699   3.213
  129    HD1  PHE  15           2HD      PHE  15   7.279   5.370   3.694
  130    HD2  PHE  15           1HD      PHE  15   5.098   7.951   1.107
  131    HE1  PHE  15           2HE      PHE  15   7.529   3.742   1.867
  132    HE2  PHE  15           1HE      PHE  15   5.344   6.327  -0.726
  133    HZ   PHE  15           HZ       PHE  15   6.561   4.219  -0.347
  134    H    GLU  16           H        GLU  16   6.889   9.895   6.025
  135    HA   GLU  16           HA       GLU  16   8.150  11.913   6.255
  136    HB2  GLU  16           2HB      GLU  16   9.397  12.831   4.522
  137    HB3  GLU  16           1HB      GLU  16   9.537  11.108   4.214
  138    HG2  GLU  16           2HG      GLU  16   8.751  11.412   2.178
  139    HG3  GLU  16           1HG      GLU  16   7.247  12.033   2.852
  140    H    LYS  17           H        LYS  17   5.444  10.926   4.596
  141    HA   LYS  17           HA       LYS  17   4.421  13.345   3.588
  142    HB2  LYS  17           2HB      LYS  17   3.456  10.643   4.041
  143    HB3  LYS  17           1HB      LYS  17   2.213  11.842   4.375
  144    HG2  LYS  17           2HG      LYS  17   1.914  11.324   2.130
  145    HG3  LYS  17           1HG      LYS  17   2.822  12.837   2.099
  146    HD2  LYS  17           2HD      LYS  17   4.381  10.315   2.105
  147    HD3  LYS  17           1HD      LYS  17   3.504  10.717   0.627
  148    HE2  LYS  17           2HE      LYS  17   5.441  12.543   2.047
  149    HE3  LYS  17           1HE      LYS  17   5.828  11.561   0.634
  150    HZ1  LYS  17           3HZ      LYS  17   3.512  13.301   0.391
  151    HZ2  LYS  17           1HZ      LYS  17   4.721  12.939  -0.738
  152    HZ3  LYS  17           2HZ      LYS  17   5.012  14.077   0.478
  153    H    VAL  18           H        VAL  18   3.895  11.702   6.703
  154    HA   VAL  18           HA       VAL  18   3.852  13.999   8.256
  155    HB   VAL  18           HB       VAL  18   1.115  13.520   8.564
  156   HG11  VAL  18          1HG1      VAL  18   1.925  15.660   8.970
  157   HG12  VAL  18          2HG1      VAL  18   0.997  15.860   7.484
  158   HG13  VAL  18          3HG1      VAL  18   2.755  15.747   7.417
  159   HG21  VAL  18          3HG2      VAL  18   0.089  13.460   6.529
  160   HG22  VAL  18          1HG2      VAL  18   1.543  12.542   6.136
  161   HG23  VAL  18          2HG2      VAL  18   1.433  14.248   5.703
  162    H    ASP  19           H        ASP  19   2.860  13.619  10.448
  163    HA   ASP  19           HA       ASP  19   3.666  11.100  11.426
  164    HB2  ASP  19           2HB      ASP  19   2.103  13.348  12.699
  165    HB3  ASP  19           1HB      ASP  19   2.604  11.906  13.577
  166    H    ALA  20           H        ALA  20   2.605   9.234  11.487
  167    HA   ALA  20           HA       ALA  20   0.059   8.856  10.414
  168    HB1  ALA  20           1HB      ALA  20   0.658   6.774  12.290
  169    HB2  ALA  20           2HB      ALA  20   2.118   7.229  11.410
  170    HB3  ALA  20           3HB      ALA  20   0.676   6.728  10.527
  171    H    SER  21           H        SER  21   0.987   9.949  13.514
  172    HA   SER  21           HA       SER  21  -1.227   9.059  15.021
  173    HB2  SER  21           2HB      SER  21   0.406   9.774  16.452
  174    HB3  SER  21           1HB      SER  21   0.929  11.068  15.373
  175    HG   SER  21           HG       SER  21  -0.953  12.225  15.997
  176    H    LYS  22           H        LYS  22  -0.856  11.528  12.683
  177    HA   LYS  22           HA       LYS  22  -3.086  13.112  13.567
  178    HB2  LYS  22           2HB      LYS  22  -2.637  14.526  11.726
  179    HB3  LYS  22           1HB      LYS  22  -1.065  13.996  12.308
  180    HG2  LYS  22           2HG      LYS  22  -1.215  12.181  10.515
  181    HG3  LYS  22           1HG      LYS  22  -2.536  13.138   9.842
  182    HD2  LYS  22           2HD      LYS  22   0.364  13.839  10.110
  183    HD3  LYS  22           1HD      LYS  22  -0.673  13.912   8.683
  184    HE2  LYS  22           2HE      LYS  22  -1.798  15.615  10.644
  185    HE3  LYS  22           1HE      LYS  22  -0.072  15.965  10.568
  186    HZ1  LYS  22           3HZ      LYS  22  -1.768  17.119   8.960
  187    HZ2  LYS  22           1HZ      LYS  22  -1.541  15.712   8.049
  188    HZ3  LYS  22           2HZ      LYS  22  -0.220  16.694   8.431
  189    H    VAL  23           H        VAL  23  -2.666  10.285  11.738
  190    HA   VAL  23           HA       VAL  23  -4.992  10.608  10.083
  191    HB   VAL  23           HB       VAL  23  -4.394   8.684   9.027
  192   HG11  VAL  23          1HG1      VAL  23  -2.176   8.833   8.580
  193   HG12  VAL  23          2HG1      VAL  23  -1.718   8.818  10.283
  194   HG13  VAL  23          3HG1      VAL  23  -2.332  10.299   9.548
  195   HG21  VAL  23          3HG2      VAL  23  -4.853   7.212  10.905
  196   HG22  VAL  23          1HG2      VAL  23  -3.305   7.633  11.637
  197   HG23  VAL  23          2HG2      VAL  23  -3.347   6.744  10.114
  198    H    THR  24           H        THR  24  -7.017  10.167  10.645
  199    HA   THR  24           HA       THR  24  -7.485   8.508  12.994
  200    HB   THR  24           HB       THR  24  -8.253  10.658  13.551
  201    HG1  THR  24           1HG      THR  24 -10.309   8.972  12.662
  202   HG21  THR  24          3HG2      THR  24  -9.547  12.104  12.206
  203   HG22  THR  24          1HG2      THR  24  -9.780  10.861  10.976
  204   HG23  THR  24          2HG2      THR  24  -8.184  11.569  11.223
  205    HA   PRO  25           HA       PRO  25  -9.767   5.496  10.771
  206    HB2  PRO  25           2HB      PRO  25 -12.071   5.977  12.589
  207    HB3  PRO  25           1HB      PRO  25 -11.218   4.474  12.227
  208    HG2  PRO  25           2HG      PRO  25 -10.837   5.724  14.546
  209    HG3  PRO  25           1HG      PRO  25  -9.487   4.947  13.698
  210    HD2  PRO  25           2HD      PRO  25 -10.187   7.844  13.896
  211    HD3  PRO  25           1HD      PRO  25  -8.590   7.066  13.895
  212    H    GLU  26           H        GLU  26 -11.589   8.430  11.567
  213    HA   GLU  26           HA       GLU  26 -13.252   8.036   9.207
  214    HB2  GLU  26           2HB      GLU  26 -14.883   9.217  10.239
  215    HB3  GLU  26           1HB      GLU  26 -13.985   8.787  11.688
  216    HG2  GLU  26           2HG      GLU  26 -14.017  10.975  12.111
  217    HG3  GLU  26           1HG      GLU  26 -12.715  11.065  10.925
  218    H    SER  27           H        SER  27 -10.379   9.405   9.895
  219    HA   SER  27           HA       SER  27 -10.574  11.970   8.737
  220    HB2  SER  27           2HB      SER  27  -8.520  12.058   9.618
  221    HB3  SER  27           1HB      SER  27  -8.511  10.309   9.843
  222    HG   SER  27           HG       SER  27  -7.112  11.739   8.108
  223    H    HIS  28           H        HIS  28 -10.116  12.706   6.684
  224    HA   HIS  28           HA       HIS  28 -10.622  10.857   4.560
  225    HB2  HIS  28           2HB      HIS  28 -10.525  13.785   4.876
  226    HB3  HIS  28           1HB      HIS  28 -10.034  13.190   3.294
  227    HD1  HIS  28           1HD      HIS  28 -11.885  11.465   2.185
  228    HD2  HIS  28           2HD      HIS  28 -13.202  14.081   5.132
  229    HE1  HIS  28           1HE      HIS  28 -14.384  11.569   1.923
  230    HE2  HIS  28           2HE      HIS  28 -15.151  13.220   3.665
  231    H    PHE  29           H        PHE  29  -9.243  10.416   2.793
  232    HA   PHE  29           HA       PHE  29  -6.528  10.068   3.480
  233    HB2  PHE  29           2HB      PHE  29  -8.065   8.767   1.790
  234    HB3  PHE  29           1HB      PHE  29  -7.437   9.939   0.637
  235    HD1  PHE  29           2HD      PHE  29  -4.669  10.260   1.541
  236    HD2  PHE  29           1HD      PHE  29  -7.069   6.759   1.224
  237    HE1  PHE  29           2HE      PHE  29  -2.639   8.898   1.261
  238    HE2  PHE  29           1HE      PHE  29  -5.042   5.391   0.946
  239    HZ   PHE  29           HZ       PHE  29  -2.824   6.461   0.964
  240    H    VAL  30           H        VAL  30  -7.412  11.544   0.428
  241    HA   VAL  30           HA       VAL  30  -5.147  13.176   0.308
  242    HB   VAL  30           HB       VAL  30  -6.249  14.336  -1.557
  243   HG11  VAL  30          1HG1      VAL  30  -5.506  12.599  -2.723
  244   HG12  VAL  30          2HG1      VAL  30  -7.069  11.815  -2.492
  245   HG13  VAL  30          3HG1      VAL  30  -5.758  11.521  -1.350
  246   HG21  VAL  30          3HG2      VAL  30  -8.661  12.657  -0.878
  247   HG22  VAL  30          1HG2      VAL  30  -8.505  13.787  -2.223
  248   HG23  VAL  30          2HG2      VAL  30  -8.513  14.386  -0.564
  249    H    LYS  31           H        LYS  31  -8.306  13.731   1.618
  250    HA   LYS  31           HA       LYS  31  -8.111  16.545   1.859
  251    HB2  LYS  31           2HB      LYS  31  -9.794  14.920   3.719
  252    HB3  LYS  31           1HB      LYS  31 -10.150  16.464   2.956
  253    HG2  LYS  31           2HG      LYS  31 -10.343  15.278   0.781
  254    HG3  LYS  31           1HG      LYS  31 -10.151  13.754   1.649
  255    HD2  LYS  31           2HD      LYS  31 -12.406  13.818   1.722
  256    HD3  LYS  31           1HD      LYS  31 -12.125  14.890   3.095
  257    HE2  LYS  31           2HE      LYS  31 -12.743  16.754   1.945
  258    HE3  LYS  31           1HE      LYS  31 -12.172  16.122   0.401
  259    HZ1  LYS  31           3HZ      LYS  31 -14.165  14.478   0.777
  260    HZ2  LYS  31           1HZ      LYS  31 -14.407  16.003   0.084
  261    HZ3  LYS  31           2HZ      LYS  31 -14.758  15.751   1.720
  262    H    ASP  32           H        ASP  32  -7.206  13.863   3.929
  263    HA   ASP  32           HA       ASP  32  -6.552  15.596   6.131
  264    HB2  ASP  32           2HB      ASP  32  -7.520  13.286   6.423
  265    HB3  ASP  32           1HB      ASP  32  -5.971  12.647   5.880
  266    H    LEU  33           H        LEU  33  -5.115  15.313   3.350
  267    HA   LEU  33           HA       LEU  33  -2.977  16.223   2.923
  268    HB2  LEU  33           2HB      LEU  33  -2.130  14.820   5.460
  269    HB3  LEU  33           1HB      LEU  33  -1.123  15.853   4.466
  270    HG   LEU  33           HG       LEU  33  -3.317  16.602   6.346
  271   HD11  LEU  33          1HD1      LEU  33  -0.830  18.153   5.817
  272   HD12  LEU  33          2HD1      LEU  33  -0.724  16.638   6.714
  273   HD13  LEU  33          3HD1      LEU  33  -1.737  17.950   7.316
  274   HD21  LEU  33          3HD2      LEU  33  -4.220  17.973   4.830
  275   HD22  LEU  33          1HD2      LEU  33  -2.867  17.780   3.715
  276   HD23  LEU  33          2HD2      LEU  33  -2.762  18.943   5.036
  277    H    GLY  34           H        GLY  34  -4.214  13.993   1.858
  278    HA2  GLY  34           2HA      GLY  34  -2.941  11.562   1.927
  279    HA3  GLY  34           1HA      GLY  34  -3.676  12.233   0.479
  280    H    LEU  35           H        LEU  35  -1.348  10.556   0.624
  281    HA   LEU  35           HA       LEU  35   1.033  12.049   0.362
  282    HB2  LEU  35           2HB      LEU  35   0.330   9.336  -0.758
  283    HB3  LEU  35           1HB      LEU  35   1.948  10.007  -0.679
  284    HG   LEU  35           HG       LEU  35   2.168   9.598   1.550
  285   HD11  LEU  35          1HD1      LEU  35   0.474   9.744   3.192
  286   HD12  LEU  35          2HD1      LEU  35  -0.807   9.620   1.987
  287   HD13  LEU  35          3HD1      LEU  35   0.187  11.073   2.070
  288   HD21  LEU  35          3HD2      LEU  35   0.864   7.557   0.130
  289   HD22  LEU  35          1HD2      LEU  35   0.136   7.588   1.735
  290   HD23  LEU  35          2HD2      LEU  35   1.881   7.398   1.563
  291    H    ASN  36           H        ASN  36   2.276  12.428  -1.571
  292    HA   ASN  36           HA       ASN  36   0.788  13.671  -3.615
  293    HB2  ASN  36           2HB      ASN  36   3.208  14.134  -2.841
  294    HB3  ASN  36           1HB      ASN  36   3.658  12.825  -3.928
  295   HD21  ASN  36          1HD2      ASN  36   3.645  13.152  -6.086
  296   HD22  ASN  36          2HD2      ASN  36   3.345  14.683  -6.829
  297    H    SER  37           H        SER  37   1.581  13.112  -6.025
  298    HA   SER  37           HA       SER  37   0.264  10.730  -6.719
  299    HB2  SER  37           2HB      SER  37   2.014  11.511  -8.834
  300    HB3  SER  37           1HB      SER  37   0.268  11.732  -8.720
  301    H    LEU  38           H        LEU  38   3.681  11.540  -7.136
  302    HA   LEU  38           HA       LEU  38   4.582   9.006  -7.820
  303    HB2  LEU  38           2HB      LEU  38   6.752   9.799  -7.492
  304    HB3  LEU  38           1HB      LEU  38   5.828  11.233  -7.898
  305    HG   LEU  38           HG       LEU  38   7.402  11.687  -6.094
  306   HD11  LEU  38          1HD1      LEU  38   4.473  11.792  -5.528
  307   HD12  LEU  38          2HD1      LEU  38   5.584  13.099  -5.933
  308   HD13  LEU  38          3HD1      LEU  38   5.630  12.368  -4.329
  309   HD21  LEU  38          3HD2      LEU  38   6.825   9.149  -5.229
  310   HD22  LEU  38          1HD2      LEU  38   6.000  10.163  -4.044
  311   HD23  LEU  38          2HD2      LEU  38   7.729  10.364  -4.325
  312    H    ASP  39           H        ASP  39   3.786  10.341  -4.729
  313    HA   ASP  39           HA       ASP  39   5.100   8.321  -3.185
  314    HB2  ASP  39           2HB      ASP  39   4.646  10.573  -2.278
  315    HB3  ASP  39           1HB      ASP  39   2.918  10.245  -2.363
  316    H    VAL  40           H        VAL  40   1.690   9.064  -2.862
  317    HA   VAL  40           HA       VAL  40   0.647   6.816  -1.967
  318    HB   VAL  40           HB       VAL  40  -0.458   8.948  -3.275
  319   HG11  VAL  40          1HG1      VAL  40  -0.150   7.270  -5.335
  320   HG12  VAL  40          2HG1      VAL  40  -1.502   8.395  -5.209
  321   HG13  VAL  40          3HG1      VAL  40  -1.713   6.708  -4.742
  322   HG21  VAL  40          3HG2      VAL  40  -1.911   8.331  -1.703
  323   HG22  VAL  40          1HG2      VAL  40  -1.353   6.657  -1.749
  324   HG23  VAL  40          2HG2      VAL  40  -2.586   7.208  -2.884
  325    H    VAL  41           H        VAL  41   1.931   7.164  -5.208
  326    HA   VAL  41           HA       VAL  41   0.962   4.675  -6.178
  327    HB   VAL  41           HB       VAL  41   1.487   6.261  -7.841
  328   HG11  VAL  41          1HG1      VAL  41   3.471   7.102  -6.102
  329   HG12  VAL  41          2HG1      VAL  41   3.137   7.755  -7.705
  330   HG13  VAL  41          3HG1      VAL  41   4.355   6.497  -7.502
  331   HG21  VAL  41          3HG2      VAL  41   3.837   4.958  -8.636
  332   HG22  VAL  41          1HG2      VAL  41   2.182   4.577  -9.111
  333   HG23  VAL  41          2HG2      VAL  41   2.909   3.770  -7.722
  334    H    GLU  42           H        GLU  42   4.084   5.763  -4.882
  335    HA   GLU  42           HA       GLU  42   5.366   3.258  -5.191
  336    HB2  GLU  42           2HB      GLU  42   7.211   4.321  -4.446
  337    HB3  GLU  42           1HB      GLU  42   6.233   5.770  -4.637
  338    HG2  GLU  42           2HG      GLU  42   5.800   5.928  -2.360
  339    HG3  GLU  42           1HG      GLU  42   6.234   4.246  -2.064
  340    H    VAL  43           H        VAL  43   3.766   4.844  -2.507
  341    HA   VAL  43           HA       VAL  43   4.273   2.832  -0.588
  342    HB   VAL  43           HB       VAL  43   3.604   4.576   0.647
  343   HG11  VAL  43          1HG1      VAL  43   1.960   6.315  -0.355
  344   HG12  VAL  43          2HG1      VAL  43   2.307   5.498  -1.877
  345   HG13  VAL  43          3HG1      VAL  43   3.615   6.241  -0.956
  346   HG21  VAL  43          3HG2      VAL  43   1.781   3.016   1.049
  347   HG22  VAL  43          1HG2      VAL  43   0.876   3.755  -0.266
  348   HG23  VAL  43          2HG2      VAL  43   1.235   4.689   1.180
  349    H    VAL  44           H        VAL  44   1.443   3.623  -2.525
  350    HA   VAL  44           HA       VAL  44  -0.247   1.570  -1.672
  351    HB   VAL  44           HB       VAL  44  -0.925   3.508  -3.106
  352   HG11  VAL  44          1HG1      VAL  44  -0.285   3.765  -5.259
  353   HG12  VAL  44          2HG1      VAL  44  -0.182   2.030  -5.552
  354   HG13  VAL  44          3HG1      VAL  44   1.118   2.859  -4.696
  355   HG21  VAL  44          3HG2      VAL  44  -1.818   0.793  -3.234
  356   HG22  VAL  44          1HG2      VAL  44  -2.064   1.572  -4.797
  357   HG23  VAL  44          2HG2      VAL  44  -2.760   2.280  -3.340
  358    H    PHE  45           H        PHE  45   2.294   1.665  -4.060
  359    HA   PHE  45           HA       PHE  45   1.782  -0.905  -5.170
  360    HB2  PHE  45           2HB      PHE  45   3.560   1.306  -5.636
  361    HB3  PHE  45           1HB      PHE  45   4.468  -0.203  -5.630
  362    HD1  PHE  45           1HD      PHE  45   3.935  -1.965  -7.197
  363    HD2  PHE  45           2HD      PHE  45   2.026   1.826  -7.387
  364    HE1  PHE  45           1HE      PHE  45   3.200  -2.462  -9.500
  365    HE2  PHE  45           2HE      PHE  45   1.284   1.346  -9.687
  366    HZ   PHE  45           HZ       PHE  45   1.872  -0.801 -10.746
  367    H    ALA  46           H        ALA  46   3.726   0.367  -2.611
  368    HA   ALA  46           HA       ALA  46   5.443  -1.801  -2.186
  369    HB1  ALA  46           1HB      ALA  46   4.650  -0.342   0.222
  370    HB2  ALA  46           2HB      ALA  46   5.196   0.677  -1.109
  371    HB3  ALA  46           3HB      ALA  46   6.249  -0.590  -0.480
  372    H    ILE  47           H        ILE  47   2.374  -0.986  -0.641
  373    HA   ILE  47           HA       ILE  47   2.244  -3.216   1.057
  374    HB   ILE  47           HB       ILE  47  -0.379  -2.716   0.643
  375   HG12  ILE  47          2HG1      ILE  47   0.742  -0.883  -1.042
  376   HG13  ILE  47          1HG1      ILE  47  -0.842  -0.712  -0.293
  377   HG21  ILE  47          1HG2      ILE  47   1.194  -2.490   2.696
  378   HG22  ILE  47          2HG2      ILE  47  -0.323  -1.593   2.659
  379   HG23  ILE  47          3HG2      ILE  47   1.194  -0.777   2.283
  380   HD11  ILE  47          3HD1      ILE  47   0.041   0.678   1.424
  381   HD12  ILE  47          1HD1      ILE  47   0.618   1.295  -0.123
  382   HD13  ILE  47          2HD1      ILE  47   1.696   0.357   0.910
  383    H    GLU  48           H        GLU  48   1.082  -2.721  -2.246
  384    HA   GLU  48           HA       GLU  48  -0.402  -5.048  -2.548
  385    HB2  GLU  48           2HB      GLU  48  -0.613  -4.329  -4.661
  386    HB3  GLU  48           1HB      GLU  48   0.405  -2.974  -4.195
  387    HG2  GLU  48           2HG      GLU  48   1.226  -3.976  -6.224
  388    HG3  GLU  48           1HG      GLU  48   2.383  -4.219  -4.916
  389    H    GLN  49           H        GLN  49   3.042  -4.516  -2.709
  390    HA   GLN  49           HA       GLN  49   3.757  -7.056  -3.724
  391    HB2  GLN  49           2HB      GLN  49   5.925  -6.385  -3.462
  392    HB3  GLN  49           1HB      GLN  49   5.144  -4.813  -3.382
  393    HG2  GLN  49           2HG      GLN  49   5.082  -5.239  -0.834
  394    HG3  GLN  49           1HG      GLN  49   6.314  -6.453  -1.178
  395   HE21  GLN  49          1HE2      GLN  49   5.833  -3.368  -2.799
  396   HE22  GLN  49          2HE2      GLN  49   7.345  -2.675  -2.328
  397    H    GLU  50           H        GLU  50   3.475  -5.765  -0.430
  398    HA   GLU  50           HA       GLU  50   3.878  -8.442   0.622
  399    HB2  GLU  50           2HB      GLU  50   5.259  -6.985   1.805
  400    HB3  GLU  50           1HB      GLU  50   4.055  -5.703   1.815
  401    HG2  GLU  50           2HG      GLU  50   3.320  -8.169   3.245
  402    HG3  GLU  50           1HG      GLU  50   4.639  -7.231   3.942
  403    H    PHE  51           H        PHE  51   1.465  -7.766  -0.741
  404    HA   PHE  51           HA       PHE  51  -0.428  -8.282   1.396
  405    HB2  PHE  51           2HB      PHE  51  -0.482  -6.030  -0.510
  406    HB3  PHE  51           1HB      PHE  51  -2.015  -6.858  -0.265
  407    HD1  PHE  51           1HD      PHE  51   0.788  -5.321   1.644
  408    HD2  PHE  51           2HD      PHE  51  -3.362  -6.252   1.502
  409    HE1  PHE  51           1HE      PHE  51   0.435  -4.040   3.714
  410    HE2  PHE  51           2HE      PHE  51  -3.724  -4.972   3.572
  411    HZ   PHE  51           HZ       PHE  51  -1.823  -3.864   4.680
  412    H    ILE  52           H        ILE  52   0.727  -8.981  -1.739
  413    HA   ILE  52           HA       ILE  52   0.204 -10.605  -3.241
  414    HB   ILE  52           HB       ILE  52  -1.974 -11.824  -1.690
  415   HG12  ILE  52          2HG1      ILE  52   0.393 -12.667  -0.382
  416   HG13  ILE  52          1HG1      ILE  52   0.362 -10.909  -0.323
  417   HG21  ILE  52          1HG2      ILE  52  -1.289 -13.605  -2.825
  418   HG22  ILE  52          2HG2      ILE  52   0.338 -13.463  -2.158
  419   HG23  ILE  52          3HG2      ILE  52  -0.097 -12.577  -3.620
  420   HD11  ILE  52          3HD1      ILE  52  -1.471 -12.879   0.913
  421   HD12  ILE  52          1HD1      ILE  52  -2.122 -11.314   0.426
  422   HD13  ILE  52          2HD1      ILE  52  -0.785 -11.394   1.575
  423    H    LEU  53           H        LEU  53  -1.145  -8.095  -3.311
  424    HA   LEU  53           HA       LEU  53  -3.214  -8.732  -5.147
  425    HB2  LEU  53           2HB      LEU  53  -4.074  -8.672  -2.551
  426    HB3  LEU  53           1HB      LEU  53  -4.361  -7.018  -3.058
  427    HG   LEU  53           HG       LEU  53  -6.222  -8.852  -3.323
  428   HD11  LEU  53          1HD1      LEU  53  -6.336  -7.462  -5.794
  429   HD12  LEU  53          2HD1      LEU  53  -5.625  -6.388  -4.589
  430   HD13  LEU  53          3HD1      LEU  53  -7.203  -7.123  -4.296
  431   HD21  LEU  53          3HD2      LEU  53  -4.812  -9.143  -5.964
  432   HD22  LEU  53          1HD2      LEU  53  -6.228 -10.017  -5.380
  433   HD23  LEU  53          2HD2      LEU  53  -4.648 -10.314  -4.655
  434    H    ASP  54           H        ASP  54  -3.993  -6.862  -6.288
  435    HA   ASP  54           HA       ASP  54  -2.021  -4.795  -6.426
  436    HB2  ASP  54           2HB      ASP  54  -2.688  -4.775  -8.558
  437    HB3  ASP  54           1HB      ASP  54  -3.990  -5.894  -8.168
  438    H    ILE  55           H        ILE  55  -2.264  -2.634  -5.946
  439    HA   ILE  55           HA       ILE  55  -4.689  -1.909  -4.472
  440    HB   ILE  55           HB       ILE  55  -1.966  -0.767  -3.904
  441   HG12  ILE  55          2HG1      ILE  55  -1.560  -2.915  -3.195
  442   HG13  ILE  55          1HG1      ILE  55  -2.350  -2.277  -1.757
  443   HG21  ILE  55          1HG2      ILE  55  -4.140   0.437  -3.278
  444   HG22  ILE  55          2HG2      ILE  55  -2.928   0.213  -2.016
  445   HG23  ILE  55          3HG2      ILE  55  -4.341  -0.840  -2.077
  446   HD11  ILE  55          3HD1      ILE  55  -4.342  -3.294  -3.511
  447   HD12  ILE  55          1HD1      ILE  55  -3.896  -3.844  -1.896
  448   HD13  ILE  55          2HD1      ILE  55  -3.077  -4.507  -3.311
  449    HA   PRO  56           HA       PRO  56  -2.914   2.267  -6.435
  450    HB2  PRO  56           2HB      PRO  56  -1.309   1.481  -8.635
  451    HB3  PRO  56           1HB      PRO  56  -0.776   2.298  -7.165
  452    HG2  PRO  56           2HG      PRO  56  -0.675  -0.584  -7.874
  453    HG3  PRO  56           1HG      PRO  56   0.420   0.366  -6.853
  454    HD2  PRO  56           2HD      PRO  56  -1.328  -1.361  -5.791
  455    HD3  PRO  56           1HD      PRO  56  -0.958   0.182  -4.992
  456    H    ASP  57           H        ASP  57  -2.885   2.833  -9.066
  457    HA   ASP  57           HA       ASP  57  -4.092   2.849 -11.002
  458    HB2  ASP  57           2HB      ASP  57  -5.226   0.157 -10.249
  459    HB3  ASP  57           1HB      ASP  57  -5.037   0.846 -11.860
  460    H    HIS  58           H        HIS  58  -6.724   1.616 -11.341
  461    HA   HIS  58           HA       HIS  58  -8.317   3.692 -10.312
  462    HB2  HIS  58           2HB      HIS  58  -8.679   1.373 -12.002
  463    HB3  HIS  58           1HB      HIS  58 -10.042   1.566 -10.905
  464    HD1  HIS  58           1HD      HIS  58 -11.733   2.406 -12.579
  465    HD2  HIS  58           2HD      HIS  58  -8.214   4.616 -12.587
  466    HE1  HIS  58           1HE      HIS  58 -12.200   4.411 -14.024
  467    HE2  HIS  58           2HE      HIS  58 -10.086   5.778 -13.941
  468    H    ASP  59           H        ASP  59  -7.465   0.557  -9.067
  469    HA   ASP  59           HA       ASP  59  -9.532   0.291  -7.169
  470    HB2  ASP  59           2HB      ASP  59  -6.775  -0.892  -7.398
  471    HB3  ASP  59           1HB      ASP  59  -7.813  -1.246  -6.019
  472    H    ALA  60           H        ALA  60  -6.258   1.638  -6.936
  473    HA   ALA  60           HA       ALA  60  -6.606   2.365  -4.180
  474    HB1  ALA  60           1HB      ALA  60  -4.408   3.109  -6.100
  475    HB2  ALA  60           2HB      ALA  60  -4.409   1.706  -5.032
  476    HB3  ALA  60           3HB      ALA  60  -4.380   3.332  -4.351
  477    H    GLU  61           H        GLU  61  -7.104   3.830  -7.253
  478    HA   GLU  61           HA       GLU  61  -7.128   6.530  -6.266
  479    HB2  GLU  61           2HB      GLU  61  -7.355   7.196  -8.453
  480    HB3  GLU  61           1HB      GLU  61  -6.594   5.627  -8.679
  481    HG2  GLU  61           2HG      GLU  61  -8.270   5.450 -10.194
  482    HG3  GLU  61           1HG      GLU  61  -9.100   4.815  -8.775
  483    H    LYS  62           H        LYS  62  -9.379   3.952  -6.598
  484    HA   LYS  62           HA       LYS  62 -11.749   5.525  -6.679
  485    HB2  LYS  62           2HB      LYS  62 -12.922   3.522  -6.600
  486    HB3  LYS  62           1HB      LYS  62 -11.405   3.045  -7.349
  487    HG2  LYS  62           2HG      LYS  62 -10.682   1.907  -5.482
  488    HG3  LYS  62           1HG      LYS  62 -11.714   2.834  -4.390
  489    HD2  LYS  62           2HD      LYS  62 -12.285   0.338  -5.085
  490    HD3  LYS  62           1HD      LYS  62 -13.546   1.539  -4.801
  491    HE2  LYS  62           2HE      LYS  62 -12.473   1.457  -7.540
  492    HE3  LYS  62           1HE      LYS  62 -13.356   0.017  -7.034
  493    HZ1  LYS  62           3HZ      LYS  62 -14.388   2.492  -7.841
  494    HZ2  LYS  62           1HZ      LYS  62 -14.812   2.259  -6.220
  495    HZ3  LYS  62           2HZ      LYS  62 -15.236   1.104  -7.380
  496    H    ILE  63           H        ILE  63  -9.536   5.411  -4.345
  497    HA   ILE  63           HA       ILE  63 -11.462   5.406  -2.145
  498    HB   ILE  63           HB       ILE  63  -9.691   3.866  -1.716
  499   HG12  ILE  63          2HG1      ILE  63  -8.943   6.333  -0.149
  500   HG13  ILE  63          1HG1      ILE  63 -10.463   5.483   0.114
  501   HG21  ILE  63          1HG2      ILE  63  -7.374   5.471  -1.543
  502   HG22  ILE  63          2HG2      ILE  63  -8.112   5.786  -3.114
  503   HG23  ILE  63          3HG2      ILE  63  -7.697   4.136  -2.648
  504   HD11  ILE  63          3HD1      ILE  63  -8.783   4.809   1.727
  505   HD12  ILE  63          1HD1      ILE  63  -7.710   4.310   0.419
  506   HD13  ILE  63          2HD1      ILE  63  -9.232   3.459   0.685
  507    H    GLN  64           H        GLN  64 -11.908   7.233  -1.065
  508    HA   GLN  64           HA       GLN  64 -10.283   9.584  -1.637
  509    HB2  GLN  64           2HB      GLN  64 -13.211   9.619  -0.941
  510    HB3  GLN  64           1HB      GLN  64 -12.238  10.958  -1.532
  511    HG2  GLN  64           2HG      GLN  64 -13.106  10.452  -3.519
  512    HG3  GLN  64           1HG      GLN  64 -11.928   9.139  -3.529
  513   HE21  GLN  64          1HE2      GLN  64 -12.644   7.060  -2.695
  514   HE22  GLN  64          2HE2      GLN  64 -14.294   6.595  -2.909
  515    H    SER  65           H        SER  65 -11.386   7.477   0.745
  516    HA   SER  65           HA       SER  65 -10.651   9.403   2.851
  517    HB2  SER  65           2HB      SER  65 -13.105   8.703   2.770
  518    HB3  SER  65           1HB      SER  65 -12.557   7.099   3.257
  519    HG   SER  65           HG       SER  65 -12.964   9.261   4.777
  520    H    ILE  66           H        ILE  66  -9.659   8.497   4.753
  521    HA   ILE  66           HA       ILE  66  -7.596   6.678   4.164
  522    HB   ILE  66           HB       ILE  66  -8.510   7.315   6.956
  523   HG12  ILE  66          2HG1      ILE  66  -8.218   9.310   5.209
  524   HG13  ILE  66          1HG1      ILE  66  -7.677   9.448   6.877
  525   HG21  ILE  66          1HG2      ILE  66  -6.746   5.687   6.800
  526   HG22  ILE  66          2HG2      ILE  66  -6.077   7.200   7.408
  527   HG23  ILE  66          3HG2      ILE  66  -5.820   6.736   5.726
  528   HD11  ILE  66          3HD1      ILE  66  -5.960   8.742   4.511
  529   HD12  ILE  66          1HD1      ILE  66  -5.410   8.856   6.182
  530   HD13  ILE  66          2HD1      ILE  66  -6.002  10.293   5.350
  531    HA   PRO  67           HA       PRO  67 -10.440   3.743   7.029
  532    HB2  PRO  67           2HB      PRO  67 -13.016   3.978   5.922
  533    HB3  PRO  67           1HB      PRO  67 -12.504   4.526   7.519
  534    HG2  PRO  67           2HG      PRO  67 -12.807   6.067   4.993
  535    HG3  PRO  67           1HG      PRO  67 -13.083   6.582   6.667
  536    HD2  PRO  67           2HD      PRO  67 -10.913   7.360   5.309
  537    HD3  PRO  67           1HD      PRO  67 -10.827   6.986   7.043
  538    H    ASP  68           H        ASP  68 -12.238   4.188   3.998
  539    HA   ASP  68           HA       ASP  68 -12.266   1.584   3.174
  540    HB2  ASP  68           2HB      ASP  68 -12.222   4.154   1.617
  541    HB3  ASP  68           1HB      ASP  68 -12.279   2.602   0.786
  542    H    ALA  69           H        ALA  69  -9.555   3.633   3.370
  543    HA   ALA  69           HA       ALA  69  -7.942   2.441   1.368
  544    HB1  ALA  69           1HB      ALA  69  -7.726   4.605   3.163
  545    HB2  ALA  69           2HB      ALA  69  -6.669   4.196   1.811
  546    HB3  ALA  69           3HB      ALA  69  -6.327   3.561   3.420
  547    H    VAL  70           H        VAL  70  -6.860   2.512   4.684
  548    HA   VAL  70           HA       VAL  70  -5.549   0.026   4.492
  549    HB   VAL  70           HB       VAL  70  -4.991   1.931   6.080
  550   HG11  VAL  70          1HG1      VAL  70  -6.073   2.011   8.211
  551   HG12  VAL  70          2HG1      VAL  70  -7.064   0.605   7.820
  552   HG13  VAL  70          3HG1      VAL  70  -7.317   2.128   6.968
  553   HG21  VAL  70          3HG2      VAL  70  -4.198   0.369   7.855
  554   HG22  VAL  70          1HG2      VAL  70  -3.806  -0.146   6.215
  555   HG23  VAL  70          2HG2      VAL  70  -5.139  -0.907   7.083
  556    H    GLU  71           H        GLU  71  -8.775   0.862   5.290
  557    HA   GLU  71           HA       GLU  71  -9.442  -1.372   6.884
  558    HB2  GLU  71           2HB      GLU  71 -11.608  -0.598   6.815
  559    HB3  GLU  71           1HB      GLU  71 -10.730   0.873   6.422
  560    HG2  GLU  71           2HG      GLU  71 -11.186   0.574   4.077
  561    HG3  GLU  71           1HG      GLU  71 -11.947  -0.985   4.391
  562    H    TYR  72           H        TYR  72  -9.594  -0.750   3.404
  563    HA   TYR  72           HA       TYR  72 -10.848  -3.197   2.749
  564    HB2  TYR  72           2HB      TYR  72 -10.940  -2.322   0.686
  565    HB3  TYR  72           1HB      TYR  72 -10.207  -0.880   1.378
  566    HD1  TYR  72           2HD      TYR  72  -8.888  -4.246   0.404
  567    HD2  TYR  72           1HD      TYR  72  -8.594  -0.023  -0.019
  568    HE1  TYR  72           2HE      TYR  72  -6.941  -4.535  -1.071
  569    HE2  TYR  72           1HE      TYR  72  -6.648  -0.300  -1.494
  570    HH   TYR  72           HH       TYR  72  -5.711  -2.068  -2.994
  571    H    ILE  73           H        ILE  73  -7.496  -2.149   2.866
  572    HA   ILE  73           HA       ILE  73  -6.399  -4.552   1.852
  573    HB   ILE  73           HB       ILE  73  -4.565  -3.283   3.642
  574   HG12  ILE  73          2HG1      ILE  73  -6.021  -1.316   3.440
  575   HG13  ILE  73          1HG1      ILE  73  -4.486  -1.055   2.618
  576   HG21  ILE  73          1HG2      ILE  73  -4.444  -2.992   0.682
  577   HG22  ILE  73          2HG2      ILE  73  -4.326  -4.602   1.394
  578   HG23  ILE  73          3HG2      ILE  73  -3.158  -3.356   1.833
  579   HD11  ILE  73          3HD1      ILE  73  -7.210  -1.318   1.508
  580   HD12  ILE  73          1HD1      ILE  73  -5.868  -1.939   0.549
  581   HD13  ILE  73          2HD1      ILE  73  -5.891  -0.246   1.043
  582    H    ALA  74           H        ALA  74  -7.342  -3.469   5.012
  583    HA   ALA  74           HA       ALA  74  -6.013  -5.433   6.531
  584    HB1  ALA  74           1HB      ALA  74  -8.014  -3.381   7.000
  585    HB2  ALA  74           2HB      ALA  74  -6.734  -3.974   8.059
  586    HB3  ALA  74           3HB      ALA  74  -8.276  -4.825   7.977
  587    H    GLN  75           H        GLN  75  -9.304  -5.264   5.283
  588    HA   GLN  75           HA       GLN  75  -9.951  -7.904   6.158
  589    HB2  GLN  75           2HB      GLN  75 -11.488  -6.201   4.208
  590    HB3  GLN  75           1HB      GLN  75 -12.102  -7.543   5.164
  591    HG2  GLN  75           2HG      GLN  75 -11.980  -6.302   7.165
  592    HG3  GLN  75           1HG      GLN  75 -11.010  -5.039   6.408
  593   HE21  GLN  75          1HE2      GLN  75 -12.004  -3.374   5.435
  594   HE22  GLN  75          2HE2      GLN  75 -13.717  -3.207   5.280
  595    H    ASN  76           H        ASN  76 -10.433  -6.669   2.898
  596    HA   ASN  76           HA       ASN  76 -10.450  -8.823   1.393
  597    HB2  ASN  76           2HB      ASN  76  -9.126  -6.207   0.983
  598    HB3  ASN  76           1HB      ASN  76  -8.639  -7.492  -0.120
  599   HD21  ASN  76          1HD2      ASN  76 -10.624  -4.976   0.152
  600   HD22  ASN  76          2HD2      ASN  76 -11.936  -5.492  -0.849
  601    HA   PRO  77           HA       PRO  77  -5.659  -9.666   1.232
  602    HB2  PRO  77           2HB      PRO  77  -4.764  -7.835   3.403
  603    HB3  PRO  77           1HB      PRO  77  -3.972  -8.242   1.876
  604    HG2  PRO  77           2HG      PRO  77  -5.166  -5.888   2.185
  605    HG3  PRO  77           1HG      PRO  77  -5.283  -6.768   0.651
  606    HD2  PRO  77           2HD      PRO  77  -7.315  -6.476   2.825
  607    HD3  PRO  77           1HD      PRO  77  -7.535  -6.497   1.065
  608    H    MET  78           H        MET  78  -7.113  -8.769   4.356
  609    HA   MET  78           HA       MET  78  -5.772 -10.546   6.009
  610    HB2  MET  78           2HB      MET  78  -7.108  -9.217   7.282
  611    HB3  MET  78           1HB      MET  78  -8.386  -9.169   6.076
  612    HG2  MET  78           2HG      MET  78  -9.377 -11.093   6.848
  613    HG3  MET  78           1HG      MET  78  -7.890 -11.691   7.581
  614    HE1  MET  78           3HE      MET  78  -8.084  -7.975   9.183
  615    HE2  MET  78           1HE      MET  78  -9.842  -7.924   9.060
  616    HE3  MET  78           2HE      MET  78  -8.866  -8.226   7.623
  617    H    ALA  79           H        ALA  79  -7.984 -11.191   3.497
  618    HA   ALA  79           HA       ALA  79  -8.436 -13.904   4.438
  619    HB1  ALA  79           1HB      ALA  79 -10.132 -12.042   3.195
  620    HB2  ALA  79           2HB      ALA  79 -10.494 -13.713   3.628
  621    HB3  ALA  79           3HB      ALA  79  -9.858 -13.335   2.028
  622    H    LYS  80           H        LYS  80  -6.808 -12.029   2.073
  623    HA   LYS  80           HA       LYS  80  -6.229 -13.045  -0.144
  624    HB2  LYS  80           2HB      LYS  80  -3.751 -13.323   0.367
  625    HB3  LYS  80           1HB      LYS  80  -4.471 -11.775   0.790
  626    HG2  LYS  80           2HG      LYS  80  -4.801 -12.986   3.121
  627    HG3  LYS  80           1HG      LYS  80  -3.428 -13.928   2.539
  628    HD2  LYS  80           2HD      LYS  80  -2.862 -11.215   1.994
  629    HD3  LYS  80           1HD      LYS  80  -3.463 -11.295   3.652
  630    HE2  LYS  80           2HE      LYS  80  -1.344 -13.162   2.624
  631    HE3  LYS  80           1HE      LYS  80  -0.953 -11.581   3.303
  632    HZ1  LYS  80           3HZ      LYS  80  -0.901 -13.556   4.865
  633    HZ2  LYS  80           1HZ      LYS  80  -2.592 -13.549   4.782
  634    HZ3  LYS  80           2HZ      LYS  80  -1.768 -12.201   5.386
  635   H282  PNS 101          8H2       PNS 101   0.388  16.598 -10.481
  636   H281  PNS 101          9H2       PNS 101   0.747  14.869 -10.534
  637   H303  PNS 101          0H3       PNS 101   2.008  17.819  -8.677
  638   H302  PNS 101          1H3       PNS 101   3.652  17.187  -8.583
  639   H301  PNS 101          2H3       PNS 101   2.339  16.356  -7.748
  640   H313  PNS 101          3H3       PNS 101   4.185  14.999  -9.827
  641   H312  PNS 101          4H3       PNS 101   2.831  14.131 -10.552
  642   H311  PNS 101          5H3       PNS 101   2.917  14.325  -8.802
  643    H32  PNS 101           6H3      PNS 101   1.843  17.160 -11.458
  644    H33  PNS 101           7H3      PNS 101   2.877  18.541 -10.097
  645    H36  PNS 101           8H3      PNS 101   4.932  15.788 -11.262
  646   H372  PNS 101          9H3       PNS 101   4.292  14.099 -13.573
  647   H371  PNS 101          0H4       PNS 101   5.502  13.759 -12.337
  648   H382  PNS 101          1H4       PNS 101   6.862  14.379 -14.060
  649   H381  PNS 101          2H4       PNS 101   5.673  15.486 -14.745
  650    H41  PNS 101           3H4      PNS 101   5.030  17.145 -13.192
  651   H422  PNS 101          4H4       PNS 101   7.276  18.831 -12.531
  652   H421  PNS 101          5H4       PNS 101   5.566  19.259 -12.461
  653   H431  PNS 101          7H4       PNS 101   6.635  19.242 -10.234
  654   H432  PNS 101          6H4       PNS 101   5.323  18.062 -10.361
  655    H44  PNS 101           8H4      PNS 101   8.217  17.410  -9.802
  Start of MODEL   19
    1    H1   MET   1           1HT      MET   1  -4.013 -10.391   9.862
    2    H2   MET   1           2HT      MET   1  -2.837  -9.926  11.022
    3    H3   MET   1           3HT      MET   1  -2.813  -9.239   9.451
    4    HA   MET   1           HA       MET   1  -4.998  -8.287   9.887
    5    HB2  MET   1           2HB      MET   1  -5.015  -8.261  12.676
    6    HB3  MET   1           1HB      MET   1  -6.112  -9.152  11.628
    7    HG2  MET   1           2HG      MET   1  -4.247 -10.956  11.650
    8    HG3  MET   1           1HG      MET   1  -3.701 -10.113  13.098
    9    HE1  MET   1           2HE      MET   1  -3.857 -12.521  13.875
   10    HE2  MET   1           3HE      MET   1  -5.285 -13.168  14.684
   11    HE3  MET   1           1HE      MET   1  -4.465 -11.753  15.342
   12    H    ASN   2           H        ASN   2  -2.964  -8.068  12.779
   13    HA   ASN   2           HA       ASN   2  -2.722  -5.279  12.657
   14    HB2  ASN   2           2HB      ASN   2  -1.025  -7.322  14.096
   15    HB3  ASN   2           1HB      ASN   2  -0.898  -5.583  14.344
   16   HD21  ASN   2          1HD2      ASN   2  -3.121  -8.309  14.532
   17   HD22  ASN   2          2HD2      ASN   2  -4.098  -7.658  15.800
   18    H    ASP   3           H        ASP   3  -0.801  -7.834  11.298
   19    HA   ASP   3           HA       ASP   3   1.578  -6.558  10.754
   20    HB2  ASP   3           2HB      ASP   3   1.994  -8.221   9.145
   21    HB3  ASP   3           1HB      ASP   3   0.894  -8.988  10.286
   22    H    VAL   4           H        VAL   4  -1.512  -6.142   9.238
   23    HA   VAL   4           HA       VAL   4  -0.606  -4.821   6.905
   24    HB   VAL   4           HB       VAL   4  -3.264  -4.870   8.223
   25   HG11  VAL   4          1HG1      VAL   4  -2.797  -3.878   5.445
   26   HG12  VAL   4          2HG1      VAL   4  -2.735  -2.784   6.828
   27   HG13  VAL   4          3HG1      VAL   4  -4.218  -3.670   6.468
   28   HG21  VAL   4          3HG2      VAL   4  -2.232  -6.942   7.122
   29   HG22  VAL   4          1HG2      VAL   4  -2.530  -6.100   5.601
   30   HG23  VAL   4          2HG2      VAL   4  -3.877  -6.495   6.670
   31    H    LEU   5           H        LEU   5  -2.170  -3.549   9.836
   32    HA   LEU   5           HA       LEU   5  -1.818  -0.843   9.135
   33    HB2  LEU   5           2HB      LEU   5  -2.025  -1.584  11.977
   34    HB3  LEU   5           1HB      LEU   5  -2.856  -0.327  11.091
   35    HG   LEU   5           HG       LEU   5  -4.631  -1.694  11.392
   36   HD11  LEU   5          1HD1      LEU   5  -3.437  -2.039   8.887
   37   HD12  LEU   5          2HD1      LEU   5  -5.128  -2.291   9.317
   38   HD13  LEU   5          3HD1      LEU   5  -3.991  -3.638   9.382
   39   HD21  LEU   5          3HD2      LEU   5  -3.771  -4.367  11.174
   40   HD22  LEU   5          1HD2      LEU   5  -4.310  -3.513  12.621
   41   HD23  LEU   5          2HD2      LEU   5  -2.599  -3.535  12.195
   42    H    THR   6           H        THR   6   0.125  -3.087  10.959
   43    HA   THR   6           HA       THR   6   1.866  -1.261  12.169
   44    HB   THR   6           HB       THR   6   2.007  -3.385  13.066
   45    HG1  THR   6           1HG      THR   6   4.121  -2.566  12.593
   46   HG21  THR   6          3HG2      THR   6   2.812  -5.090  10.949
   47   HG22  THR   6          1HG2      THR   6   1.330  -4.259  10.474
   48   HG23  THR   6          2HG2      THR   6   1.378  -5.190  11.972
   49    H    ARG   7           H        ARG   7   2.410  -3.194   9.251
   50    HA   ARG   7           HA       ARG   7   4.779  -1.764   8.572
   51    HB2  ARG   7           2HB      ARG   7   5.116  -3.359   6.977
   52    HB3  ARG   7           1HB      ARG   7   3.997  -4.238   8.009
   53    HG2  ARG   7           2HG      ARG   7   3.087  -4.613   5.943
   54    HG3  ARG   7           1HG      ARG   7   2.185  -3.184   6.452
   55    HD2  ARG   7           2HD      ARG   7   2.854  -2.194   4.577
   56    HD3  ARG   7           1HD      ARG   7   4.489  -2.192   5.235
   57    HE   ARG   7           HE       ARG   7   3.420  -3.971   3.210
   58   HH11  ARG   7          1HH1      ARG   7   5.989  -3.297   5.462
   59   HH12  ARG   7          2HH1      ARG   7   7.143  -4.298   4.646
   60   HH21  ARG   7          1HH2      ARG   7   4.931  -5.294   2.128
   61   HH22  ARG   7          2HH2      ARG   7   6.542  -5.433   2.750
   62    H    VAL   8           H        VAL   8   1.469  -1.879   7.359
   63    HA   VAL   8           HA       VAL   8   1.848  -0.139   5.189
   64    HB   VAL   8           HB       VAL   8  -0.167  -1.695   5.785
   65   HG11  VAL   8          1HG1      VAL   8  -2.070  -0.537   6.733
   66   HG12  VAL   8          2HG1      VAL   8  -1.108   0.928   6.934
   67   HG13  VAL   8          3HG1      VAL   8  -0.724  -0.515   7.871
   68   HG21  VAL   8          3HG2      VAL   8  -1.069   0.871   4.594
   69   HG22  VAL   8          1HG2      VAL   8  -1.285  -0.783   4.021
   70   HG23  VAL   8          2HG2      VAL   8   0.270   0.025   3.819
   71    H    LEU   9           H        LEU   9   0.576   0.464   8.455
   72    HA   LEU   9           HA       LEU   9   0.168   3.227   8.135
   73    HB2  LEU   9           2HB      LEU   9  -0.337   3.274  10.375
   74    HB3  LEU   9           1HB      LEU   9  -0.592   1.579  10.011
   75    HG   LEU   9           HG       LEU   9   1.831   1.239  10.818
   76   HD11  LEU   9          1HD1      LEU   9   1.305   4.064  11.592
   77   HD12  LEU   9          2HD1      LEU   9   2.793   3.304  11.028
   78   HD13  LEU   9          3HD1      LEU   9   2.240   3.041  12.682
   79   HD21  LEU   9          3HD2      LEU   9   1.037   1.308  13.233
   80   HD22  LEU   9          1HD2      LEU   9   0.084   0.340  12.108
   81   HD23  LEU   9          2HD2      LEU   9  -0.485   1.935  12.600
   82    H    GLU  10           H        GLU  10   2.936   1.395   9.364
   83    HA   GLU  10           HA       GLU  10   4.500   3.621  10.091
   84    HB2  GLU  10           2HB      GLU  10   6.331   2.091  10.286
   85    HB3  GLU  10           1HB      GLU  10   4.883   1.268  10.850
   86    HG2  GLU  10           2HG      GLU  10   4.921  -0.238   9.178
   87    HG3  GLU  10           1HG      GLU  10   5.536   0.918   8.000
   88    H    VAL  11           H        VAL  11   4.042   1.911   7.100
   89    HA   VAL  11           HA       VAL  11   6.229   2.825   5.657
   90    HB   VAL  11           HB       VAL  11   3.607   1.737   4.985
   91   HG11  VAL  11          1HG1      VAL  11   5.084   3.578   3.177
   92   HG12  VAL  11          2HG1      VAL  11   3.347   3.370   3.395
   93   HG13  VAL  11          3HG1      VAL  11   4.270   2.173   2.488
   94   HG21  VAL  11          3HG2      VAL  11   5.366   0.595   3.304
   95   HG22  VAL  11          1HG2      VAL  11   5.086   0.042   4.956
   96   HG23  VAL  11          2HG2      VAL  11   6.449   1.103   4.599
   97    H    VAL  12           H        VAL  12   2.955   4.144   5.707
   98    HA   VAL  12           HA       VAL  12   3.590   6.443   4.171
   99    HB   VAL  12           HB       VAL  12   1.303   5.661   4.263
  100   HG11  VAL  12          1HG1      VAL  12   0.127   5.222   6.136
  101   HG12  VAL  12          2HG1      VAL  12   0.801   6.597   7.012
  102   HG13  VAL  12          3HG1      VAL  12   1.730   5.105   6.865
  103   HG21  VAL  12          3HG2      VAL  12   1.105   8.233   5.746
  104   HG22  VAL  12          1HG2      VAL  12   0.301   7.718   4.263
  105   HG23  VAL  12          2HG2      VAL  12   1.995   8.209   4.223
  106    H    LYS  13           H        LYS  13   3.164   5.902   7.653
  107    HA   LYS  13           HA       LYS  13   3.452   8.504   8.555
  108    HB2  LYS  13           2HB      LYS  13   3.994   5.816   9.724
  109    HB3  LYS  13           1HB      LYS  13   4.619   7.221  10.575
  110    HG2  LYS  13           2HG      LYS  13   2.392   6.421  11.357
  111    HG3  LYS  13           1HG      LYS  13   2.438   8.121  10.865
  112    HD2  LYS  13           2HD      LYS  13   1.756   6.244   8.714
  113    HD3  LYS  13           1HD      LYS  13   0.585   6.301  10.033
  114    HE2  LYS  13           2HE      LYS  13   1.084   8.945   9.637
  115    HE3  LYS  13           1HE      LYS  13   1.247   8.313   8.000
  116    HZ1  LYS  13           3HZ      LYS  13  -0.935   7.853   7.868
  117    HZ2  LYS  13           1HZ      LYS  13  -1.077   9.015   9.090
  118    HZ3  LYS  13           2HZ      LYS  13  -1.060   7.370   9.483
  119    H    ASN  14           H        ASN  14   5.986   6.070   8.014
  120    HA   ASN  14           HA       ASN  14   8.064   7.981   8.534
  121    HB2  ASN  14           2HB      ASN  14   8.349   5.176   7.457
  122    HB3  ASN  14           1HB      ASN  14   9.603   6.157   8.211
  123   HD21  ASN  14          1HD2      ASN  14   7.515   3.688   8.709
  124   HD22  ASN  14          2HD2      ASN  14   7.392   3.748  10.431
  125    H    PHE  15           H        PHE  15   6.101   7.407   5.968
  126    HA   PHE  15           HA       PHE  15   7.879   7.429   3.781
  127    HB2  PHE  15           2HB      PHE  15   5.168   7.162   4.067
  128    HB3  PHE  15           1HB      PHE  15   5.298   8.766   3.352
  129    HD1  PHE  15           2HD      PHE  15   6.989   5.470   2.862
  130    HD2  PHE  15           1HD      PHE  15   4.991   8.782   1.088
  131    HE1  PHE  15           2HE      PHE  15   7.276   4.449   0.642
  132    HE2  PHE  15           1HE      PHE  15   5.274   7.767  -1.135
  133    HZ   PHE  15           HZ       PHE  15   6.418   5.598  -1.360
  134    H    GLU  16           H        GLU  16   6.660   9.877   5.876
  135    HA   GLU  16           HA       GLU  16   7.878  11.911   6.172
  136    HB2  GLU  16           2HB      GLU  16   9.115  12.897   4.497
  137    HB3  GLU  16           1HB      GLU  16   9.231  11.207   4.043
  138    HG2  GLU  16           2HG      GLU  16   6.951  12.111   2.770
  139    HG3  GLU  16           1HG      GLU  16   8.099  13.433   2.621
  140    H    LYS  17           H        LYS  17   5.127  10.916   4.701
  141    HA   LYS  17           HA       LYS  17   4.057  13.353   3.737
  142    HB2  LYS  17           2HB      LYS  17   3.115  10.621   4.172
  143    HB3  LYS  17           1HB      LYS  17   1.870  11.830   4.430
  144    HG2  LYS  17           2HG      LYS  17   3.144  10.925   1.955
  145    HG3  LYS  17           1HG      LYS  17   1.541  11.613   2.228
  146    HD2  LYS  17           2HD      LYS  17   4.145  13.110   2.017
  147    HD3  LYS  17           1HD      LYS  17   2.825  13.114   0.845
  148    HE2  LYS  17           2HE      LYS  17   2.188  13.891   3.634
  149    HE3  LYS  17           1HE      LYS  17   3.131  15.031   2.672
  150    HZ1  LYS  17           3HZ      LYS  17   0.386  14.057   2.219
  151    HZ2  LYS  17           1HZ      LYS  17   1.304  14.646   0.925
  152    HZ3  LYS  17           2HZ      LYS  17   0.961  15.647   2.244
  153    H    VAL  18           H        VAL  18   3.610  11.571   6.786
  154    HA   VAL  18           HA       VAL  18   3.550  13.800   8.434
  155    HB   VAL  18           HB       VAL  18   0.823  13.260   8.753
  156   HG11  VAL  18          1HG1      VAL  18   1.607  15.391   9.256
  157   HG12  VAL  18          2HG1      VAL  18   0.656  15.648   7.793
  158   HG13  VAL  18          3HG1      VAL  18   2.415  15.568   7.697
  159   HG21  VAL  18          3HG2      VAL  18  -0.209  13.177   6.746
  160   HG22  VAL  18          1HG2      VAL  18   1.319  12.467   6.228
  161   HG23  VAL  18          2HG2      VAL  18   1.007  14.181   5.959
  162    H    ASP  19           H        ASP  19   2.875  13.315  10.635
  163    HA   ASP  19           HA       ASP  19   3.519  10.661  11.381
  164    HB2  ASP  19           2HB      ASP  19   2.921  11.454  13.695
  165    HB3  ASP  19           1HB      ASP  19   4.128  12.436  12.870
  166    H    ALA  20           H        ALA  20   2.223   9.060  12.306
  167    HA   ALA  20           HA       ALA  20  -0.377   8.813  11.244
  168    HB1  ALA  20           1HB      ALA  20  -0.108   7.003  13.385
  169    HB2  ALA  20           2HB      ALA  20   1.481   7.157  12.636
  170    HB3  ALA  20           3HB      ALA  20   0.088   6.686  11.661
  171    H    SER  21           H        SER  21   0.789  10.311  14.081
  172    HA   SER  21           HA       SER  21  -1.455   9.976  15.756
  173    HB2  SER  21           2HB      SER  21  -0.526  11.914  17.013
  174    HB3  SER  21           1HB      SER  21   0.680  10.671  16.680
  175    HG   SER  21           HG       SER  21   1.256  11.997  14.811
  176    H    LYS  22           H        LYS  22  -0.921  11.955  13.012
  177    HA   LYS  22           HA       LYS  22  -3.098  13.754  13.708
  178    HB2  LYS  22           2HB      LYS  22  -2.485  14.739  11.391
  179    HB3  LYS  22           1HB      LYS  22  -1.390  15.002  12.740
  180    HG2  LYS  22           2HG      LYS  22  -0.110  14.438  10.805
  181    HG3  LYS  22           1HG      LYS  22  -0.030  13.093  11.943
  182    HD2  LYS  22           2HD      LYS  22  -0.363  12.325   9.631
  183    HD3  LYS  22           1HD      LYS  22  -1.719  11.890  10.672
  184    HE2  LYS  22           2HE      LYS  22  -3.084  13.594   9.766
  185    HE3  LYS  22           1HE      LYS  22  -1.715  14.371   8.974
  186    HZ1  LYS  22           3HZ      LYS  22  -3.424  12.394   7.957
  187    HZ2  LYS  22           1HZ      LYS  22  -1.863  11.744   8.045
  188    HZ3  LYS  22           2HZ      LYS  22  -2.138  13.171   7.180
  189    H    VAL  23           H        VAL  23  -3.013  10.771  12.721
  190    HA   VAL  23           HA       VAL  23  -4.799  10.957  10.448
  191    HB   VAL  23           HB       VAL  23  -2.924   9.043  11.366
  192   HG11  VAL  23          1HG1      VAL  23  -4.431   6.998  11.001
  193   HG12  VAL  23          2HG1      VAL  23  -5.763   8.086  11.394
  194   HG13  VAL  23          3HG1      VAL  23  -4.480   7.801  12.572
  195   HG21  VAL  23          3HG2      VAL  23  -3.443   7.988   9.171
  196   HG22  VAL  23          1HG2      VAL  23  -3.108   9.717   9.081
  197   HG23  VAL  23          2HG2      VAL  23  -4.770   9.136   8.988
  198    H    THR  24           H        THR  24  -6.943  10.900  10.631
  199    HA   THR  24           HA       THR  24  -8.104   9.912  13.114
  200    HB   THR  24           HB       THR  24  -8.398  12.412  11.880
  201    HG1  THR  24           1HG      THR  24  -9.332  11.080  14.089
  202   HG21  THR  24          3HG2      THR  24 -11.139  11.319  12.003
  203   HG22  THR  24          1HG2      THR  24 -10.196  10.979  10.553
  204   HG23  THR  24          2HG2      THR  24 -10.483  12.648  11.047
  205    HA   PRO  25           HA       PRO  25 -10.555   6.933  11.006
  206    HB2  PRO  25           2HB      PRO  25 -13.107   7.384  11.864
  207    HB3  PRO  25           1HB      PRO  25 -11.863   6.621  12.861
  208    HG2  PRO  25           2HG      PRO  25 -12.807   9.461  12.851
  209    HG3  PRO  25           1HG      PRO  25 -12.430   8.412  14.230
  210    HD2  PRO  25           2HD      PRO  25 -10.708  10.290  13.345
  211    HD3  PRO  25           1HD      PRO  25 -10.153   8.748  14.025
  212    H    GLU  26           H        GLU  26 -11.894  10.200  10.860
  213    HA   GLU  26           HA       GLU  26 -13.081   9.588   8.262
  214    HB2  GLU  26           2HB      GLU  26 -14.237  11.826   8.600
  215    HB3  GLU  26           1HB      GLU  26 -14.718  10.525   9.681
  216    HG2  GLU  26           2HG      GLU  26 -12.534  12.290  10.603
  217    HG3  GLU  26           1HG      GLU  26 -14.152  12.986  10.525
  218    H    SER  27           H        SER  27 -10.193  10.246   8.995
  219    HA   SER  27           HA       SER  27  -9.542  12.787   7.997
  220    HB2  SER  27           2HB      SER  27  -8.122  10.394   8.812
  221    HB3  SER  27           1HB      SER  27  -7.365  11.138   7.405
  222    HG   SER  27           HG       SER  27  -6.739  12.748   8.606
  223    H    HIS  28           H        HIS  28  -9.322  13.581   5.997
  224    HA   HIS  28           HA       HIS  28 -10.132  11.963   3.771
  225    HB2  HIS  28           2HB      HIS  28  -9.755  14.845   4.298
  226    HB3  HIS  28           1HB      HIS  28  -9.469  14.328   2.639
  227    HD1  HIS  28           1HD      HIS  28 -11.573  12.805   1.647
  228    HD2  HIS  28           2HD      HIS  28 -12.349  15.406   4.793
  229    HE1  HIS  28           1HE      HIS  28 -14.063  13.158   1.627
  230    HE2  HIS  28           2HE      HIS  28 -14.519  14.665   3.595
  231    H    PHE  29           H        PHE  29  -8.909  11.567   1.890
  232    HA   PHE  29           HA       PHE  29  -6.183  10.976   2.351
  233    HB2  PHE  29           2HB      PHE  29  -8.004  10.029   0.617
  234    HB3  PHE  29           1HB      PHE  29  -7.160  11.148  -0.447
  235    HD1  PHE  29           1HD      PHE  29  -4.409  10.854   0.783
  236    HD2  PHE  29           2HD      PHE  29  -7.345   7.989  -0.351
  237    HE1  PHE  29           1HE      PHE  29  -2.637   9.183   0.432
  238    HE2  PHE  29           2HE      PHE  29  -5.579   6.312  -0.702
  239    HZ   PHE  29           HZ       PHE  29  -3.221   6.909  -0.310
  240    H    VAL  30           H        VAL  30  -5.563  11.843  -0.537
  241    HA   VAL  30           HA       VAL  30  -3.792  13.793  -0.220
  242    HB   VAL  30           HB       VAL  30  -5.626  14.251  -2.520
  243   HG11  VAL  30          1HG1      VAL  30  -3.603  14.578  -3.731
  244   HG12  VAL  30          2HG1      VAL  30  -2.639  13.875  -2.431
  245   HG13  VAL  30          3HG1      VAL  30  -3.435  15.431  -2.196
  246   HG21  VAL  30          3HG2      VAL  30  -4.235  11.684  -1.907
  247   HG22  VAL  30          1HG2      VAL  30  -4.340  12.231  -3.581
  248   HG23  VAL  30          2HG2      VAL  30  -5.811  11.962  -2.647
  249    H    LYS  31           H        LYS  31  -7.224  14.251  -0.133
  250    HA   LYS  31           HA       LYS  31  -7.272  17.067  -0.281
  251    HB2  LYS  31           2HB      LYS  31  -9.308  15.491   1.260
  252    HB3  LYS  31           1HB      LYS  31  -9.538  16.928   0.273
  253    HG2  LYS  31           2HG      LYS  31  -9.289  14.080  -0.553
  254    HG3  LYS  31           1HG      LYS  31 -10.453  15.305  -1.061
  255    HD2  LYS  31           2HD      LYS  31  -9.062  16.164  -2.648
  256    HD3  LYS  31           1HD      LYS  31  -7.603  15.770  -1.737
  257    HE2  LYS  31           2HE      LYS  31  -7.348  13.839  -2.818
  258    HE3  LYS  31           1HE      LYS  31  -9.029  13.387  -2.540
  259    HZ1  LYS  31           3HZ      LYS  31  -7.924  14.032  -4.941
  260    HZ2  LYS  31           1HZ      LYS  31  -8.756  15.441  -4.514
  261    HZ3  LYS  31           2HZ      LYS  31  -9.579  13.966  -4.601
  262    H    ASP  32           H        ASP  32  -7.207  14.834   2.474
  263    HA   ASP  32           HA       ASP  32  -7.058  17.013   4.347
  264    HB2  ASP  32           2HB      ASP  32  -8.032  14.436   4.502
  265    HB3  ASP  32           1HB      ASP  32  -6.528  14.346   5.412
  266    H    LEU  33           H        LEU  33  -4.890  16.003   2.309
  267    HA   LEU  33           HA       LEU  33  -2.632  16.773   2.491
  268    HB2  LEU  33           2HB      LEU  33  -2.763  15.653   5.292
  269    HB3  LEU  33           1HB      LEU  33  -1.387  16.463   4.566
  270    HG   LEU  33           HG       LEU  33  -3.962  17.954   4.716
  271   HD11  LEU  33          1HD1      LEU  33  -3.897  17.087   6.927
  272   HD12  LEU  33          2HD1      LEU  33  -3.285  18.739   7.001
  273   HD13  LEU  33          3HD1      LEU  33  -2.163  17.378   7.060
  274   HD21  LEU  33          3HD2      LEU  33  -2.604  19.558   4.010
  275   HD22  LEU  33          1HD2      LEU  33  -1.211  18.484   4.150
  276   HD23  LEU  33          2HD2      LEU  33  -1.722  19.450   5.534
  277    H    GLY  34           H        GLY  34  -3.828  14.463   1.411
  278    HA2  GLY  34           2HA      GLY  34  -2.588  12.061   2.214
  279    HA3  GLY  34           1HA      GLY  34  -3.291  12.370   0.633
  280    H    LEU  35           H        LEU  35  -1.051  10.798   0.890
  281    HA   LEU  35           HA       LEU  35   1.384  12.194   0.597
  282    HB2  LEU  35           2HB      LEU  35   1.303   9.660  -0.820
  283    HB3  LEU  35           1HB      LEU  35   2.289  10.150   0.545
  284    HG   LEU  35           HG       LEU  35  -0.532   9.082   0.688
  285   HD11  LEU  35          1HD1      LEU  35   1.721   7.725   2.019
  286   HD12  LEU  35          2HD1      LEU  35   1.692   7.637   0.259
  287   HD13  LEU  35          3HD1      LEU  35   0.315   7.054   1.194
  288   HD21  LEU  35          3HD2      LEU  35   1.356   9.929   2.883
  289   HD22  LEU  35          1HD2      LEU  35  -0.191   9.116   3.118
  290   HD23  LEU  35          2HD2      LEU  35  -0.143  10.736   2.425
  291    H    ASN  36           H        ASN  36   2.501  12.878  -1.184
  292    HA   ASN  36           HA       ASN  36   1.232  13.960  -3.337
  293    HB2  ASN  36           2HB      ASN  36   3.643  14.288  -2.674
  294    HB3  ASN  36           1HB      ASN  36   4.008  12.771  -3.488
  295   HD21  ASN  36          1HD2      ASN  36   4.116  12.704  -5.666
  296   HD22  ASN  36          2HD2      ASN  36   3.996  14.098  -6.681
  297    H    SER  37           H        SER  37   1.911  13.234  -5.740
  298    HA   SER  37           HA       SER  37   0.327  10.980  -6.320
  299    HB2  SER  37           2HB      SER  37   2.350  12.024  -8.267
  300    HB3  SER  37           1HB      SER  37   0.708  11.455  -8.567
  301    H    LEU  38           H        LEU  38   3.788  11.457  -6.846
  302    HA   LEU  38           HA       LEU  38   4.387   8.785  -7.420
  303    HB2  LEU  38           2HB      LEU  38   6.644   9.390  -7.317
  304    HB3  LEU  38           1HB      LEU  38   5.821  10.851  -7.808
  305    HG   LEU  38           HG       LEU  38   7.467  10.360  -5.496
  306   HD11  LEU  38          1HD1      LEU  38   6.342  12.945  -6.521
  307   HD12  LEU  38          2HD1      LEU  38   7.702  12.118  -7.281
  308   HD13  LEU  38          3HD1      LEU  38   7.835  12.687  -5.617
  309   HD21  LEU  38          3HD2      LEU  38   5.905  12.071  -4.198
  310   HD22  LEU  38          1HD2      LEU  38   5.752  10.326  -4.004
  311   HD23  LEU  38          2HD2      LEU  38   4.659  11.193  -5.082
  312    H    ASP  39           H        ASP  39   3.495  10.226  -4.511
  313    HA   ASP  39           HA       ASP  39   4.939   8.500  -2.734
  314    HB2  ASP  39           2HB      ASP  39   2.733  10.504  -2.415
  315    HB3  ASP  39           1HB      ASP  39   3.116   9.403  -1.096
  316    H    VAL  40           H        VAL  40   1.463   8.874  -2.643
  317    HA   VAL  40           HA       VAL  40   0.713   6.475  -1.701
  318    HB   VAL  40           HB       VAL  40  -0.649   8.541  -2.890
  319   HG11  VAL  40          1HG1      VAL  40  -0.265   6.985  -5.018
  320   HG12  VAL  40          2HG1      VAL  40  -1.737   7.930  -4.787
  321   HG13  VAL  40          3HG1      VAL  40  -1.716   6.214  -4.379
  322   HG21  VAL  40          3HG2      VAL  40  -2.286   7.765  -1.583
  323   HG22  VAL  40          1HG2      VAL  40  -1.166   6.476  -1.141
  324   HG23  VAL  40          2HG2      VAL  40  -2.343   6.220  -2.430
  325    H    VAL  41           H        VAL  41   1.840   7.127  -4.949
  326    HA   VAL  41           HA       VAL  41   1.080   4.679  -6.128
  327    HB   VAL  41           HB       VAL  41   3.445   6.378  -6.916
  328   HG11  VAL  41          1HG1      VAL  41   2.632   3.948  -7.886
  329   HG12  VAL  41          2HG1      VAL  41   3.601   5.130  -8.765
  330   HG13  VAL  41          3HG1      VAL  41   1.852   5.081  -8.988
  331   HG21  VAL  41          3HG2      VAL  41   0.903   6.735  -8.346
  332   HG22  VAL  41          1HG2      VAL  41   2.104   7.926  -7.848
  333   HG23  VAL  41          2HG2      VAL  41   0.917   7.334  -6.687
  334    H    GLU  42           H        GLU  42   4.105   5.738  -4.588
  335    HA   GLU  42           HA       GLU  42   5.453   3.284  -5.029
  336    HB2  GLU  42           2HB      GLU  42   5.972   5.732  -3.416
  337    HB3  GLU  42           1HB      GLU  42   6.893   4.281  -3.044
  338    HG2  GLU  42           2HG      GLU  42   7.248   4.307  -5.675
  339    HG3  GLU  42           1HG      GLU  42   6.981   6.031  -5.427
  340    H    VAL  43           H        VAL  43   3.673   4.641  -2.338
  341    HA   VAL  43           HA       VAL  43   4.193   2.585  -0.485
  342    HB   VAL  43           HB       VAL  43   3.315   4.257   0.728
  343   HG11  VAL  43          1HG1      VAL  43   1.724   5.934  -0.166
  344   HG12  VAL  43          2HG1      VAL  43   1.712   5.050  -1.690
  345   HG13  VAL  43          3HG1      VAL  43   3.203   5.794  -1.114
  346   HG21  VAL  43          3HG2      VAL  43   1.687   2.464   1.038
  347   HG22  VAL  43          1HG2      VAL  43   0.722   3.144  -0.264
  348   HG23  VAL  43          2HG2      VAL  43   0.953   4.057   1.219
  349    H    VAL  44           H        VAL  44   1.697   3.060  -2.893
  350    HA   VAL  44           HA       VAL  44  -0.007   0.961  -2.137
  351    HB   VAL  44           HB       VAL  44  -0.774   0.996  -4.529
  352   HG11  VAL  44          1HG1      VAL  44  -1.034   2.952  -2.511
  353   HG12  VAL  44          2HG1      VAL  44  -2.170   2.552  -3.798
  354   HG13  VAL  44          3HG1      VAL  44  -0.949   3.798  -4.056
  355   HG21  VAL  44          3HG2      VAL  44   0.106   2.593  -6.063
  356   HG22  VAL  44          1HG2      VAL  44   1.466   1.656  -5.442
  357   HG23  VAL  44          2HG2      VAL  44   1.162   3.282  -4.830
  358    H    PHE  45           H        PHE  45   2.800   1.067  -4.285
  359    HA   PHE  45           HA       PHE  45   2.602  -1.614  -5.169
  360    HB2  PHE  45           2HB      PHE  45   4.807   0.426  -5.152
  361    HB3  PHE  45           1HB      PHE  45   5.128  -1.232  -5.650
  362    HD1  PHE  45           2HD      PHE  45   3.516  -2.185  -7.472
  363    HD2  PHE  45           1HD      PHE  45   4.129   1.960  -6.727
  364    HE1  PHE  45           2HE      PHE  45   2.710  -1.662  -9.738
  365    HE2  PHE  45           1HE      PHE  45   3.323   2.490  -8.992
  366    HZ   PHE  45           HZ       PHE  45   2.613   0.677 -10.499
  367    H    ALA  46           H        ALA  46   3.836  -0.105  -2.331
  368    HA   ALA  46           HA       ALA  46   5.558  -2.160  -1.443
  369    HB1  ALA  46           1HB      ALA  46   5.365  -1.062   0.764
  370    HB2  ALA  46           2HB      ALA  46   4.113  -0.016   0.095
  371    HB3  ALA  46           3HB      ALA  46   5.757   0.060  -0.539
  372    H    ILE  47           H        ILE  47   2.711  -1.217   0.367
  373    HA   ILE  47           HA       ILE  47   2.244  -3.583   1.656
  374    HB   ILE  47           HB       ILE  47  -0.318  -2.725   1.287
  375   HG12  ILE  47          2HG1      ILE  47   1.072  -0.854  -0.115
  376   HG13  ILE  47          1HG1      ILE  47  -0.478  -0.556   0.664
  377   HG21  ILE  47          1HG2      ILE  47   1.418  -1.249   3.209
  378   HG22  ILE  47          2HG2      ILE  47   1.257  -2.999   3.358
  379   HG23  ILE  47          3HG2      ILE  47  -0.172  -1.972   3.452
  380   HD11  ILE  47          3HD1      ILE  47   0.435   0.981   1.962
  381   HD12  ILE  47          1HD1      ILE  47   1.955   0.762   1.096
  382   HD13  ILE  47          2HD1      ILE  47   1.631  -0.173   2.555
  383    H    GLU  48           H        GLU  48   1.199  -2.658  -1.586
  384    HA   GLU  48           HA       GLU  48  -0.571  -4.735  -2.103
  385    HB2  GLU  48           2HB      GLU  48   1.288  -3.186  -3.893
  386    HB3  GLU  48           1HB      GLU  48   0.233  -4.439  -4.531
  387    HG2  GLU  48           2HG      GLU  48  -0.486  -1.906  -4.482
  388    HG3  GLU  48           1HG      GLU  48  -1.649  -3.208  -4.238
  389    H    GLN  49           H        GLN  49   2.908  -4.621  -2.150
  390    HA   GLN  49           HA       GLN  49   3.342  -7.161  -3.328
  391    HB2  GLN  49           2HB      GLN  49   4.940  -5.038  -2.246
  392    HB3  GLN  49           1HB      GLN  49   5.481  -6.566  -1.564
  393    HG2  GLN  49           2HG      GLN  49   5.904  -7.469  -3.725
  394    HG3  GLN  49           1HG      GLN  49   5.128  -6.096  -4.511
  395   HE21  GLN  49          1HE2      GLN  49   6.241  -4.053  -2.940
  396   HE22  GLN  49          2HE2      GLN  49   7.926  -3.948  -3.304
  397    H    GLU  50           H        GLU  50   2.946  -6.016  -0.019
  398    HA   GLU  50           HA       GLU  50   3.100  -8.755   0.946
  399    HB2  GLU  50           2HB      GLU  50   4.535  -7.165   2.110
  400    HB3  GLU  50           1HB      GLU  50   3.149  -6.142   2.454
  401    HG2  GLU  50           2HG      GLU  50   3.303  -7.208   4.442
  402    HG3  GLU  50           1HG      GLU  50   2.268  -8.360   3.603
  403    H    PHE  51           H        PHE  51   0.837  -7.830  -0.531
  404    HA   PHE  51           HA       PHE  51  -1.218  -8.339   1.442
  405    HB2  PHE  51           2HB      PHE  51  -1.117  -5.969  -0.386
  406    HB3  PHE  51           1HB      PHE  51  -2.663  -6.606   0.162
  407    HD1  PHE  51           2HD      PHE  51  -1.060  -7.453   2.877
  408    HD2  PHE  51           1HD      PHE  51  -1.874  -3.859   0.750
  409    HE1  PHE  51           2HE      PHE  51  -0.840  -6.172   4.965
  410    HE2  PHE  51           1HE      PHE  51  -1.657  -2.571   2.833
  411    HZ   PHE  51           HZ       PHE  51  -1.137  -3.727   4.945
  412    H    ILE  52           H        ILE  52   0.043  -8.853  -1.676
  413    HA   ILE  52           HA       ILE  52  -0.564 -10.246  -3.363
  414    HB   ILE  52           HB       ILE  52  -2.968 -11.335  -2.074
  415   HG12  ILE  52          2HG1      ILE  52  -0.798 -12.561  -0.716
  416   HG13  ILE  52          1HG1      ILE  52  -0.659 -10.823  -0.474
  417   HG21  ILE  52          1HG2      ILE  52  -2.303 -13.263  -3.061
  418   HG22  ILE  52          2HG2      ILE  52  -0.596 -12.977  -2.721
  419   HG23  ILE  52          3HG2      ILE  52  -1.380 -12.142  -4.062
  420   HD11  ILE  52          3HD1      ILE  52  -2.792 -12.695   0.403
  421   HD12  ILE  52          1HD1      ILE  52  -3.203 -11.008   0.091
  422   HD13  ILE  52          2HD1      ILE  52  -1.976 -11.408   1.294
  423    H    LEU  53           H        LEU  53  -1.636  -7.584  -3.234
  424    HA   LEU  53           HA       LEU  53  -3.592  -7.791  -5.274
  425    HB2  LEU  53           2HB      LEU  53  -4.807  -8.148  -2.977
  426    HB3  LEU  53           1HB      LEU  53  -4.656  -6.406  -2.849
  427    HG   LEU  53           HG       LEU  53  -6.181  -6.003  -4.506
  428   HD11  LEU  53          1HD1      LEU  53  -6.698  -7.544  -6.339
  429   HD12  LEU  53          2HD1      LEU  53  -5.560  -8.714  -5.669
  430   HD13  LEU  53          3HD1      LEU  53  -4.977  -7.162  -6.269
  431   HD21  LEU  53          3HD2      LEU  53  -7.585  -8.470  -4.304
  432   HD22  LEU  53          1HD2      LEU  53  -7.931  -6.933  -3.512
  433   HD23  LEU  53          2HD2      LEU  53  -6.862  -8.103  -2.739
  434    H    ASP  54           H        ASP  54  -3.572  -5.998  -6.512
  435    HA   ASP  54           HA       ASP  54  -1.752  -3.902  -5.810
  436    HB2  ASP  54           2HB      ASP  54  -3.498  -4.171  -8.261
  437    HB3  ASP  54           1HB      ASP  54  -2.137  -3.071  -8.067
  438    H    ILE  55           H        ILE  55  -2.221  -1.755  -5.434
  439    HA   ILE  55           HA       ILE  55  -4.987  -1.201  -4.701
  440    HB   ILE  55           HB       ILE  55  -2.369  -0.059  -3.830
  441   HG12  ILE  55          2HG1      ILE  55  -4.855  -1.026  -2.402
  442   HG13  ILE  55          1HG1      ILE  55  -3.312  -1.868  -2.516
  443   HG21  ILE  55          1HG2      ILE  55  -3.791   1.846  -4.536
  444   HG22  ILE  55          2HG2      ILE  55  -3.436   1.837  -2.809
  445   HG23  ILE  55          3HG2      ILE  55  -5.017   1.309  -3.387
  446   HD11  ILE  55          3HD1      ILE  55  -4.034   0.536  -0.901
  447   HD12  ILE  55          1HD1      ILE  55  -2.354   0.211  -1.330
  448   HD13  ILE  55          2HD1      ILE  55  -3.268  -0.969  -0.392
  449    HA   PRO  56           HA       PRO  56  -3.216   2.508  -7.569
  450    HB2  PRO  56           2HB      PRO  56  -2.165   0.513  -9.527
  451    HB3  PRO  56           1HB      PRO  56  -1.579   2.138  -9.152
  452    HG2  PRO  56           2HG      PRO  56  -0.310  -0.008  -8.222
  453    HG3  PRO  56           1HG      PRO  56  -0.492   1.446  -7.224
  454    HD2  PRO  56           2HD      PRO  56  -1.913  -1.165  -7.048
  455    HD3  PRO  56           1HD      PRO  56  -1.460  -0.035  -5.757
  456    H    ASP  57           H        ASP  57  -3.662   2.487 -10.237
  457    HA   ASP  57           HA       ASP  57  -5.298   2.429 -11.815
  458    HB2  ASP  57           2HB      ASP  57  -6.013  -0.196 -10.488
  459    HB3  ASP  57           1HB      ASP  57  -6.589   0.343 -12.062
  460    H    HIS  58           H        HIS  58  -7.821   2.099 -12.039
  461    HA   HIS  58           HA       HIS  58  -9.150   4.023 -10.714
  462    HB2  HIS  58           2HB      HIS  58 -11.084   1.999 -10.927
  463    HB3  HIS  58           1HB      HIS  58 -10.727   3.258 -12.104
  464    HD1  HIS  58           1HD      HIS  58 -10.581   2.213 -14.333
  465    HD2  HIS  58           2HD      HIS  58  -8.856  -0.173 -11.400
  466    HE1  HIS  58           1HE      HIS  58  -9.650   0.218 -15.550
  467    HE2  HIS  58           2HE      HIS  58  -8.683  -1.250 -13.745
  468    H    ASP  59           H        ASP  59  -8.232   0.954  -9.409
  469    HA   ASP  59           HA       ASP  59 -10.023   0.786  -7.253
  470    HB2  ASP  59           2HB      ASP  59  -7.383  -0.403  -7.925
  471    HB3  ASP  59           1HB      ASP  59  -7.882  -0.464  -6.237
  472    H    ALA  60           H        ALA  60  -6.810   2.270  -7.507
  473    HA   ALA  60           HA       ALA  60  -6.777   3.147  -4.795
  474    HB1  ALA  60           1HB      ALA  60  -5.074   4.064  -7.106
  475    HB2  ALA  60           2HB      ALA  60  -4.715   2.696  -6.051
  476    HB3  ALA  60           3HB      ALA  60  -4.747   4.333  -5.393
  477    H    GLU  61           H        GLU  61  -7.967   4.416  -7.772
  478    HA   GLU  61           HA       GLU  61  -8.133   7.137  -6.881
  479    HB2  GLU  61           2HB      GLU  61  -9.296   5.707  -9.270
  480    HB3  GLU  61           1HB      GLU  61  -9.511   7.425  -8.971
  481    HG2  GLU  61           2HG      GLU  61  -6.902   5.998  -9.430
  482    HG3  GLU  61           1HG      GLU  61  -7.732   7.069 -10.557
  483    H    LYS  62           H        LYS  62 -10.144   4.320  -6.773
  484    HA   LYS  62           HA       LYS  62 -12.610   5.669  -6.321
  485    HB2  LYS  62           2HB      LYS  62 -11.645   2.865  -6.221
  486    HB3  LYS  62           1HB      LYS  62 -13.082   3.240  -5.280
  487    HG2  LYS  62           2HG      LYS  62 -14.021   4.265  -7.407
  488    HG3  LYS  62           1HG      LYS  62 -12.684   3.473  -8.244
  489    HD2  LYS  62           2HD      LYS  62 -14.300   1.814  -6.392
  490    HD3  LYS  62           1HD      LYS  62 -15.063   2.310  -7.905
  491    HE2  LYS  62           2HE      LYS  62 -13.900   0.801  -9.050
  492    HE3  LYS  62           1HE      LYS  62 -12.380   1.408  -8.396
  493    HZ1  LYS  62           3HZ      LYS  62 -12.239  -0.313  -7.022
  494    HZ2  LYS  62           1HZ      LYS  62 -13.519  -1.023  -7.872
  495    HZ3  LYS  62           2HZ      LYS  62 -13.828  -0.123  -6.474
  496    H    ILE  63           H        ILE  63  -9.898   5.419  -4.447
  497    HA   ILE  63           HA       ILE  63 -11.398   5.468  -1.937
  498    HB   ILE  63           HB       ILE  63  -9.135   4.044  -2.564
  499   HG12  ILE  63          2HG1      ILE  63  -9.247   4.609   0.274
  500   HG13  ILE  63          1HG1      ILE  63 -10.866   4.407  -0.390
  501   HG21  ILE  63          1HG2      ILE  63  -7.880   6.212  -2.533
  502   HG22  ILE  63          2HG2      ILE  63  -7.270   4.985  -1.423
  503   HG23  ILE  63          3HG2      ILE  63  -8.243   6.322  -0.811
  504   HD11  ILE  63          3HD1      ILE  63  -8.644   2.433  -0.821
  505   HD12  ILE  63          1HD1      ILE  63 -10.360   2.225  -1.167
  506   HD13  ILE  63          2HD1      ILE  63  -9.803   2.331   0.503
  507    H    GLN  64           H        GLN  64 -11.719   7.374  -0.999
  508    HA   GLN  64           HA       GLN  64  -9.884   9.555  -1.610
  509    HB2  GLN  64           2HB      GLN  64 -12.780   9.884  -0.856
  510    HB3  GLN  64           1HB      GLN  64 -11.690  11.114  -1.483
  511    HG2  GLN  64           2HG      GLN  64 -12.588  10.682  -3.466
  512    HG3  GLN  64           1HG      GLN  64 -11.634   9.199  -3.445
  513   HE21  GLN  64          1HE2      GLN  64 -12.669   7.286  -2.527
  514   HE22  GLN  64          2HE2      GLN  64 -14.373   7.084  -2.731
  515    H    SER  65           H        SER  65 -11.133   7.567   0.795
  516    HA   SER  65           HA       SER  65 -10.320   9.462   2.899
  517    HB2  SER  65           2HB      SER  65 -11.931   7.083   3.639
  518    HB3  SER  65           1HB      SER  65 -12.015   8.737   4.245
  519    HG   SER  65           HG       SER  65 -13.849   8.311   3.033
  520    H    ILE  66           H        ILE  66  -9.044   8.715   4.611
  521    HA   ILE  66           HA       ILE  66  -7.028   6.884   3.938
  522    HB   ILE  66           HB       ILE  66  -7.724   7.726   6.746
  523   HG12  ILE  66          2HG1      ILE  66  -7.450   9.546   4.816
  524   HG13  ILE  66          1HG1      ILE  66  -6.797   9.798   6.432
  525   HG21  ILE  66          1HG2      ILE  66  -4.961   7.356   5.697
  526   HG22  ILE  66          2HG2      ILE  66  -5.926   5.934   6.095
  527   HG23  ILE  66          3HG2      ILE  66  -5.584   7.143   7.333
  528   HD11  ILE  66          3HD1      ILE  66  -5.315  10.304   4.401
  529   HD12  ILE  66          1HD1      ILE  66  -5.132   8.554   4.285
  530   HD13  ILE  66          2HD1      ILE  66  -4.620   9.399   5.746
  531    HA   PRO  67           HA       PRO  67  -9.417   4.007   7.201
  532    HB2  PRO  67           2HB      PRO  67 -12.150   4.250   6.659
  533    HB3  PRO  67           1HB      PRO  67 -11.316   4.878   8.083
  534    HG2  PRO  67           2HG      PRO  67 -12.113   6.283   5.578
  535    HG3  PRO  67           1HG      PRO  67 -12.095   6.881   7.246
  536    HD2  PRO  67           2HD      PRO  67 -10.204   7.593   5.494
  537    HD3  PRO  67           1HD      PRO  67  -9.810   7.302   7.201
  538    H    ASP  68           H        ASP  68 -11.872   4.384   4.687
  539    HA   ASP  68           HA       ASP  68 -12.074   1.816   3.872
  540    HB2  ASP  68           2HB      ASP  68 -12.830   4.337   2.814
  541    HB3  ASP  68           1HB      ASP  68 -12.119   3.415   1.492
  542    H    ALA  69           H        ALA  69  -9.383   3.880   3.383
  543    HA   ALA  69           HA       ALA  69  -8.207   2.647   1.143
  544    HB1  ALA  69           1HB      ALA  69  -6.751   4.301   1.378
  545    HB2  ALA  69           2HB      ALA  69  -6.217   3.663   2.934
  546    HB3  ALA  69           3HB      ALA  69  -7.587   4.773   2.857
  547    H    VAL  70           H        VAL  70  -6.656   2.555   4.285
  548    HA   VAL  70           HA       VAL  70  -5.401   0.078   3.803
  549    HB   VAL  70           HB       VAL  70  -4.271   1.432   5.327
  550   HG11  VAL  70          1HG1      VAL  70  -5.288   2.976   6.556
  551   HG12  VAL  70          2HG1      VAL  70  -6.100   1.734   7.510
  552   HG13  VAL  70          3HG1      VAL  70  -6.842   2.330   6.025
  553   HG21  VAL  70          3HG2      VAL  70  -4.068   0.138   7.317
  554   HG22  VAL  70          1HG2      VAL  70  -4.448  -0.976   6.004
  555   HG23  VAL  70          2HG2      VAL  70  -5.705  -0.495   7.144
  556    H    GLU  71           H        GLU  71  -8.540   0.847   4.858
  557    HA   GLU  71           HA       GLU  71  -9.072  -1.388   6.502
  558    HB2  GLU  71           2HB      GLU  71 -10.760   0.585   5.013
  559    HB3  GLU  71           1HB      GLU  71 -11.513  -0.841   5.713
  560    HG2  GLU  71           2HG      GLU  71  -9.910   1.220   7.209
  561    HG3  GLU  71           1HG      GLU  71 -11.667   1.079   7.198
  562    H    TYR  72           H        TYR  72  -9.801  -0.747   3.077
  563    HA   TYR  72           HA       TYR  72 -10.874  -3.296   2.550
  564    HB2  TYR  72           2HB      TYR  72 -11.406  -2.318   0.613
  565    HB3  TYR  72           1HB      TYR  72 -10.506  -0.895   1.128
  566    HD1  TYR  72           1HD      TYR  72  -8.224  -0.515   0.342
  567    HD2  TYR  72           2HD      TYR  72 -10.465  -3.885  -0.968
  568    HE1  TYR  72           1HE      TYR  72  -6.617  -0.866  -1.486
  569    HE2  TYR  72           2HE      TYR  72  -8.864  -4.246  -2.800
  570    HH   TYR  72           HH       TYR  72  -6.340  -1.938  -3.516
  571    H    ILE  73           H        ILE  73  -7.647  -1.966   2.281
  572    HA   ILE  73           HA       ILE  73  -6.463  -4.152   0.962
  573    HB   ILE  73           HB       ILE  73  -4.963  -2.392   2.832
  574   HG12  ILE  73          2HG1      ILE  73  -5.294  -1.560  -0.001
  575   HG13  ILE  73          1HG1      ILE  73  -6.643  -1.258   1.089
  576   HG21  ILE  73          1HG2      ILE  73  -4.189  -3.545   0.166
  577   HG22  ILE  73          2HG2      ILE  73  -3.837  -4.304   1.718
  578   HG23  ILE  73          3HG2      ILE  73  -3.136  -2.735   1.325
  579   HD11  ILE  73          3HD1      ILE  73  -4.388  -0.377   2.463
  580   HD12  ILE  73          1HD1      ILE  73  -5.625   0.611   1.686
  581   HD13  ILE  73          2HD1      ILE  73  -4.167   0.166   0.799
  582    H    ALA  74           H        ALA  74  -6.552  -3.256   4.369
  583    HA   ALA  74           HA       ALA  74  -5.084  -5.366   5.407
  584    HB1  ALA  74           1HB      ALA  74  -6.565  -3.250   6.447
  585    HB2  ALA  74           2HB      ALA  74  -5.552  -4.381   7.345
  586    HB3  ALA  74           3HB      ALA  74  -7.277  -4.700   7.154
  587    H    GLN  75           H        GLN  75  -8.470  -5.187   4.553
  588    HA   GLN  75           HA       GLN  75  -9.073  -7.807   5.528
  589    HB2  GLN  75           2HB      GLN  75 -10.690  -6.007   3.719
  590    HB3  GLN  75           1HB      GLN  75 -11.282  -7.448   4.534
  591    HG2  GLN  75           2HG      GLN  75 -10.677  -4.757   5.630
  592    HG3  GLN  75           1HG      GLN  75 -12.046  -5.824   5.939
  593   HE21  GLN  75          1HE2      GLN  75  -9.723  -4.404   7.505
  594   HE22  GLN  75          2HE2      GLN  75  -9.271  -5.613   8.654
  595    H    ASN  76           H        ASN  76  -7.720  -6.505   2.694
  596    HA   ASN  76           HA       ASN  76  -8.609  -8.359   0.776
  597    HB2  ASN  76           2HB      ASN  76  -6.421  -6.387   0.980
  598    HB3  ASN  76           1HB      ASN  76  -6.130  -7.723  -0.124
  599   HD21  ASN  76          1HD2      ASN  76  -9.254  -6.414   0.608
  600   HD22  ASN  76          2HD2      ASN  76  -9.567  -5.739  -0.951
  601    HA   PRO  77           HA       PRO  77  -4.669 -10.996   1.605
  602    HB2  PRO  77           2HB      PRO  77  -3.381  -9.760   3.941
  603    HB3  PRO  77           1HB      PRO  77  -2.674 -10.243   2.397
  604    HG2  PRO  77           2HG      PRO  77  -3.003  -7.658   3.068
  605    HG3  PRO  77           1HG      PRO  77  -3.148  -8.225   1.394
  606    HD2  PRO  77           2HD      PRO  77  -5.300  -7.545   3.362
  607    HD3  PRO  77           1HD      PRO  77  -5.208  -7.200   1.622
  608    H    MET  78           H        MET  78  -6.103  -9.478   4.466
  609    HA   MET  78           HA       MET  78  -5.873 -11.708   6.178
  610    HB2  MET  78           2HB      MET  78  -6.283  -9.534   7.115
  611    HB3  MET  78           1HB      MET  78  -7.770  -9.360   6.194
  612    HG2  MET  78           2HG      MET  78  -8.719  -9.978   8.128
  613    HG3  MET  78           1HG      MET  78  -8.341 -11.600   7.550
  614    HE1  MET  78           3HE      MET  78  -7.999 -11.246  11.418
  615    HE2  MET  78           1HE      MET  78  -9.057 -10.483  10.230
  616    HE3  MET  78           2HE      MET  78  -7.802  -9.537  11.029
  617    H    ALA  79           H        ALA  79  -7.940 -11.050   3.543
  618    HA   ALA  79           HA       ALA  79  -9.996 -12.879   4.388
  619    HB1  ALA  79           1HB      ALA  79 -10.423 -10.738   3.094
  620    HB2  ALA  79           2HB      ALA  79 -11.233 -12.192   2.512
  621    HB3  ALA  79           3HB      ALA  79  -9.793 -11.595   1.687
  622    H    LYS  80           H        LYS  80  -7.339 -12.745   2.134
  623    HA   LYS  80           HA       LYS  80  -7.944 -15.159   0.778
  624    HB2  LYS  80           2HB      LYS  80  -5.509 -14.993   0.050
  625    HB3  LYS  80           1HB      LYS  80  -6.563 -13.658  -0.396
  626    HG2  LYS  80           2HG      LYS  80  -4.539 -12.703   0.341
  627    HG3  LYS  80           1HG      LYS  80  -5.708 -12.450   1.638
  628    HD2  LYS  80           2HD      LYS  80  -3.761 -13.164   2.728
  629    HD3  LYS  80           1HD      LYS  80  -4.778 -14.603   2.654
  630    HE2  LYS  80           2HE      LYS  80  -3.338 -14.679   0.291
  631    HE3  LYS  80           1HE      LYS  80  -2.169 -14.104   1.481
  632    HZ1  LYS  80           3HZ      LYS  80  -2.843 -16.025   2.888
  633    HZ2  LYS  80           1HZ      LYS  80  -2.081 -16.463   1.442
  634    HZ3  LYS  80           2HZ      LYS  80  -3.759 -16.606   1.591
  635   H282  PNS 101          8H2       PNS 101   1.683  15.806  -9.689
  636   H281  PNS 101          9H2       PNS 101   1.396  15.583 -11.418
  637   H303  PNS 101          0H3       PNS 101   4.366  16.149  -9.115
  638   H302  PNS 101          1H3       PNS 101   3.210  17.212  -9.916
  639   H301  PNS 101          2H3       PNS 101   4.785  16.911 -10.649
  640   H313  PNS 101          3H3       PNS 101   5.142  14.083 -10.544
  641   H312  PNS 101          4H3       PNS 101   3.657  13.182 -10.851
  642   H311  PNS 101          5H3       PNS 101   3.929  13.922  -9.273
  643    H32  PNS 101           6H3      PNS 101   2.733  15.954 -12.567
  644    H33  PNS 101           7H3      PNS 101   5.401  16.372 -12.198
  645    H36  PNS 101           8H3      PNS 101   5.166  13.606 -12.280
  646   H372  PNS 101          9H3       PNS 101   4.304  12.498 -14.874
  647   H371  PNS 101          0H4       PNS 101   5.013  11.528 -13.584
  648   H382  PNS 101          1H4       PNS 101   7.104  12.802 -13.800
  649   H381  PNS 101          2H4       PNS 101   6.667  11.966 -15.289
  650    H41  PNS 101           3H4      PNS 101   6.124  14.915 -13.599
  651   H422  PNS 101          4H4       PNS 101   7.410  16.460 -15.727
  652   H421  PNS 101          5H4       PNS 101   5.855  17.007 -15.099
  653   H431  PNS 101          7H4       PNS 101   7.299  18.244 -13.804
  654   H432  PNS 101          6H4       PNS 101   7.096  16.814 -12.782
  655    H44  PNS 101           8H4      PNS 101   9.399  15.936 -13.749
  Start of MODEL   20
    1    H1   MET   1           1HT      MET   1  -2.269  -9.669  10.711
    2    H2   MET   1           2HT      MET   1  -3.701 -10.520  11.121
    3    H3   MET   1           3HT      MET   1  -2.982  -9.450  12.254
    4    HA   MET   1           HA       MET   1  -4.083  -8.655   9.644
    5    HB2  MET   1           2HB      MET   1  -5.969  -9.294  10.834
    6    HB3  MET   1           1HB      MET   1  -5.251  -8.898  12.389
    7    HG2  MET   1           2HG      MET   1  -6.650  -7.148  12.275
    8    HG3  MET   1           1HG      MET   1  -5.355  -6.448  11.306
    9    HE1  MET   1           2HE      MET   1  -8.515  -5.838  11.539
   10    HE2  MET   1           3HE      MET   1  -9.103  -5.616   9.891
   11    HE3  MET   1           1HE      MET   1  -7.648  -4.777  10.428
   12    H    ASN   2           H        ASN   2  -2.708  -7.804  12.780
   13    HA   ASN   2           HA       ASN   2  -2.766  -5.018  12.494
   14    HB2  ASN   2           2HB      ASN   2  -0.898  -6.802  14.056
   15    HB3  ASN   2           1HB      ASN   2  -0.883  -5.045  14.171
   16   HD21  ASN   2          1HD2      ASN   2  -3.972  -5.644  13.595
   17   HD22  ASN   2          2HD2      ASN   2  -4.577  -5.831  15.202
   18    H    ASP   3           H        ASP   3  -0.576  -7.426  11.275
   19    HA   ASP   3           HA       ASP   3   1.655  -5.934  10.654
   20    HB2  ASP   3           2HB      ASP   3   2.060  -7.555   8.833
   21    HB3  ASP   3           1HB      ASP   3   1.577  -8.347  10.330
   22    H    VAL   4           H        VAL   4  -1.475  -5.856   9.197
   23    HA   VAL   4           HA       VAL   4  -0.747  -4.624   6.751
   24    HB   VAL   4           HB       VAL   4  -3.140  -5.527   7.952
   25   HG11  VAL   4          1HG1      VAL   4  -3.299  -2.667   7.016
   26   HG12  VAL   4          2HG1      VAL   4  -3.635  -3.270   8.639
   27   HG13  VAL   4          3HG1      VAL   4  -4.689  -3.715   7.297
   28   HG21  VAL   4          3HG2      VAL   4  -3.367  -6.180   5.844
   29   HG22  VAL   4          1HG2      VAL   4  -1.986  -5.182   5.388
   30   HG23  VAL   4          2HG2      VAL   4  -3.615  -4.507   5.344
   31    H    LEU   5           H        LEU   5  -2.211  -3.288   9.708
   32    HA   LEU   5           HA       LEU   5  -2.002  -0.595   8.895
   33    HB2  LEU   5           2HB      LEU   5  -2.359  -0.138  11.368
   34    HB3  LEU   5           1HB      LEU   5  -3.615  -1.032  10.533
   35    HG   LEU   5           HG       LEU   5  -2.235  -3.112  11.448
   36   HD11  LEU   5          1HD1      LEU   5  -0.642  -2.602  12.901
   37   HD12  LEU   5          2HD1      LEU   5  -1.863  -1.885  13.953
   38   HD13  LEU   5          3HD1      LEU   5  -1.026  -0.886  12.765
   39   HD21  LEU   5          3HD2      LEU   5  -4.621  -2.503  11.865
   40   HD22  LEU   5          1HD2      LEU   5  -4.075  -1.534  13.234
   41   HD23  LEU   5          2HD2      LEU   5  -3.816  -3.278  13.230
   42    H    THR   6           H        THR   6   0.104  -2.734  10.660
   43    HA   THR   6           HA       THR   6   1.874  -0.845  11.723
   44    HB   THR   6           HB       THR   6   3.305  -3.201  11.001
   45    HG1  THR   6           1HG      THR   6   1.196  -4.050  10.680
   46   HG21  THR   6          3HG2      THR   6   2.169  -2.216  13.595
   47   HG22  THR   6          1HG2      THR   6   3.825  -2.079  13.004
   48   HG23  THR   6          2HG2      THR   6   3.173  -3.660  13.447
   49    H    ARG   7           H        ARG   7   2.266  -2.844   8.837
   50    HA   ARG   7           HA       ARG   7   4.567  -1.419   8.003
   51    HB2  ARG   7           2HB      ARG   7   4.896  -3.196   6.688
   52    HB3  ARG   7           1HB      ARG   7   3.458  -3.892   7.421
   53    HG2  ARG   7           2HG      ARG   7   3.274  -4.034   5.037
   54    HG3  ARG   7           1HG      ARG   7   2.097  -2.861   5.633
   55    HD2  ARG   7           2HD      ARG   7   2.932  -1.388   4.196
   56    HD3  ARG   7           1HD      ARG   7   4.428  -1.400   5.129
   57    HE   ARG   7           HE       ARG   7   3.898  -2.892   2.667
   58   HH11  ARG   7          1HH1      ARG   7   6.085  -1.974   5.216
   59   HH12  ARG   7          2HH1      ARG   7   7.499  -2.514   4.375
   60   HH21  ARG   7          1HH2      ARG   7   5.753  -3.607   1.550
   61   HH22  ARG   7          2HH2      ARG   7   7.311  -3.442   2.290
   62    H    VAL   8           H        VAL   8   1.196  -1.549   6.963
   63    HA   VAL   8           HA       VAL   8   1.483   0.172   4.757
   64    HB   VAL   8           HB       VAL   8  -0.526  -1.384   5.574
   65   HG11  VAL   8          1HG1      VAL   8  -2.422   0.013   6.292
   66   HG12  VAL   8          2HG1      VAL   8  -1.330   1.389   6.443
   67   HG13  VAL   8          3HG1      VAL   8  -1.123  -0.019   7.483
   68   HG21  VAL   8          3HG2      VAL   8  -1.513   0.944   4.078
   69   HG22  VAL   8          1HG2      VAL   8  -1.508  -0.767   3.649
   70   HG23  VAL   8          2HG2      VAL   8  -0.050   0.201   3.433
   71    H    LEU   9           H        LEU   9   0.337   0.767   8.064
   72    HA   LEU   9           HA       LEU   9  -0.027   3.553   7.739
   73    HB2  LEU   9           2HB      LEU   9  -0.676   3.562   9.919
   74    HB3  LEU   9           1HB      LEU   9  -0.832   1.848   9.598
   75    HG   LEU   9           HG       LEU   9   1.588   1.680  10.503
   76   HD11  LEU   9          1HD1      LEU   9   1.562   4.337  10.507
   77   HD12  LEU   9          2HD1      LEU   9   2.495   3.399  11.673
   78   HD13  LEU   9          3HD1      LEU   9   0.926   4.064  12.130
   79   HD21  LEU   9          3HD2      LEU   9   0.680   1.705  12.874
   80   HD22  LEU   9          1HD2      LEU   9  -0.156   0.670  11.717
   81   HD23  LEU   9          2HD2      LEU   9  -0.851   2.226  12.170
   82    H    GLU  10           H        GLU  10   2.642   1.601   8.993
   83    HA   GLU  10           HA       GLU  10   4.270   3.747   9.816
   84    HB2  GLU  10           2HB      GLU  10   6.025   2.144  10.027
   85    HB3  GLU  10           1HB      GLU  10   4.534   1.340  10.498
   86    HG2  GLU  10           2HG      GLU  10   5.121  -0.280   9.103
   87    HG3  GLU  10           1HG      GLU  10   4.704   0.830   7.796
   88    H    VAL  11           H        VAL  11   3.803   2.107   6.802
   89    HA   VAL  11           HA       VAL  11   6.036   2.951   5.396
   90    HB   VAL  11           HB       VAL  11   3.438   1.856   4.746
   91   HG11  VAL  11          1HG1      VAL  11   3.179   3.789   3.378
   92   HG12  VAL  11          2HG1      VAL  11   3.604   2.438   2.328
   93   HG13  VAL  11          3HG1      VAL  11   4.824   3.637   2.761
   94   HG21  VAL  11          3HG2      VAL  11   5.006   0.768   2.962
   95   HG22  VAL  11          1HG2      VAL  11   5.127   0.313   4.662
   96   HG23  VAL  11          2HG2      VAL  11   6.279   1.455   3.970
   97    H    VAL  12           H        VAL  12   2.810   4.393   5.419
   98    HA   VAL  12           HA       VAL  12   3.537   6.663   3.886
   99    HB   VAL  12           HB       VAL  12   1.271   6.349   3.796
  100   HG11  VAL  12          1HG1      VAL  12   1.022   4.606   5.385
  101   HG12  VAL  12          2HG1      VAL  12  -0.127   5.867   5.835
  102   HG13  VAL  12          3HG1      VAL  12   1.382   5.689   6.731
  103   HG21  VAL  12          3HG2      VAL  12   0.151   8.071   5.293
  104   HG22  VAL  12          1HG2      VAL  12   1.467   8.648   4.271
  105   HG23  VAL  12          2HG2      VAL  12   1.748   8.352   5.987
  106    H    LYS  13           H        LYS  13   2.997   6.228   7.378
  107    HA   LYS  13           HA       LYS  13   3.457   8.827   8.208
  108    HB2  LYS  13           2HB      LYS  13   3.737   7.973  10.379
  109    HB3  LYS  13           1HB      LYS  13   2.690   6.809   9.580
  110    HG2  LYS  13           2HG      LYS  13   4.651   5.374   9.163
  111    HG3  LYS  13           1HG      LYS  13   5.650   6.527  10.062
  112    HD2  LYS  13           2HD      LYS  13   3.496   4.699  11.058
  113    HD3  LYS  13           1HD      LYS  13   5.137   4.927  11.666
  114    HE2  LYS  13           2HE      LYS  13   2.879   6.914  11.874
  115    HE3  LYS  13           1HE      LYS  13   3.480   5.894  13.181
  116    HZ1  LYS  13           3HZ      LYS  13   5.175   7.857  11.743
  117    HZ2  LYS  13           1HZ      LYS  13   5.538   7.033  13.175
  118    HZ3  LYS  13           2HZ      LYS  13   4.338   8.224  13.166
  119    H    ASN  14           H        ASN  14   5.828   6.198   7.842
  120    HA   ASN  14           HA       ASN  14   8.011   7.973   8.415
  121    HB2  ASN  14           2HB      ASN  14   8.183   5.144   7.385
  122    HB3  ASN  14           1HB      ASN  14   9.427   6.051   8.239
  123   HD21  ASN  14          1HD2      ASN  14   7.163   3.712   8.559
  124   HD22  ASN  14          2HD2      ASN  14   6.904   3.782  10.265
  125    H    PHE  15           H        PHE  15   6.139   7.488   5.763
  126    HA   PHE  15           HA       PHE  15   8.082   7.391   3.699
  127    HB2  PHE  15           2HB      PHE  15   5.228   7.417   3.890
  128    HB3  PHE  15           1HB      PHE  15   5.727   8.650   2.737
  129    HD1  PHE  15           2HD      PHE  15   8.159   7.354   1.622
  130    HD2  PHE  15           1HD      PHE  15   4.312   5.771   2.520
  131    HE1  PHE  15           2HE      PHE  15   8.477   5.619  -0.094
  132    HE2  PHE  15           1HE      PHE  15   4.623   4.033   0.807
  133    HZ   PHE  15           HZ       PHE  15   6.707   3.955  -0.504
  134    H    GLU  16           H        GLU  16   6.837   9.868   5.705
  135    HA   GLU  16           HA       GLU  16   7.996  11.925   5.964
  136    HB2  GLU  16           2HB      GLU  16   9.325  12.841   4.320
  137    HB3  GLU  16           1HB      GLU  16   9.428  11.138   3.909
  138    HG2  GLU  16           2HG      GLU  16   8.679  11.576   1.885
  139    HG3  GLU  16           1HG      GLU  16   7.188  12.217   2.569
  140    H    LYS  17           H        LYS  17   5.372  10.880   4.209
  141    HA   LYS  17           HA       LYS  17   4.318  13.290   3.203
  142    HB2  LYS  17           2HB      LYS  17   2.750  10.901   4.163
  143    HB3  LYS  17           1HB      LYS  17   2.222  12.111   3.008
  144    HG2  LYS  17           2HG      LYS  17   3.895   9.738   2.632
  145    HG3  LYS  17           1HG      LYS  17   2.840  10.581   1.497
  146    HD2  LYS  17           2HD      LYS  17   5.625  11.379   2.317
  147    HD3  LYS  17           1HD      LYS  17   5.124  10.760   0.741
  148    HE2  LYS  17           2HE      LYS  17   3.616  13.097   1.642
  149    HE3  LYS  17           1HE      LYS  17   5.338  13.406   1.417
  150    HZ1  LYS  17           3HZ      LYS  17   5.101  12.394  -0.828
  151    HZ2  LYS  17           1HZ      LYS  17   4.239  13.837  -0.629
  152    HZ3  LYS  17           2HZ      LYS  17   3.426  12.353  -0.594
  153    H    VAL  18           H        VAL  18   3.734  11.562   6.256
  154    HA   VAL  18           HA       VAL  18   3.564  13.820   7.859
  155    HB   VAL  18           HB       VAL  18   0.887  13.397   8.168
  156   HG11  VAL  18          1HG1      VAL  18   2.302  15.528   7.952
  157   HG12  VAL  18          2HG1      VAL  18   0.619  15.595   7.432
  158   HG13  VAL  18          3HG1      VAL  18   1.906  15.452   6.235
  159   HG21  VAL  18          3HG2      VAL  18  -0.229  13.111   6.177
  160   HG22  VAL  18          1HG2      VAL  18   1.158  12.048   5.940
  161   HG23  VAL  18          2HG2      VAL  18   1.140  13.653   5.207
  162    H    ASP  19           H        ASP  19   2.990  13.344  10.036
  163    HA   ASP  19           HA       ASP  19   3.562  10.698  10.825
  164    HB2  ASP  19           2HB      ASP  19   2.289  12.826  12.547
  165    HB3  ASP  19           1HB      ASP  19   3.272  11.465  13.076
  166    H    ALA  20           H        ALA  20   2.251   9.004  10.763
  167    HA   ALA  20           HA       ALA  20  -0.456   9.065  10.143
  168    HB1  ALA  20           1HB      ALA  20  -0.037   6.716  11.616
  169    HB2  ALA  20           2HB      ALA  20   1.493   7.075  10.817
  170    HB3  ALA  20           3HB      ALA  20   0.016   6.916   9.865
  171    H    SER  21           H        SER  21   1.043   9.844  13.075
  172    HA   SER  21           HA       SER  21  -0.916   8.980  14.908
  173    HB2  SER  21           2HB      SER  21   0.111  10.745  16.410
  174    HB3  SER  21           1HB      SER  21   1.236   9.550  15.767
  175    HG   SER  21           HG       SER  21   1.563  12.070  15.621
  176    H    LYS  22           H        LYS  22  -0.885  11.556  12.655
  177    HA   LYS  22           HA       LYS  22  -2.939  13.044  14.068
  178    HB2  LYS  22           2HB      LYS  22  -2.800  14.464  11.886
  179    HB3  LYS  22           1HB      LYS  22  -1.504  14.562  13.069
  180    HG2  LYS  22           2HG      LYS  22  -0.763  14.412  10.693
  181    HG3  LYS  22           1HG      LYS  22  -0.093  13.178  11.759
  182    HD2  LYS  22           2HD      LYS  22  -0.726  12.047   9.783
  183    HD3  LYS  22           1HD      LYS  22  -1.974  11.672  10.973
  184    HE2  LYS  22           2HE      LYS  22  -2.781  14.037   9.674
  185    HE3  LYS  22           1HE      LYS  22  -2.230  12.934   8.413
  186    HZ1  LYS  22           3HZ      LYS  22  -4.325  12.173   8.594
  187    HZ2  LYS  22           1HZ      LYS  22  -4.528  12.734  10.177
  188    HZ3  LYS  22           2HZ      LYS  22  -3.698  11.288   9.892
  189    H    VAL  23           H        VAL  23  -3.003  10.312  12.491
  190    HA   VAL  23           HA       VAL  23  -5.190  10.836  10.672
  191    HB   VAL  23           HB       VAL  23  -3.193   8.821  10.901
  192   HG11  VAL  23          1HG1      VAL  23  -4.785   6.873  10.370
  193   HG12  VAL  23          2HG1      VAL  23  -6.011   7.846  11.183
  194   HG13  VAL  23          3HG1      VAL  23  -4.563   7.339  12.056
  195   HG21  VAL  23          3HG2      VAL  23  -4.098   8.195   8.648
  196   HG22  VAL  23          1HG2      VAL  23  -3.682   9.899   8.838
  197   HG23  VAL  23          2HG2      VAL  23  -5.370   9.390   8.901
  198    H    THR  24           H        THR  24  -7.264  10.674  11.220
  199    HA   THR  24           HA       THR  24  -7.946   9.330  13.709
  200    HB   THR  24           HB       THR  24  -8.589  11.891  12.772
  201    HG1  THR  24           1HG      THR  24  -9.320  12.089  14.773
  202   HG21  THR  24          3HG2      THR  24 -11.163  10.429  13.143
  203   HG22  THR  24          1HG2      THR  24 -10.456  10.605  11.538
  204   HG23  THR  24          2HG2      THR  24 -10.870  12.037  12.480
  205    HA   PRO  25           HA       PRO  25 -10.542   6.295  11.879
  206    HB2  PRO  25           2HB      PRO  25 -13.043   6.792  12.949
  207    HB3  PRO  25           1HB      PRO  25 -11.757   5.899  13.765
  208    HG2  PRO  25           2HG      PRO  25 -12.569   8.759  14.070
  209    HG3  PRO  25           1HG      PRO  25 -12.068   7.596  15.311
  210    HD2  PRO  25           2HD      PRO  25 -10.397   9.489  14.407
  211    HD3  PRO  25           1HD      PRO  25  -9.814   7.865  14.829
  212    H    GLU  26           H        GLU  26 -11.936   9.542  11.853
  213    HA   GLU  26           HA       GLU  26 -13.306   8.920   9.350
  214    HB2  GLU  26           2HB      GLU  26 -13.766  10.919  11.514
  215    HB3  GLU  26           1HB      GLU  26 -14.284  11.321   9.883
  216    HG2  GLU  26           2HG      GLU  26 -15.558   9.161   9.862
  217    HG3  GLU  26           1HG      GLU  26 -15.184   9.010  11.579
  218    H    SER  27           H        SER  27 -10.382   9.751  10.040
  219    HA   SER  27           HA       SER  27  -9.903  12.255   8.863
  220    HB2  SER  27           2HB      SER  27  -8.015  11.633   9.964
  221    HB3  SER  27           1HB      SER  27  -8.278   9.918   9.654
  222    HG   SER  27           HG       SER  27  -7.007  11.845   8.062
  223    H    HIS  28           H        HIS  28  -9.697  12.914   6.809
  224    HA   HIS  28           HA       HIS  28 -10.458  11.129   4.707
  225    HB2  HIS  28           2HB      HIS  28 -10.338  13.987   5.108
  226    HB3  HIS  28           1HB      HIS  28  -9.623  13.546   3.561
  227    HD1  HIS  28           1HD      HIS  28 -12.833  12.826   5.479
  228    HD2  HIS  28           2HD      HIS  28 -11.454  13.301   1.588
  229    HE1  HIS  28           1HE      HIS  28 -14.877  12.688   4.020
  230    HE2  HIS  28           2HE      HIS  28 -14.028  13.064   1.677
  231    H    PHE  29           H        PHE  29  -9.224  10.598   2.866
  232    HA   PHE  29           HA       PHE  29  -6.503  10.043   3.384
  233    HB2  PHE  29           2HB      PHE  29  -8.283   8.932   1.744
  234    HB3  PHE  29           1HB      PHE  29  -7.517  10.013   0.584
  235    HD1  PHE  29           2HD      PHE  29  -4.740   9.859   1.937
  236    HD2  PHE  29           1HD      PHE  29  -7.550   6.915   0.694
  237    HE1  PHE  29           2HE      PHE  29  -2.909   8.242   1.641
  238    HE2  PHE  29           1HE      PHE  29  -5.723   5.293   0.396
  239    HZ   PHE  29           HZ       PHE  29  -3.400   5.956   0.869
  240    H    VAL  30           H        VAL  30  -5.951  10.728   0.399
  241    HA   VAL  30           HA       VAL  30  -4.146  12.681   0.596
  242    HB   VAL  30           HB       VAL  30  -5.859  13.136  -1.749
  243   HG11  VAL  30          1HG1      VAL  30  -3.518  12.351  -2.735
  244   HG12  VAL  30          2HG1      VAL  30  -2.989  12.757  -1.102
  245   HG13  VAL  30          3HG1      VAL  30  -3.775  13.977  -2.103
  246   HG21  VAL  30          3HG2      VAL  30  -4.798  10.395  -1.096
  247   HG22  VAL  30          1HG2      VAL  30  -5.195  10.911  -2.735
  248   HG23  VAL  30          2HG2      VAL  30  -6.453  10.853  -1.500
  249    H    LYS  31           H        LYS  31  -7.579  13.151   0.640
  250    HA   LYS  31           HA       LYS  31  -7.665  15.933   0.258
  251    HB2  LYS  31           2HB      LYS  31  -9.560  14.222   1.876
  252    HB3  LYS  31           1HB      LYS  31  -9.897  15.828   1.245
  253    HG2  LYS  31           2HG      LYS  31  -9.842  13.218  -0.138
  254    HG3  LYS  31           1HG      LYS  31 -10.906  14.607  -0.368
  255    HD2  LYS  31           2HD      LYS  31  -8.060  14.321  -1.325
  256    HD3  LYS  31           1HD      LYS  31  -9.517  14.345  -2.320
  257    HE2  LYS  31           2HE      LYS  31  -9.206  16.665  -0.554
  258    HE3  LYS  31           1HE      LYS  31  -7.952  16.510  -1.785
  259    HZ1  LYS  31           3HZ      LYS  31 -10.817  17.009  -2.098
  260    HZ2  LYS  31           1HZ      LYS  31 -10.045  16.097  -3.298
  261    HZ3  LYS  31           2HZ      LYS  31  -9.508  17.661  -2.948
  262    H    ASP  32           H        ASP  32  -7.479  13.995   3.222
  263    HA   ASP  32           HA       ASP  32  -7.269  16.354   4.856
  264    HB2  ASP  32           2HB      ASP  32  -8.419  14.048   5.415
  265    HB3  ASP  32           1HB      ASP  32  -6.793  13.610   5.930
  266    H    LEU  33           H        LEU  33  -5.184  15.154   2.847
  267    HA   LEU  33           HA       LEU  33  -2.922  15.857   2.809
  268    HB2  LEU  33           2HB      LEU  33  -3.400  16.589   5.316
  269    HB3  LEU  33           1HB      LEU  33  -2.512  15.116   5.638
  270    HG   LEU  33           HG       LEU  33  -1.360  17.162   3.789
  271   HD11  LEU  33          1HD1      LEU  33  -0.127  17.794   6.074
  272   HD12  LEU  33          2HD1      LEU  33  -1.722  17.392   6.712
  273   HD13  LEU  33          3HD1      LEU  33  -1.554  18.647   5.483
  274   HD21  LEU  33          3HD2      LEU  33  -0.219  15.066   3.852
  275   HD22  LEU  33          1HD2      LEU  33  -0.233  15.050   5.616
  276   HD23  LEU  33          2HD2      LEU  33   0.750  16.233   4.754
  277    H    GLY  34           H        GLY  34  -4.113  13.445   2.138
  278    HA2  GLY  34           2HA      GLY  34  -2.826  11.209   3.334
  279    HA3  GLY  34           1HA      GLY  34  -3.669  11.216   1.794
  280    H    LEU  35           H        LEU  35  -1.838   9.672   1.361
  281    HA   LEU  35           HA       LEU  35   0.811  10.610   1.102
  282    HB2  LEU  35           2HB      LEU  35  -0.135   8.459  -0.703
  283    HB3  LEU  35           1HB      LEU  35   1.306   8.535   0.290
  284    HG   LEU  35           HG       LEU  35  -1.417   7.564   0.979
  285   HD11  LEU  35          1HD1      LEU  35   1.411   6.697   1.291
  286   HD12  LEU  35          2HD1      LEU  35   0.011   5.799   0.704
  287   HD13  LEU  35          3HD1      LEU  35   0.207   6.096   2.431
  288   HD21  LEU  35          3HD2      LEU  35  -1.547   8.784   2.838
  289   HD22  LEU  35          1HD2      LEU  35   0.094   9.398   2.642
  290   HD23  LEU  35          2HD2      LEU  35  -0.177   7.846   3.433
  291    H    ASN  36           H        ASN  36   1.803  11.735  -0.457
  292    HA   ASN  36           HA       ASN  36   0.338  13.079  -2.444
  293    HB2  ASN  36           2HB      ASN  36   2.592  13.717  -1.360
  294    HB3  ASN  36           1HB      ASN  36   3.317  12.667  -2.575
  295   HD21  ASN  36          1HD2      ASN  36   3.689  13.462  -4.535
  296   HD22  ASN  36          2HD2      ASN  36   3.139  14.993  -5.112
  297    H    SER  37           H        SER  37   1.584  13.014  -4.799
  298    HA   SER  37           HA       SER  37   0.587  10.687  -6.029
  299    HB2  SER  37           2HB      SER  37   1.590  13.188  -6.873
  300    HB3  SER  37           1HB      SER  37   2.556  11.959  -7.688
  301    H    LEU  38           H        LEU  38   3.932  11.803  -5.794
  302    HA   LEU  38           HA       LEU  38   5.131   9.442  -6.674
  303    HB2  LEU  38           2HB      LEU  38   7.172  10.364  -6.013
  304    HB3  LEU  38           1HB      LEU  38   6.169  11.754  -6.378
  305    HG   LEU  38           HG       LEU  38   7.475  12.151  -4.370
  306   HD11  LEU  38          1HD1      LEU  38   5.439  12.391  -2.745
  307   HD12  LEU  38          2HD1      LEU  38   4.511  11.926  -4.170
  308   HD13  LEU  38          3HD1      LEU  38   5.534  13.362  -4.213
  309   HD21  LEU  38          3HD2      LEU  38   7.060   9.474  -3.847
  310   HD22  LEU  38          1HD2      LEU  38   6.076  10.292  -2.633
  311   HD23  LEU  38          2HD2      LEU  38   7.798  10.648  -2.757
  312    H    ASP  39           H        ASP  39   3.979  10.402  -3.541
  313    HA   ASP  39           HA       ASP  39   5.259   8.322  -2.078
  314    HB2  ASP  39           2HB      ASP  39   4.341  10.522  -1.152
  315    HB3  ASP  39           1HB      ASP  39   2.757   9.758  -1.216
  316    H    VAL  40           H        VAL  40   1.769   8.761  -2.284
  317    HA   VAL  40           HA       VAL  40   0.817   6.370  -1.679
  318    HB   VAL  40           HB       VAL  40  -0.167   8.487  -3.263
  319   HG11  VAL  40          1HG1      VAL  40   0.285   6.729  -5.116
  320   HG12  VAL  40          2HG1      VAL  40  -1.273   7.555  -5.073
  321   HG13  VAL  40          3HG1      VAL  40  -1.127   5.912  -4.446
  322   HG21  VAL  40          3HG2      VAL  40  -1.580   8.025  -1.575
  323   HG22  VAL  40          1HG2      VAL  40  -1.190   6.304  -1.583
  324   HG23  VAL  40          2HG2      VAL  40  -2.340   6.954  -2.751
  325    H    VAL  41           H        VAL  41   2.378   7.088  -4.768
  326    HA   VAL  41           HA       VAL  41   1.878   4.597  -5.985
  327    HB   VAL  41           HB       VAL  41   3.692   5.157  -7.535
  328   HG11  VAL  41          1HG1      VAL  41   1.332   6.600  -7.102
  329   HG12  VAL  41          2HG1      VAL  41   2.259   6.480  -8.597
  330   HG13  VAL  41          3HG1      VAL  41   2.571   7.801  -7.470
  331   HG21  VAL  41          3HG2      VAL  41   5.108   7.025  -7.270
  332   HG22  VAL  41          1HG2      VAL  41   5.137   6.183  -5.720
  333   HG23  VAL  41          2HG2      VAL  41   4.167   7.642  -5.913
  334    H    GLU  42           H        GLU  42   4.648   5.800  -4.110
  335    HA   GLU  42           HA       GLU  42   6.190   3.450  -4.349
  336    HB2  GLU  42           2HB      GLU  42   6.249   5.855  -2.594
  337    HB3  GLU  42           1HB      GLU  42   7.183   4.448  -2.099
  338    HG2  GLU  42           2HG      GLU  42   7.984   4.605  -4.636
  339    HG3  GLU  42           1HG      GLU  42   7.591   6.303  -4.362
  340    H    VAL  43           H        VAL  43   3.823   4.534  -2.025
  341    HA   VAL  43           HA       VAL  43   4.167   2.435  -0.167
  342    HB   VAL  43           HB       VAL  43   2.904   3.855   0.996
  343   HG11  VAL  43          1HG1      VAL  43   1.508   5.637  -0.185
  344   HG12  VAL  43          2HG1      VAL  43   2.221   5.025  -1.675
  345   HG13  VAL  43          3HG1      VAL  43   3.255   5.690  -0.411
  346   HG21  VAL  43          3HG2      VAL  43   1.208   2.208   0.777
  347   HG22  VAL  43          1HG2      VAL  43   0.753   2.827  -0.805
  348   HG23  VAL  43          2HG2      VAL  43   0.438   3.790   0.633
  349    H    VAL  44           H        VAL  44   2.122   2.887  -2.972
  350    HA   VAL  44           HA       VAL  44   0.433   0.678  -2.646
  351    HB   VAL  44           HB       VAL  44  -0.040   0.810  -5.001
  352   HG11  VAL  44          1HG1      VAL  44   0.188   3.613  -4.937
  353   HG12  VAL  44          2HG1      VAL  44  -0.056   3.085  -3.272
  354   HG13  VAL  44          3HG1      VAL  44  -1.214   2.628  -4.523
  355   HG21  VAL  44          3HG2      VAL  44   1.443   1.371  -6.565
  356   HG22  VAL  44          1HG2      VAL  44   2.651   1.399  -5.281
  357   HG23  VAL  44          2HG2      VAL  44   1.833   2.887  -5.753
  358    H    PHE  45           H        PHE  45   3.677   0.983  -3.944
  359    HA   PHE  45           HA       PHE  45   3.844  -1.666  -4.963
  360    HB2  PHE  45           2HB      PHE  45   5.502   0.661  -4.886
  361    HB3  PHE  45           1HB      PHE  45   6.434  -0.709  -4.294
  362    HD1  PHE  45           1HD      PHE  45   6.701  -2.717  -5.725
  363    HD2  PHE  45           2HD      PHE  45   4.974   0.890  -7.172
  364    HE1  PHE  45           1HE      PHE  45   7.091  -3.465  -8.039
  365    HE2  PHE  45           2HE      PHE  45   5.358   0.152  -9.488
  366    HZ   PHE  45           HZ       PHE  45   6.418  -2.029  -9.924
  367    H    ALA  46           H        ALA  46   4.646  -0.103  -1.949
  368    HA   ALA  46           HA       ALA  46   6.024  -2.221  -0.726
  369    HB1  ALA  46           1HB      ALA  46   4.625   0.211   0.270
  370    HB2  ALA  46           2HB      ALA  46   6.330  -0.226   0.377
  371    HB3  ALA  46           3HB      ALA  46   5.151  -1.019   1.421
  372    H    ILE  47           H        ILE  47   2.713  -1.130  -0.154
  373    HA   ILE  47           HA       ILE  47   1.898  -3.344   1.351
  374    HB   ILE  47           HB       ILE  47  -0.451  -2.654   0.588
  375   HG12  ILE  47          2HG1      ILE  47   1.258  -0.848  -1.011
  376   HG13  ILE  47          1HG1      ILE  47  -0.369  -1.434  -1.331
  377   HG21  ILE  47          1HG2      ILE  47   1.280  -1.663   2.504
  378   HG22  ILE  47          2HG2      ILE  47  -0.465  -1.419   2.440
  379   HG23  ILE  47          3HG2      ILE  47   0.620  -0.220   1.736
  380   HD11  ILE  47          3HD1      ILE  47  -1.196   0.512  -0.718
  381   HD12  ILE  47          1HD1      ILE  47   0.435   1.100  -0.401
  382   HD13  ILE  47          2HD1      ILE  47  -0.487   0.327   0.887
  383    H    GLU  48           H        GLU  48   2.093  -2.828  -2.097
  384    HA   GLU  48           HA       GLU  48   0.412  -4.837  -3.019
  385    HB2  GLU  48           2HB      GLU  48   2.572  -3.234  -4.092
  386    HB3  GLU  48           1HB      GLU  48   2.621  -4.869  -4.738
  387    HG2  GLU  48           2HG      GLU  48   0.299  -4.653  -5.462
  388    HG3  GLU  48           1HG      GLU  48   0.250  -3.013  -4.815
  389    H    GLN  49           H        GLN  49   3.657  -4.977  -1.759
  390    HA   GLN  49           HA       GLN  49   4.068  -7.735  -2.395
  391    HB2  GLN  49           2HB      GLN  49   5.595  -6.273  -0.268
  392    HB3  GLN  49           1HB      GLN  49   6.157  -7.524  -1.370
  393    HG2  GLN  49           2HG      GLN  49   5.319  -4.826  -2.364
  394    HG3  GLN  49           1HG      GLN  49   6.947  -5.127  -1.758
  395   HE21  GLN  49          1HE2      GLN  49   6.733  -4.297  -4.278
  396   HE22  GLN  49          2HE2      GLN  49   7.044  -5.581  -5.391
  397    H    GLU  50           H        GLU  50   3.062  -5.909   0.453
  398    HA   GLU  50           HA       GLU  50   2.681  -8.387   1.918
  399    HB2  GLU  50           2HB      GLU  50   2.850  -7.203   3.879
  400    HB3  GLU  50           1HB      GLU  50   3.863  -6.227   2.825
  401    HG2  GLU  50           2HG      GLU  50   2.578  -4.455   3.127
  402    HG3  GLU  50           1HG      GLU  50   1.138  -5.353   2.651
  403    H    PHE  51           H        PHE  51   0.908  -7.757  -0.226
  404    HA   PHE  51           HA       PHE  51  -1.584  -7.941   1.189
  405    HB2  PHE  51           2HB      PHE  51  -0.881  -5.582  -0.501
  406    HB3  PHE  51           1HB      PHE  51  -2.541  -6.160  -0.494
  407    HD1  PHE  51           2HD      PHE  51  -3.742  -6.316   1.726
  408    HD2  PHE  51           1HD      PHE  51  -0.069  -4.229   1.212
  409    HE1  PHE  51           2HE      PHE  51  -4.173  -5.052   3.795
  410    HE2  PHE  51           1HE      PHE  51  -0.493  -2.962   3.278
  411    HZ   PHE  51           HZ       PHE  51  -2.547  -3.372   4.571
  412    H    ILE  52           H        ILE  52   0.206  -8.028  -1.822
  413    HA   ILE  52           HA       ILE  52  -0.024  -9.314  -3.686
  414    HB   ILE  52           HB       ILE  52  -2.208 -10.836  -2.291
  415   HG12  ILE  52          2HG1      ILE  52   0.123 -12.259  -1.877
  416   HG13  ILE  52          1HG1      ILE  52   0.597 -10.592  -1.573
  417   HG21  ILE  52          1HG2      ILE  52  -1.596 -11.176  -4.755
  418   HG22  ILE  52          2HG2      ILE  52  -1.676 -12.603  -3.722
  419   HG23  ILE  52          3HG2      ILE  52  -0.112 -11.907  -4.144
  420   HD11  ILE  52          3HD1      ILE  52  -1.542 -12.175  -0.194
  421   HD12  ILE  52          1HD1      ILE  52  -1.367 -10.428  -0.022
  422   HD13  ILE  52          2HD1      ILE  52  -0.066 -11.500   0.496
  423    H    LEU  53           H        LEU  53  -1.373  -6.915  -3.615
  424    HA   LEU  53           HA       LEU  53  -3.302  -7.296  -5.661
  425    HB2  LEU  53           2HB      LEU  53  -4.470  -7.677  -3.329
  426    HB3  LEU  53           1HB      LEU  53  -4.458  -5.925  -3.276
  427    HG   LEU  53           HG       LEU  53  -6.088  -5.727  -4.833
  428   HD11  LEU  53          1HD1      LEU  53  -6.386  -7.523  -6.655
  429   HD12  LEU  53          2HD1      LEU  53  -4.789  -8.078  -6.152
  430   HD13  LEU  53          3HD1      LEU  53  -5.001  -6.435  -6.758
  431   HD21  LEU  53          3HD2      LEU  53  -7.299  -8.200  -4.870
  432   HD22  LEU  53          1HD2      LEU  53  -7.554  -6.938  -3.667
  433   HD23  LEU  53          2HD2      LEU  53  -6.382  -8.220  -3.364
  434    H    ASP  54           H        ASP  54  -3.553  -5.462  -6.876
  435    HA   ASP  54           HA       ASP  54  -1.760  -3.307  -6.311
  436    HB2  ASP  54           2HB      ASP  54  -3.749  -3.472  -8.572
  437    HB3  ASP  54           1HB      ASP  54  -2.280  -2.503  -8.505
  438    H    ILE  55           H        ILE  55  -2.254  -1.191  -5.850
  439    HA   ILE  55           HA       ILE  55  -4.985  -0.710  -4.927
  440    HB   ILE  55           HB       ILE  55  -2.522   0.849  -4.169
  441   HG12  ILE  55          2HG1      ILE  55  -1.938  -0.971  -2.978
  442   HG13  ILE  55          1HG1      ILE  55  -3.302  -0.577  -1.939
  443   HG21  ILE  55          1HG2      ILE  55  -4.672   2.016  -3.912
  444   HG22  ILE  55          2HG2      ILE  55  -3.891   1.703  -2.362
  445   HG23  ILE  55          3HG2      ILE  55  -5.246   0.702  -2.885
  446   HD11  ILE  55          3HD1      ILE  55  -4.574  -1.996  -3.815
  447   HD12  ILE  55          1HD1      ILE  55  -3.850  -2.715  -2.376
  448   HD13  ILE  55          2HD1      ILE  55  -2.979  -2.741  -3.909
  449    HA   PRO  56           HA       PRO  56  -3.315   3.256  -7.460
  450    HB2  PRO  56           2HB      PRO  56  -2.107   1.526  -9.571
  451    HB3  PRO  56           1HB      PRO  56  -1.607   3.124  -9.003
  452    HG2  PRO  56           2HG      PRO  56  -0.267   0.950  -8.264
  453    HG3  PRO  56           1HG      PRO  56  -0.558   2.270  -7.115
  454    HD2  PRO  56           2HD      PRO  56  -1.877  -0.399  -7.315
  455    HD3  PRO  56           1HD      PRO  56  -1.488   0.564  -5.875
  456    H    ASP  57           H        ASP  57  -3.690   3.489 -10.121
  457    HA   ASP  57           HA       ASP  57  -5.291   3.528 -11.735
  458    HB2  ASP  57           2HB      ASP  57  -6.557   0.973 -11.240
  459    HB3  ASP  57           1HB      ASP  57  -5.601   1.495 -12.625
  460    H    HIS  58           H        HIS  58  -7.821   2.822 -12.014
  461    HA   HIS  58           HA       HIS  58  -9.335   4.551 -10.596
  462    HB2  HIS  58           2HB      HIS  58 -10.051   1.886 -11.790
  463    HB3  HIS  58           1HB      HIS  58 -11.269   2.871 -10.988
  464    HD1  HIS  58           1HD      HIS  58 -12.476   4.412 -12.490
  465    HD2  HIS  58           2HD      HIS  58  -8.698   3.482 -13.949
  466    HE1  HIS  58           1HE      HIS  58 -12.315   5.563 -14.720
  467    HE2  HIS  58           2HE      HIS  58  -9.989   5.057 -15.544
  468    H    ASP  59           H        ASP  59  -8.015   1.601  -9.424
  469    HA   ASP  59           HA       ASP  59  -9.796   1.145  -7.276
  470    HB2  ASP  59           2HB      ASP  59  -7.044   0.211  -7.980
  471    HB3  ASP  59           1HB      ASP  59  -7.655  -0.083  -6.354
  472    H    ALA  60           H        ALA  60  -6.690   2.843  -7.510
  473    HA   ALA  60           HA       ALA  60  -6.611   3.549  -4.755
  474    HB1  ALA  60           1HB      ALA  60  -5.119   4.884  -7.002
  475    HB2  ALA  60           2HB      ALA  60  -4.615   3.368  -6.254
  476    HB3  ALA  60           3HB      ALA  60  -4.686   4.845  -5.293
  477    H    GLU  61           H        GLU  61  -8.149   4.860  -7.528
  478    HA   GLU  61           HA       GLU  61  -8.453   7.514  -6.483
  479    HB2  GLU  61           2HB      GLU  61 -10.090   6.330  -8.709
  480    HB3  GLU  61           1HB      GLU  61  -9.639   8.011  -8.458
  481    HG2  GLU  61           2HG      GLU  61  -7.550   5.937  -8.967
  482    HG3  GLU  61           1HG      GLU  61  -8.460   6.647 -10.298
  483    H    LYS  62           H        LYS  62 -10.219   4.531  -6.384
  484    HA   LYS  62           HA       LYS  62 -12.726   5.642  -5.618
  485    HB2  LYS  62           2HB      LYS  62 -11.565   2.868  -5.518
  486    HB3  LYS  62           1HB      LYS  62 -13.155   3.226  -4.857
  487    HG2  LYS  62           2HG      LYS  62 -12.240   3.161  -7.681
  488    HG3  LYS  62           1HG      LYS  62 -13.725   2.542  -6.955
  489    HD2  LYS  62           2HD      LYS  62 -14.133   5.134  -6.527
  490    HD3  LYS  62           1HD      LYS  62 -13.075   5.268  -7.932
  491    HE2  LYS  62           2HE      LYS  62 -14.635   3.526  -9.007
  492    HE3  LYS  62           1HE      LYS  62 -15.756   3.942  -7.712
  493    HZ1  LYS  62           3HZ      LYS  62 -15.704   5.202 -10.036
  494    HZ2  LYS  62           1HZ      LYS  62 -14.603   6.169  -9.188
  495    HZ3  LYS  62           2HZ      LYS  62 -16.174   5.959  -8.598
  496    H    ILE  63           H        ILE  63 -10.025   6.021  -4.049
  497    HA   ILE  63           HA       ILE  63 -11.073   5.367  -1.400
  498    HB   ILE  63           HB       ILE  63  -8.567   4.904  -2.440
  499   HG12  ILE  63          2HG1      ILE  63  -8.473   5.144   0.443
  500   HG13  ILE  63          1HG1      ILE  63  -9.997   4.430  -0.077
  501   HG21  ILE  63          1HG2      ILE  63  -8.488   7.376  -0.726
  502   HG22  ILE  63          2HG2      ILE  63  -7.884   7.182  -2.372
  503   HG23  ILE  63          3HG2      ILE  63  -7.082   6.356  -1.036
  504   HD11  ILE  63          3HD1      ILE  63  -8.859   2.513  -0.042
  505   HD12  ILE  63          1HD1      ILE  63  -7.296   3.326  -0.097
  506   HD13  ILE  63          2HD1      ILE  63  -8.201   3.055  -1.586
  507    H    GLN  64           H        GLN  64 -11.891   6.969  -0.222
  508    HA   GLN  64           HA       GLN  64 -11.111   9.703  -0.858
  509    HB2  GLN  64           2HB      GLN  64 -13.673   8.747   0.416
  510    HB3  GLN  64           1HB      GLN  64 -13.285  10.412   0.003
  511    HG2  GLN  64           2HG      GLN  64 -14.376  10.010  -1.892
  512    HG3  GLN  64           1HG      GLN  64 -12.928   9.130  -2.382
  513   HE21  GLN  64          1HE2      GLN  64 -12.880   6.810  -1.765
  514   HE22  GLN  64          2HE2      GLN  64 -14.357   5.920  -1.871
  515    H    SER  65           H        SER  65 -11.866   7.485   1.782
  516    HA   SER  65           HA       SER  65 -10.515   9.336   3.633
  517    HB2  SER  65           2HB      SER  65 -12.341   7.161   4.591
  518    HB3  SER  65           1HB      SER  65 -11.946   8.701   5.352
  519    HG   SER  65           HG       SER  65 -14.073   8.209   4.000
  520    H    ILE  66           H        ILE  66  -9.346   8.289   5.430
  521    HA   ILE  66           HA       ILE  66  -7.466   6.427   4.477
  522    HB   ILE  66           HB       ILE  66  -7.973   6.917   7.399
  523   HG12  ILE  66          2HG1      ILE  66  -7.802   8.999   5.693
  524   HG13  ILE  66          1HG1      ILE  66  -7.155   9.040   7.330
  525   HG21  ILE  66          1HG2      ILE  66  -6.166   5.627   7.542
  526   HG22  ILE  66          2HG2      ILE  66  -5.259   6.972   6.850
  527   HG23  ILE  66          3HG2      ILE  66  -5.888   5.702   5.802
  528   HD11  ILE  66          3HD1      ILE  66  -4.961   8.709   6.584
  529   HD12  ILE  66          1HD1      ILE  66  -5.660   9.877   5.464
  530   HD13  ILE  66          2HD1      ILE  66  -5.494   8.188   4.985
  531    HA   PRO  67           HA       PRO  67 -10.164   3.494   7.515
  532    HB2  PRO  67           2HB      PRO  67 -12.686   4.394   6.191
  533    HB3  PRO  67           1HB      PRO  67 -12.422   3.840   7.849
  534    HG2  PRO  67           2HG      PRO  67 -12.727   6.430   7.317
  535    HG3  PRO  67           1HG      PRO  67 -11.560   5.880   8.535
  536    HD2  PRO  67           2HD      PRO  67 -11.084   6.901   5.778
  537    HD3  PRO  67           1HD      PRO  67 -10.084   7.069   7.235
  538    H    ASP  68           H        ASP  68 -12.028   4.112   4.548
  539    HA   ASP  68           HA       ASP  68 -12.162   1.481   3.702
  540    HB2  ASP  68           2HB      ASP  68 -12.759   2.357   1.504
  541    HB3  ASP  68           1HB      ASP  68 -13.533   3.311   2.765
  542    H    ALA  69           H        ALA  69  -9.487   3.582   3.701
  543    HA   ALA  69           HA       ALA  69  -8.042   2.549   1.506
  544    HB1  ALA  69           1HB      ALA  69  -7.657   4.528   3.492
  545    HB2  ALA  69           2HB      ALA  69  -6.742   4.271   2.006
  546    HB3  ALA  69           3HB      ALA  69  -6.245   3.469   3.497
  547    H    VAL  70           H        VAL  70  -6.717   2.313   4.725
  548    HA   VAL  70           HA       VAL  70  -5.447  -0.152   4.216
  549    HB   VAL  70           HB       VAL  70  -4.444   1.258   5.837
  550   HG11  VAL  70          1HG1      VAL  70  -5.698   2.618   7.065
  551   HG12  VAL  70          2HG1      VAL  70  -6.164   1.239   8.060
  552   HG13  VAL  70          3HG1      VAL  70  -7.149   1.696   6.671
  553   HG21  VAL  70          3HG2      VAL  70  -5.685  -0.936   7.478
  554   HG22  VAL  70          1HG2      VAL  70  -4.081  -0.220   7.643
  555   HG23  VAL  70          2HG2      VAL  70  -4.453  -1.241   6.254
  556    H    GLU  71           H        GLU  71  -8.619   0.608   5.211
  557    HA   GLU  71           HA       GLU  71  -9.190  -1.748   6.682
  558    HB2  GLU  71           2HB      GLU  71 -10.992   0.222   5.276
  559    HB3  GLU  71           1HB      GLU  71 -11.582  -1.102   6.271
  560    HG2  GLU  71           2HG      GLU  71  -9.701   1.002   7.299
  561    HG3  GLU  71           1HG      GLU  71 -11.456   1.154   7.377
  562    H    TYR  72           H        TYR  72  -9.599  -0.810   3.295
  563    HA   TYR  72           HA       TYR  72 -10.948  -3.171   2.517
  564    HB2  TYR  72           2HB      TYR  72 -11.211  -2.050   0.601
  565    HB3  TYR  72           1HB      TYR  72 -10.274  -0.740   1.310
  566    HD1  TYR  72           2HD      TYR  72  -9.818  -3.963  -0.516
  567    HD2  TYR  72           1HD      TYR  72  -8.317  -0.060   0.269
  568    HE1  TYR  72           2HE      TYR  72  -8.076  -4.297  -2.219
  569    HE2  TYR  72           1HE      TYR  72  -6.572  -0.383  -1.432
  570    HH   TYR  72           HH       TYR  72  -6.539  -2.178  -3.719
  571    H    ILE  73           H        ILE  73  -7.599  -2.124   2.220
  572    HA   ILE  73           HA       ILE  73  -6.664  -4.512   1.036
  573    HB   ILE  73           HB       ILE  73  -4.650  -3.109   2.575
  574   HG12  ILE  73          2HG1      ILE  73  -5.871  -1.496   0.360
  575   HG13  ILE  73          1HG1      ILE  73  -6.466  -1.330   2.007
  576   HG21  ILE  73          1HG2      ILE  73  -3.422  -3.237   0.581
  577   HG22  ILE  73          2HG2      ILE  73  -4.880  -3.352  -0.405
  578   HG23  ILE  73          3HG2      ILE  73  -4.396  -4.706   0.615
  579   HD11  ILE  73          3HD1      ILE  73  -3.554  -1.151   1.695
  580   HD12  ILE  73          1HD1      ILE  73  -4.661  -0.200   2.685
  581   HD13  ILE  73          2HD1      ILE  73  -4.492   0.153   0.966
  582    H    ALA  74           H        ALA  74  -7.175  -3.504   4.303
  583    HA   ALA  74           HA       ALA  74  -5.550  -5.397   5.608
  584    HB1  ALA  74           1HB      ALA  74  -6.380  -3.423   6.750
  585    HB2  ALA  74           2HB      ALA  74  -6.880  -4.883   7.602
  586    HB3  ALA  74           3HB      ALA  74  -8.035  -4.011   6.595
  587    H    GLN  75           H        GLN  75  -8.879  -5.487   4.520
  588    HA   GLN  75           HA       GLN  75  -9.380  -8.064   5.663
  589    HB2  GLN  75           2HB      GLN  75 -10.979  -6.250   3.879
  590    HB3  GLN  75           1HB      GLN  75 -11.535  -7.864   4.300
  591    HG2  GLN  75           2HG      GLN  75 -12.433  -7.028   6.133
  592    HG3  GLN  75           1HG      GLN  75 -10.813  -6.646   6.716
  593   HE21  GLN  75          1HE2      GLN  75 -10.607  -4.635   7.348
  594   HE22  GLN  75          2HE2      GLN  75 -11.415  -3.261   6.681
  595    H    ASN  76           H        ASN  76  -8.528  -6.767   2.549
  596    HA   ASN  76           HA       ASN  76  -9.082  -8.949   0.913
  597    HB2  ASN  76           2HB      ASN  76  -7.347  -6.574   0.771
  598    HB3  ASN  76           1HB      ASN  76  -6.810  -7.929  -0.217
  599   HD21  ASN  76          1HD2      ASN  76  -9.043  -5.386   0.127
  600   HD22  ASN  76          2HD2      ASN  76  -9.963  -5.687  -1.304
  601    HA   PRO  77           HA       PRO  77  -4.906 -10.750   2.308
  602    HB2  PRO  77           2HB      PRO  77  -3.750  -9.719   4.512
  603    HB3  PRO  77           1HB      PRO  77  -3.575  -8.972   2.923
  604    HG2  PRO  77           2HG      PRO  77  -5.112  -8.059   5.253
  605    HG3  PRO  77           1HG      PRO  77  -4.539  -7.139   3.856
  606    HD2  PRO  77           2HD      PRO  77  -7.169  -8.240   4.337
  607    HD3  PRO  77           1HD      PRO  77  -6.636  -7.219   2.994
  608    H    MET  78           H        MET  78  -6.981  -9.739   4.998
  609    HA   MET  78           HA       MET  78  -6.401 -11.862   6.739
  610    HB2  MET  78           2HB      MET  78  -7.569  -9.806   7.432
  611    HB3  MET  78           1HB      MET  78  -8.968 -10.286   6.482
  612    HG2  MET  78           2HG      MET  78  -9.408 -12.131   7.906
  613    HG3  MET  78           1HG      MET  78  -7.866 -11.937   8.737
  614    HE1  MET  78           3HE      MET  78 -11.730  -9.678   9.122
  615    HE2  MET  78           1HE      MET  78 -11.621 -11.291   9.829
  616    HE3  MET  78           2HE      MET  78 -11.288 -11.056   8.113
  617    H    ALA  79           H        ALA  79  -8.193 -11.769   3.830
  618    HA   ALA  79           HA       ALA  79  -8.567 -14.547   3.738
  619    HB1  ALA  79           1HB      ALA  79 -10.762 -13.003   4.961
  620    HB2  ALA  79           2HB      ALA  79 -10.317 -14.698   5.156
  621    HB3  ALA  79           3HB      ALA  79 -11.233 -14.186   3.739
  622    H    LYS  80           H        LYS  80  -7.569 -12.688   1.970
  623    HA   LYS  80           HA       LYS  80  -8.615 -11.388   0.055
  624    HB2  LYS  80           2HB      LYS  80  -7.319 -14.045  -0.587
  625    HB3  LYS  80           1HB      LYS  80  -7.515 -12.714  -1.719
  626    HG2  LYS  80           2HG      LYS  80  -6.088 -12.211   0.843
  627    HG3  LYS  80           1HG      LYS  80  -5.259 -13.093  -0.440
  628    HD2  LYS  80           2HD      LYS  80  -5.324 -11.286  -1.898
  629    HD3  LYS  80           1HD      LYS  80  -6.658 -10.515  -1.038
  630    HE2  LYS  80           2HE      LYS  80  -4.508  -9.351  -0.709
  631    HE3  LYS  80           1HE      LYS  80  -5.199  -9.948   0.799
  632    HZ1  LYS  80           3HZ      LYS  80  -2.954 -11.126  -0.740
  633    HZ2  LYS  80           1HZ      LYS  80  -3.710 -11.913   0.554
  634    HZ3  LYS  80           2HZ      LYS  80  -2.897 -10.452   0.811
  635   H282  PNS 101          8H2       PNS 101   0.593  15.725 -10.166
  636   H281  PNS 101          9H2       PNS 101   0.396  13.995 -10.464
  637   H303  PNS 101          0H3       PNS 101   4.059  15.924 -10.567
  638   H302  PNS 101          1H3       PNS 101   2.854  16.557  -9.445
  639   H301  PNS 101          2H3       PNS 101   2.513  16.519 -11.175
  640   H313  PNS 101          3H3       PNS 101   4.144  14.216  -9.050
  641   H312  PNS 101          4H3       PNS 101   3.079  12.831  -9.287
  642   H311  PNS 101          5H3       PNS 101   2.623  14.111  -8.162
  643    H32  PNS 101           6H3      PNS 101   1.846  13.091 -11.357
  644    H33  PNS 101           7H3      PNS 101   1.325  15.095 -12.370
  645    H36  PNS 101           8H3      PNS 101   5.356  13.245 -10.497
  646   H372  PNS 101          9H3       PNS 101   6.075  15.289 -11.245
  647   H371  PNS 101          0H4       PNS 101   4.601  15.432 -12.201
  648   H382  PNS 101          1H4       PNS 101   7.124  14.992 -13.189
  649   H381  PNS 101          2H4       PNS 101   6.420  13.375 -13.182
  650    H41  PNS 101           3H4      PNS 101   3.664  15.611 -14.135
  651   H422  PNS 101          4H4       PNS 101   6.099  17.230 -14.465
  652   H421  PNS 101          5H4       PNS 101   4.453  17.790 -14.756
  653   H431  PNS 101          7H4       PNS 101   4.130  17.264 -12.214
  654   H432  PNS 101          6H4       PNS 101   5.894  17.400 -12.168
  655    H44  PNS 101           8H4      PNS 101   4.585  19.746 -11.784