*HEADER    DNA BINDING PROTEIN                     08-JUL-15   2RVC              
*TITLE     SOLUTION STRUCTURE OF ZALPHA DOMAIN OF GOLDFISH ZBP-CONTAINING PROTEIN
*TITLE    2 KINASE                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INTERFERON-INDUCIBLE AND DOUBLE-STRANDED-DEPENDENT EIF-    
*COMPND   3 2KINASE;                                                             
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 FRAGMENT: UNP RESIDUES 1-64;                                         
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: CARASSIUS AURATUS;                              
*SOURCE   3 ORGANISM_COMMON: GOLDFISH;                                           
*SOURCE   4 ORGANISM_TAXID: 7957;                                                
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET28A                                     
*KEYWDS    Z DNA BINDING PROTEIN, HELIX TURN HELIX, DNA BINDING PROTEIN          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    A.LEE, C.PARK, J.PARK, M.KWON, Y.CHOI, K.KIM, B.CHOI, J.LEE           
*REVDAT   1   03-FEB-16 2RVC    0                                                


 ASSIGN  (resid 3    and name C   ) (resid 4    and name N   )
         (resid 4    and name CA  ) (resid 4    and name C   )  1.00 -66.2  25.00 2 ! 4 phi

 ASSIGN  (resid 4    and name N   ) (resid 4    and name CA  )
         (resid 4    and name C   ) (resid 5    and name N   )  1.00 -39.2  50.00 2 ! 4 psi

 ASSIGN  (resid 4    and name C   ) (resid 5    and name N   )
         (resid 5    and name CA  ) (resid 5    and name C   )  1.00 -66.3  25.00 2 ! 5 phi

 ASSIGN  (resid 5    and name N   ) (resid 5    and name CA  )
         (resid 5    and name C   ) (resid 6    and name N   )  1.00 -38.1  50.00 2 ! 5 psi

 ASSIGN  (resid 5    and name C   ) (resid 6    and name N   )
         (resid 6    and name CA  ) (resid 6    and name C   )  1.00 -64.6  25.00 2 ! 6 phi

 ASSIGN  (resid 6    and name N   ) (resid 6    and name CA  )
         (resid 6    and name C   ) (resid 7    and name N   )  1.00 -39.2  50.00 2 ! 6 psi

 ASSIGN  (resid 6    and name C   ) (resid 7    and name N   )
         (resid 7    and name CA  ) (resid 7    and name C   )  1.00 -66.2  25.00 2 ! 7 phi

 ASSIGN  (resid 7    and name N   ) (resid 7    and name CA  )
         (resid 7    and name C   ) (resid 8    and name N   )  1.00 -40.5  50.00 2 ! 7 psi

 ASSIGN  (resid 7    and name C   ) (resid 8    and name N   )
         (resid 8    and name CA  ) (resid 8    and name C   )  1.00 -64.3  25.00 2 ! 8 phi

 ASSIGN  (resid 8    and name N   ) (resid 8    and name CA  )
         (resid 8    and name C   ) (resid 9    and name N   )  1.00 -43.6  50.00 2 ! 8 psi

 ASSIGN  (resid 8    and name C   ) (resid 9    and name N   )
         (resid 9    and name CA  ) (resid 9    and name C   )  1.00 -58.2  25.00 2 ! 9 phi

 ASSIGN  (resid 9    and name N   ) (resid 9    and name CA  )
         (resid 9    and name C   ) (resid 10   and name N   )  1.00 -42.0  50.00 2 ! 9 psi

 ASSIGN  (resid 9    and name C   ) (resid 10   and name N   )
         (resid 10   and name CA  ) (resid 10   and name C   )  1.00 -64.0  25.00 2 ! 10 phi

 ASSIGN  (resid 10   and name N   ) (resid 10   and name CA  )
         (resid 10   and name C   ) (resid 11   and name N   )  1.00 -41.8  50.00 2 ! 10 psi

 ASSIGN  (resid 10   and name C   ) (resid 11   and name N   )
         (resid 11   and name CA  ) (resid 11   and name C   )  1.00 -64.1  25.00 2 ! 11 phi

 ASSIGN  (resid 11   and name N   ) (resid 11   and name CA  )
         (resid 11   and name C   ) (resid 12   and name N   )  1.00 -46.9  50.00 2 ! 11 psi

 ASSIGN  (resid 11   and name C   ) (resid 12   and name N   )
         (resid 12   and name CA  ) (resid 12   and name C   )  1.00 -63.4  25.00 2 ! 12 phi

 ASSIGN  (resid 12   and name N   ) (resid 12   and name CA  )
         (resid 12   and name C   ) (resid 13   and name N   )  1.00 -43.2  50.00 2 ! 12 psi

 ASSIGN  (resid 12   and name C   ) (resid 13   and name N   )
         (resid 13   and name CA  ) (resid 13   and name C   )  1.00 -61.1  25.00 2 ! 13 phi

 ASSIGN  (resid 13   and name N   ) (resid 13   and name CA  )
         (resid 13   and name C   ) (resid 14   and name N   )  1.00 -39.7  50.00 2 ! 13 psi

 ASSIGN  (resid 13   and name C   ) (resid 14   and name N   )
         (resid 14   and name CA  ) (resid 14   and name C   )  1.00 -63.2  25.00 2 ! 14 phi

 ASSIGN  (resid 14   and name N   ) (resid 14   and name CA  )
         (resid 14   and name C   ) (resid 15   and name N   )  1.00 -45.4  50.00 2 ! 14 psi

 ASSIGN  (resid 14   and name C   ) (resid 15   and name N   )
         (resid 15   and name CA  ) (resid 15   and name C   )  1.00 -59.8  25.00 2 ! 15 phi

 ASSIGN  (resid 15   and name N   ) (resid 15   and name CA  )
         (resid 15   and name C   ) (resid 16   and name N   )  1.00 -42.1  50.00 2 ! 15 psi

 ASSIGN  (resid 15   and name C   ) (resid 16   and name N   )
         (resid 16   and name CA  ) (resid 16   and name C   )  1.00 -61.3  25.00 2 ! 16 phi

 ASSIGN  (resid 16   and name N   ) (resid 16   and name CA  )
         (resid 16   and name C   ) (resid 17   and name N   )  1.00 -41.2  50.00 2 ! 16 psi

 ASSIGN  (resid 16   and name C   ) (resid 17   and name N   )
         (resid 17   and name CA  ) (resid 17   and name C   )  1.00 -72.4  25.00 2 ! 17 phi

 ASSIGN  (resid 17   and name N   ) (resid 17   and name CA  )
         (resid 17   and name C   ) (resid 18   and name N   )  1.00 -33.4  50.00 2 ! 17 psi

 ASSIGN  (resid 17   and name C   ) (resid 18   and name N   )
         (resid 18   and name CA  ) (resid 18   and name C   )  1.00 -92.0  25.00 2 ! 18 phi

 ASSIGN  (resid 18   and name N   ) (resid 18   and name CA  )
         (resid 18   and name C   ) (resid 19   and name N   )  1.00 -23.8  50.00 2 ! 18 psi

 ASSIGN  (resid 19   and name C   ) (resid 20   and name N   )
         (resid 20   and name CA  ) (resid 20   and name C   )  1.00 -87.9  50.00 2 ! 20 phi

 ASSIGN  (resid 20   and name N   ) (resid 20   and name CA  )
         (resid 20   and name C   ) (resid 21   and name N   )  1.00 144.1  50.00 2 ! 20 psi

 ASSIGN  (resid 20   and name C   ) (resid 21   and name N   )
         (resid 21   and name CA  ) (resid 21   and name C   )  1.00 -126.9 50.00 2 ! 21 phi

 ASSIGN  (resid 21   and name N   ) (resid 21   and name CA  )
         (resid 21   and name C   ) (resid 22   and name N   )  1.00  159.6 50.00 2 ! 21 psi

 ASSIGN  (resid 21   and name C   ) (resid 22   and name N   )
         (resid 22   and name CA  ) (resid 22   and name C   )  1.00 -74.5  25.00 2 ! 22 phi

 ASSIGN  (resid 22   and name N   ) (resid 22   and name CA  )
         (resid 22   and name C   ) (resid 23   and name N   )  1.00 167.5  50.00 2 ! 22 psi

 ASSIGN  (resid 22   and name C   ) (resid 23   and name N   )
         (resid 23   and name CA  ) (resid 23   and name C   )  1.00 -60.0  25.00 2 ! 23 phi

 ASSIGN  (resid 23   and name N   ) (resid 23   and name CA  )
         (resid 23   and name C   ) (resid 24   and name N   )  1.00 -41.7  50.00 2 ! 23 psi

 ASSIGN  (resid 23   and name C   ) (resid 24   and name N   )
         (resid 24   and name CA  ) (resid 24   and name C   )  1.00 -61.0  25.00 2 ! 24 phi

 ASSIGN  (resid 24   and name N   ) (resid 24   and name CA  )
         (resid 24   and name C   ) (resid 25   and name N   )  1.00 -39.6  50.00 2 ! 24 psi

 ASSIGN  (resid 24   and name C   ) (resid 25   and name N   )
         (resid 25   and name CA  ) (resid 25   and name C   )  1.00 -62.6  25.00 2 ! 25 phi

 ASSIGN  (resid 25   and name N   ) (resid 25   and name CA  )
         (resid 25   and name C   ) (resid 26   and name N   )  1.00 -45.7  50.00 2 ! 25 psi
 
 ASSIGN  (resid 25   and name C   ) (resid 26   and name N   )
         (resid 26   and name CA  ) (resid 26   and name C   )  1.00 -65.2  25.00 2 ! 26 phi

 ASSIGN  (resid 26   and name N   ) (resid 26   and name CA  )
         (resid 26   and name C   ) (resid 27   and name N   )  1.00 -44.9  50.00 2 ! 26 psi

 ASSIGN  (resid 26   and name C   ) (resid 27   and name N   )
         (resid 27   and name CA  ) (resid 27   and name C   )  1.00 -61.5  25.00 2 ! 27 phi

 ASSIGN  (resid 27   and name N   ) (resid 27   and name CA  )
         (resid 27   and name C   ) (resid 28   and name N   )  1.00 -39.1  50.00 2 ! 27 psi

 ASSIGN  (resid 27   and name C   ) (resid 28   and name N   )
         (resid 28   and name CA  ) (resid 28   and name C   )  1.00 -64.7  25.00 2 ! 28 phi

 ASSIGN  (resid 28   and name N   ) (resid 28   and name CA  )
         (resid 28   and name C   ) (resid 29   and name N   )  1.00 -41.5  50.00 2 ! 28 psi

 ASSIGN  (resid 28   and name C   ) (resid 29   and name N   )
         (resid 29   and name CA  ) (resid 29   and name C   )  1.00 -68.0  25.00 2 ! 29 phi

 ASSIGN  (resid 29   and name N   ) (resid 29   and name CA  )
         (resid 29   and name C   ) (resid 30   and name N   )  1.00 -35.1  50.00 2 ! 29 psi

 ASSIGN  (resid 29   and name C   ) (resid 30   and name N   )
         (resid 30   and name CA  ) (resid 30   and name C   )  1.00 -97.9  25.00 2 ! 30 phi

 ASSIGN  (resid 30   and name N   ) (resid 30   and name CA  )
         (resid 30   and name C   ) (resid 31   and name N   )  1.00   2.4  50.00 2 ! 30 psi

 ASSIGN  (resid 30   and name C   ) (resid 31   and name N   )
         (resid 31   and name CA  ) (resid 31   and name C   )  1.00  74.4  25.00 2 ! 31 phi

 ASSIGN  (resid 31   and name N   ) (resid 31   and name CA  )
         (resid 31   and name C   ) (resid 32   and name N   )  1.00  30.1  50.00 2 ! 31 psi

 ASSIGN  (resid 31   and name C   ) (resid 32   and name N   )
         (resid 32   and name CA  ) (resid 32   and name C   )  1.00 -117.3 25.00 2 ! 32 phi

 ASSIGN  (resid 32   and name N   ) (resid 32   and name CA  )
         (resid 32   and name C   ) (resid 33   and name N   )  1.00 159.1  50.00 2 ! 32 psi

 ASSIGN  (resid 32   and name C   ) (resid 33   and name N   )
         (resid 33   and name CA  ) (resid 33   and name C   )  1.00 -73.7  25.00 2 ! 33 phi

 ASSIGN  (resid 33   and name N   ) (resid 33   and name CA  )
         (resid 33   and name C   ) (resid 34   and name N   )  1.00 155.3  50.00 2 ! 33 psi

 ASSIGN  (resid 33   and name C   ) (resid 34   and name N   )
         (resid 34   and name CA  ) (resid 34   and name C   )  1.00 -58.0  25.00 2 ! 34 phi

 ASSIGN  (resid 34   and name N   ) (resid 34   and name CA  )
         (resid 34   and name C   ) (resid 35   and name N   )  1.00 -39.6  50.00 2 ! 34 psi

 ASSIGN  (resid 34   and name C   ) (resid 35   and name N   )
         (resid 35   and name CA  ) (resid 35   and name C   )  1.00 -63.8  25.00 2 ! 35 phi

 ASSIGN  (resid 35   and name N   ) (resid 35   and name CA  )
         (resid 35   and name C   ) (resid 36   and name N   )  1.00 -37.9  50.00 2 ! 35 psi

 ASSIGN  (resid 35   and name C   ) (resid 36   and name N   )
         (resid 36   and name CA  ) (resid 36   and name C   )  1.00 -66.5  25.00 2 ! 36 phi

 ASSIGN  (resid 36   and name N   ) (resid 36   and name CA  )
         (resid 36   and name C   ) (resid 37   and name N   )  1.00 -42.2  50.00 2 ! 36 psi

 ASSIGN  (resid 36   and name C   ) (resid 37   and name N   )
         (resid 37   and name CA  ) (resid 37   and name C   )  1.00 -65.6  25.00 2 ! 37 phi

 ASSIGN  (resid 37   and name N   ) (resid 37   and name CA  )
         (resid 37   and name C   ) (resid 38   and name N   )  1.00 -44.6  50.00 2 ! 37 psi

 ASSIGN  (resid 37   and name C   ) (resid 38   and name N   )
         (resid 38   and name CA  ) (resid 38   and name C   )  1.00 -59.5  25.00 2 ! 38 phi

 ASSIGN  (resid 38   and name N   ) (resid 38   and name CA  )
         (resid 38   and name C   ) (resid 39   and name N   )  1.00 -39.8  50.00 2 ! 38 psi

 ASSIGN  (resid 38   and name C   ) (resid 39   and name N   )
         (resid 39   and name CA  ) (resid 39   and name C   )  1.00 -63.1  25.00 2 ! 39 phi

 ASSIGN  (resid 39   and name N   ) (resid 39   and name CA  )
         (resid 39   and name C   ) (resid 40   and name N   )  1.00 -45.4  50.00 2 ! 39 psi

 ASSIGN  (resid 39   and name C   ) (resid 40   and name N   )
         (resid 40   and name CA  ) (resid 40   and name C   )  1.00 -63.8  25.00 2 ! 40 phi

 ASSIGN  (resid 40   and name N   ) (resid 40   and name CA  )
         (resid 40   and name C   ) (resid 41   and name N   )  1.00 -43.2  50.00 2 ! 40 psi

 ASSIGN  (resid 40   and name C   ) (resid 41   and name N   )
         (resid 41   and name CA  ) (resid 41   and name C   )  1.00 -63.7  25.00 2 ! 41 phi

 ASSIGN  (resid 41   and name N   ) (resid 41   and name CA  )
         (resid 41   and name C   ) (resid 42   and name N   )  1.00 -44.0  50.00 2 ! 41 psi

 ASSIGN  (resid 41   and name C   ) (resid 42   and name N   )
         (resid 42   and name CA  ) (resid 42   and name C   )  1.00 -62.0  25.00 2 ! 42 phi

 ASSIGN  (resid 42   and name N   ) (resid 42   and name CA  )
         (resid 42   and name C   ) (resid 43   and name N   )  1.00 -40.2  50.00 2 ! 42 psi

 ASSIGN  (resid 42   and name C   ) (resid 43   and name N   )
         (resid 43   and name CA  ) (resid 43   and name C   )  1.00 -66.4  25.00 2 ! 43 phi

 ASSIGN  (resid 43   and name N   ) (resid 43   and name CA  )
         (resid 43   and name C   ) (resid 44   and name N   )  1.00 -42.9  50.00 2 ! 43 psi

 ASSIGN  (resid 43   and name C   ) (resid 44   and name N   )
         (resid 44   and name CA  ) (resid 44   and name C   )  1.00 -67.7  25.00 2 ! 44 phi

 ASSIGN  (resid 44   and name N   ) (resid 44   and name CA  )
         (resid 44   and name C   ) (resid 45   and name N   )  1.00 -38.7  50.00 2 ! 44 psi

 ASSIGN  (resid 44   and name C   ) (resid 45   and name N   )
         (resid 45   and name CA  ) (resid 45   and name C   )  1.00 -64.8  25.00 2 ! 45 phi

 ASSIGN  (resid 45   and name N   ) (resid 45   and name CA  )
         (resid 45   and name C   ) (resid 46   and name N   )  1.00 -41.7  50.00 2 ! 45 psi

 ASSIGN  (resid 45   and name C   ) (resid 46   and name N   )
         (resid 46   and name CA  ) (resid 46   and name C   )  1.00 -66.2  25.00 2 ! 46 phi

 ASSIGN  (resid 46   and name N   ) (resid 46   and name CA  )
         (resid 46   and name C   ) (resid 47   and name N   )  1.00 -32.1  50.00 2 ! 46 psi

 ASSIGN  (resid 46   and name C   ) (resid 47   and name N   )
         (resid 47   and name CA  ) (resid 47   and name C   )  1.00 -91.6  25.00 2 ! 47 phi

 ASSIGN  (resid 47   and name N   ) (resid 47   and name CA  )
         (resid 47   and name C   ) (resid 48   and name N   )  1.00  8.3   50.00 2 ! 47 psi

 ASSIGN  (resid 47   and name C   ) (resid 48   and name N   )
         (resid 48   and name CA  ) (resid 48   and name C   )  1.00 60.1   25.00 2 ! 48 phi

 ASSIGN  (resid 48   and name N   ) (resid 48   and name CA  )
         (resid 48   and name C   ) (resid 49   and name N   )  1.00 34.0   50.00 2 ! 48 psi

 ASSIGN  (resid 48   and name C   ) (resid 49   and name N   )
         (resid 49   and name CA  ) (resid 49   and name C   )  1.00 -99.5  25.00 2 ! 49 phi

 ASSIGN  (resid 49   and name N   ) (resid 49   and name CA  )
         (resid 49   and name C   ) (resid 50   and name N   )  1.00 -16.0  50.00 2 ! 49 psi

 ASSIGN  (resid 49   and name C   ) (resid 50   and name N   )
         (resid 50   and name CA  ) (resid 50   and name C   )  1.00 -128.8 25.00 2 ! 50 phi

 ASSIGN  (resid 50   and name N   ) (resid 50   and name CA  )
         (resid 50   and name C   ) (resid 51   and name N   )  1.00 164.9  50.00 2 ! 50 psi

 ASSIGN  (resid 50   and name C   ) (resid 51   and name N   )
         (resid 51   and name CA  ) (resid 51   and name C   )  1.00 -137.3 25.00 2 ! 51 phi

 ASSIGN  (resid 51   and name N   ) (resid 51   and name CA  )
         (resid 51   and name C   ) (resid 52   and name N   )  1.00 151.9  50.00 2 ! 51 psi

 ASSIGN  (resid 51   and name C   ) (resid 52   and name N   )
         (resid 52   and name CA  ) (resid 52   and name C   )  1.00 -132.4 50.00 2 ! 52 phi

 ASSIGN  (resid 52   and name N   ) (resid 52   and name CA  )
         (resid 52   and name C   ) (resid 53   and name N   )  1.00 151.8  50.00 2 ! 52 psi


 ASSIGN  (resid 52   and name C   ) (resid 53   and name N   )
         (resid 53   and name CA  ) (resid 53   and name C   )  1.00 -108.7 50.00 2 ! 53 phi

 ASSIGN  (resid 53   and name N   ) (resid 53   and name CA  )
         (resid 53   and name C   ) (resid 54   and name N   )  1.00 160.5  50.00 2 ! 53 psi

 ASSIGN  (resid 53   and name C   ) (resid 54   and name N   )
         (resid 54   and name CA  ) (resid 54   and name C   )  1.00  57.0  25.00 2 ! 54 phi

 ASSIGN  (resid 54   and name N   ) (resid 54   and name CA  )
         (resid 54   and name C   ) (resid 55   and name N   )  1.00  32.4  50.00 2 ! 54 psi

 ASSIGN  (resid 58   and name C   ) (resid 59   and name N   )
         (resid 59   and name CA  ) (resid 59   and name C   )  1.00 -91.4  50.00 2 ! 59 phi

 ASSIGN  (resid 59   and name N   ) (resid 59   and name CA  )
         (resid 59   and name C   ) (resid 60   and name N   )  1.00 132.8  50.00 2 ! 59 psi

 ASSIGN  (resid 59   and name C   ) (resid 60   and name N   )
         (resid 60   and name CA  ) (resid 60   and name C   )  1.00 -101.6 50.00 2 ! 60 phi

 ASSIGN  (resid 60   and name N   ) (resid 60   and name CA  )
         (resid 60   and name C   ) (resid 61   and name N   )  1.00 147.8  50.00 2 ! 60 psi

 ASSIGN  (resid 60   and name C   ) (resid 61   and name N   )
         (resid 61   and name CA  ) (resid 61   and name C   )  1.00 -136.9 50.00 2 ! 61 phi

 ASSIGN  (resid 61   and name N   ) (resid 61   and name CA  )
         (resid 61   and name C   ) (resid 62   and name N   )  1.00 151.8  50.00 2 ! 61 psi

 ASSIGN  (resid 61   and name C   ) (resid 62   and name N   )
         (resid 62   and name CA  ) (resid 62   and name C   )  1.00 -82.1  50.00 2 ! 62 phi

 ASSIGN  (resid 62   and name N   ) (resid 62   and name CA  )
         (resid 62   and name C   ) (resid 63   and name N   )  1.00 148.8  50.00 2 ! 62 psi

 ASSIGN  (resid 42   and name N   ) (resid 42   and name CA  )
         (resid 42   and name CB  ) (resid 42   and name CG  )  1.00 -60.0  30.00 2 ! 42 chi1






assign (  resid   3  and  name    HB#  )  (  resid    4  and  name     HN  )   2.995    1.195   1.195 
assign (  resid   3  and  name     HA  )  (  resid    4  and  name    HB#  )   2.995    1.195   1.195 

assign (  resid   4  and  name     HN  )  (  resid    4  and  name    HB2  )   2.945    1.145   1.145 
assign (  resid   4  and  name     HN  )  (  resid    4  and  name    HB1  )   2.945    1.145   1.145 
assign (  resid   4  and  name     HN  )  (  resid    4  and  name    HB#  )   2.645    0.845   0.845 
assign (  resid   4  and  name    HB#  )  (  resid    5  and  name     HN  )   2.665    0.865   0.865 
assign (  resid   4  and  name     HN  )  (  resid    5  and  name     HN  )   3.395    1.595   1.595 
assign (  resid   4  and  name     HA  )  (  resid    6  and  name     HN  )   3.205    1.405   1.405 

assign (  resid   5  and  name     HA  )  (  resid    5  and  name   HG2#  )   2.875    1.075   1.075 
assign (  resid   5  and  name     HN  )  (  resid    5  and  name     HB  )   2.975    1.175   1.175 
assign (  resid   5  and  name     HN  )  (  resid    5  and  name   HG2#  )   2.835    1.035   1.035 
assign (  resid   5  and  name     HN  )  (  resid    6  and  name     HN  )   3.105    1.305   1.305 
assign (  resid   5  and  name     HB  )  (  resid    6  and  name     HN  )   3.325    1.525   1.525 
assign (  resid   5  and  name     HA  )  (  resid    6  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid   5  and  name   HG2#  )  (  resid    6  and  name     HN  )   3.280    1.480   1.480 
assign (  resid   5  and  name     HN  )  (  resid    6  and  name    HB#  )   3.320    1.520   1.520 
assign (  resid   5  and  name     HA  )  (  resid    8  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014

assign (  resid   6  and  name     HN  )  (  resid    6  and  name    HG2  )   3.410    1.610   1.610 
assign (  resid   6  and  name     HN  )  (  resid    6  and  name    HG1  )   3.410    1.610   1.610 
assign (  resid   6  and  name     HN  )  (  resid    6  and  name    HG#  )   3.075    1.275   1.275 
assign (  resid   6  and  name    HB#  )  (  resid    7  and  name     HN  )   2.710    0.910   0.910 
assign (  resid   6  and  name     HA  )  (  resid    7  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid   6  and  name     HN  )  (  resid    7  and  name     HN  )   3.270    1.470   1.470 
assign (  resid   6  and  name     HN  )  (  resid    9  and  name     HN  )   3.620    1.820   1.820 
assign (  resid   6  and  name     HA  )  (  resid    9  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014

assign (  resid   7  and  name     HN  )  (  resid    7  and  name    HG2  )   2.920    1.120   1.120 
assign (  resid   7  and  name     HN  )  (  resid    7  and  name    HG1  )   2.920    1.120   1.120 
assign (  resid   7  and  name     HN  )  (  resid    7  and  name    HB2  )   2.835    1.035   1.035 
assign (  resid   7  and  name     HN  )  (  resid    7  and  name    HB1  )   2.835    1.035   1.035 
assign (  resid   7  and  name     HN  )  (  resid    7  and  name    HG#  )   2.620    0.820   0.820 
assign (  resid   7  and  name     HA  )  (  resid    7  and  name    HG#  )   2.770    0.970   0.970 
assign (  resid   7  and  name    HB2  )  (  resid    8  and  name     HN  )   3.075    1.275   1.275 
assign (  resid   7  and  name     HA  )  (  resid    8  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid   7  and  name    HB1  )  (  resid    8  and  name     HN  )   3.075    1.275   1.275 
assign (  resid   7  and  name    HB#  )  (  resid    8  and  name     HA  )   3.175    1.375   1.375 
assign (  resid   7  and  name     HN  )  (  resid    8  and  name     HN  )   2.540    0.740   0.740  ! added 05/09/2014
assign (  resid   7  and  name     HA  )  (  resid    9  and  name     HN  )   3.030    1.230   1.230 
assign (  resid   7  and  name     HA  )  (  resid   10  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014

assign (  resid   8  and  name     HA  )  (  resid    8  and  name    HG2  )   3.025    1.225   1.225 
assign (  resid   8  and  name     HA  )  (  resid    8  and  name    HG1  )   3.025    1.225   1.225 
assign (  resid   8  and  name     HN  )  (  resid    8  and  name    HG1  )   3.220    1.420   1.420 
assign (  resid   8  and  name     HN  )  (  resid    8  and  name    HG2  )   3.220    1.420   1.420 
assign (  resid   8  and  name     HN  )  (  resid    8  and  name    HB2  )   2.840    1.040   1.040 
assign (  resid   8  and  name     HN  )  (  resid    8  and  name    HB1  )   2.840    1.040   1.040 
assign (  resid   8  and  name     HN  )  (  resid    8  and  name    HB#  )   2.405    0.605   0.605 
assign (  resid   8  and  name     HN  )  (  resid    8  and  name    HG#  )   2.920    1.120   1.120 
assign (  resid   8  and  name     HA  )  (  resid    8  and  name    HG#  )   2.745    0.945   0.945 
assign (  resid   8  and  name    HB#  )  (  resid    9  and  name     HN  )   2.440    0.640   0.640 
assign (  resid   8  and  name     HA  )  (  resid    9  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid   8  and  name     HN  )  (  resid    9  and  name     HN  )   2.540    0.740   0.740  ! added 05/09/2014
assign (  resid   8  and  name    HB#  )  (  resid   10  and  name     HN  )   3.545    1.745   1.745 
assign (  resid   8  and  name     HN  )  (  resid   10  and  name     HN  )   3.015    1.215   1.215 
assign (  resid   8  and  name     HA  )  (  resid   10  and  name     HN  )   3.105    1.305   1.305 
assign (  resid   8  and  name     HN  )  (  resid   10  and  name    HE#  )   3.425    1.625   1.625 
assign (  resid   8  and  name     HA  )  (  resid   11  and  name   HD1#  )   3.015    1.215   1.215 
assign (  resid   8  and  name     HA  )  (  resid   11  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid   8  and  name    HG#  )  (  resid   44  and  name     HN  )   3.570    1.770   1.770 
assign (  resid   8  and  name     HN  )  (  resid   44  and  name   HD1#  )   3.565    1.765   1.765 
assign (  resid   8  and  name     HN  )  (  resid   44  and  name   HD2#  )   3.565    1.765   1.765 

assign (  resid   9  and  name     HA  )  (  resid    9  and  name    HD#  )   3.060    1.260   1.260 
assign (  resid   9  and  name     HN  )  (  resid    9  and  name    HD#  )   3.295    1.495   1.495 
assign (  resid   9  and  name    HD#  )  (  resid   10  and  name     HN  )   3.650    1.850   1.850 
assign (  resid   9  and  name     HA  )  (  resid   10  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid   9  and  name     HN  )  (  resid   10  and  name     HN  )   2.560    0.760   0.760 
assign (  resid   9  and  name     HA  )  (  resid   11  and  name     HN  )   3.100    1.300   1.300 
assign (  resid   9  and  name     HN  )  (  resid   11  and  name     HN  )   3.355    1.555   1.555 
assign (  resid   9  and  name     HA  )  (  resid   12  and  name   HD1#  )   3.100    1.300   1.300 
assign (  resid   9  and  name    HD#  )  (  resid   12  and  name   HG12  )   3.115    1.315   1.315 
assign (  resid   9  and  name     HA  )  (  resid   12  and  name     HN  )   2.655    0.855   0.855 
assign (  resid   9  and  name     HN  )  (  resid   12  and  name   HG12  )   3.650    1.850   1.850 
assign (  resid   9  and  name     HA  )  (  resid   12  and  name     HB  )   3.465    1.665   1.665 
assign (  resid   9  and  name    HD#  )  (  resid   13  and  name     HN  )   3.480    1.680   1.680 
assign (  resid   9  and  name     HA  )  (  resid   13  and  name     HN  )   3.235    1.435   1.435 

assign (  resid  10  and  name     HA  )  (  resid   10  and  name    HG1  )   2.885    1.085   1.085 
assign (  resid  10  and  name     HA  )  (  resid   10  and  name    HG2  )   2.885    1.085   1.085 
assign (  resid  10  and  name     HN  )  (  resid   10  and  name    HB#  )   2.375    0.575   0.575 
assign (  resid  10  and  name     HN  )  (  resid   10  and  name    HG#  )   2.370    0.570   0.570 
assign (  resid  10  and  name     HN  )  (  resid   10  and  name    HE#  )   3.095    1.295   1.295 
assign (  resid  10  and  name     HA  )  (  resid   10  and  name    HG#  )   2.630    0.830   0.830 
assign (  resid  10  and  name    HG2  )  (  resid   11  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  10  and  name     HA  )  (  resid   11  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid  10  and  name    HG#  )  (  resid   11  and  name     HN  )   3.305    1.505   1.505 
assign (  resid  10  and  name    HE#  )  (  resid   11  and  name   HG2#  )   3.555    1.755   1.755 
assign (  resid  10  and  name    HB#  )  (  resid   11  and  name     HN  )   2.900    1.100   1.100 
assign (  resid  10  and  name    HG1  )  (  resid   11  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  10  and  name     HN  )  (  resid   11  and  name   HD1#  )   3.465    1.665   1.665 
assign (  resid  10  and  name     HN  )  (  resid   11  and  name   HG2#  )   3.155    1.355   1.355 
assign (  resid  10  and  name     HN  )  (  resid   11  and  name     HN  )   2.540    0.740   0.740  ! added 05/09/2014
assign (  resid  10  and  name     HN  )  (  resid   12  and  name     HN  )   3.200    1.400   1.400 
assign (  resid  10  and  name     HA  )  (  resid   12  and  name     HN  )   3.285    1.485   1.485 
assign (  resid  10  and  name     HA  )  (  resid   13  and  name     HN  )   2.700    0.900   0.900 
assign (  resid  10  and  name     HN  )  (  resid   13  and  name     HN  )   3.390    1.590   1.590 
assign (  resid  10  and  name     HA  )  (  resid   13  and  name    HB#  )   2.830    1.030   1.030 
assign (  resid  10  and  name    HB#  )  (  resid   13  and  name     HN  )   3.570    1.770   1.770 

assign (  resid  11  and  name     HN  )  (  resid   11  and  name     HB  )   2.885    1.085   1.085 
assign (  resid  11  and  name     HB  )  (  resid   11  and  name   HD1#  )   2.625    0.825   0.825 
assign (  resid  11  and  name     HA  )  (  resid   11  and  name   HD1#  )   3.565    1.765   1.765 
assign (  resid  11  and  name     HN  )  (  resid   11  and  name   HD1#  )   2.550    0.750   0.750 
assign (  resid  11  and  name     HN  )  (  resid   11  and  name   HG2#  )   2.890    1.090   1.090 
assign (  resid  11  and  name     HN  )  (  resid   11  and  name   HG1#  )   2.560    0.760   0.760 
assign (  resid  11  and  name   HG1#  )  (  resid   12  and  name   HG2#  )   2.725    0.925   0.925 
assign (  resid  11  and  name     HN  )  (  resid   12  and  name     HN  )   2.540    0.740   0.740 
assign (  resid  11  and  name     HA  )  (  resid   12  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid  11  and  name     HN  )  (  resid   12  and  name   HG12  )   3.645    1.845   1.845  
assign (  resid  11  and  name     HN  )  (  resid   12  and  name   HG11  )   3.305    1.505   1.505 
assign (  resid  11  and  name   HG2#  )  (  resid   12  and  name     HN  )   2.830    1.030   1.030 
assign (  resid  11  and  name   HG2#  )  (  resid   12  and  name     HN  )   2.830    1.030   1.030 
assign (  resid  11  and  name     HB  )  (  resid   12  and  name     HN  )   2.740    0.940   0.940 
assign (  resid  11  and  name   HG1#  )  (  resid   12  and  name     HN  )   2.870    1.070   1.070 
assign (  resid  11  and  name     HN  )  (  resid   12  and  name   HG2#  )   3.270    1.470   1.470 
assign (  resid  11  and  name   HD1#  )  (  resid   12  and  name     HN  )   2.920    1.120   1.120 
assign (  resid  11  and  name     HN  )  (  resid   13  and  name     HN  )   3.010    1.210   1.210 
assign (  resid  11  and  name     HA  )  (  resid   13  and  name     HN  )   3.235    1.435   1.435 
assign (  resid  11  and  name     HB  )  (  resid   13  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  11  and  name   HG1#  )  (  resid   13  and  name     HN  )   3.060    1.260   1.260 
assign (  resid  11  and  name     HA  )  (  resid   14  and  name     HN  )   3.100    1.300   1.300 
assign (  resid  11  and  name   HD1#  )  (  resid   37  and  name     HA  )   3.335    1.535   1.535 
assign (  resid  11  and  name   HD1#  )  (  resid   40  and  name    HB2  )   2.915    1.115   1.115 
assign (  resid  11  and  name   HD1#  )  (  resid   40  and  name    HB1  )   2.860    1.060   1.060 

assign (  resid  12  and  name     HN  )  (  resid   12  and  name     HB  )   2.715    0.915   0.915 
assign (  resid  12  and  name     HN  )  (  resid   12  and  name   HG11  )   2.515    0.715   0.715 
assign (  resid  12  and  name     HN  )  (  resid   12  and  name   HG12  )   2.630    0.830   0.830 
assign (  resid  12  and  name     HN  )  (  resid   12  and  name   HG2#  )   2.550    0.750   0.750 
assign (  resid  12  and  name     HB  )  (  resid   12  and  name   HD1#  )   2.920    1.120   1.120 
assign (  resid  12  and  name   HG2#  )  (  resid   12  and  name   HD1#  )   2.490    0.690   0.690 
assign (  resid  12  and  name     HA  )  (  resid   12  and  name   HD1#  )   2.760    0.960   0.960 
assign (  resid  12  and  name     HN  )  (  resid   12  and  name   HD1#  )   2.985    1.185   1.185 
assign (  resid  12  and  name     HA  )  (  resid   12  and  name   HG2#  )   2.640    0.840   0.840 
assign (  resid  12  and  name   HG2#  )  (  resid   13  and  name     HA  )   3.630    1.830   1.830 
assign (  resid  12  and  name     HA  )  (  resid   13  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  12  and  name     HB  )  (  resid   13  and  name     HN  )   3.155    1.355   1.355 
assign (  resid  12  and  name   HG11  )  (  resid   13  and  name     HN  )   3.000    1.200   1.200 
assign (  resid  12  and  name   HG12  )  (  resid   13  and  name     HN  )   3.035    1.235   1.235 
assign (  resid  12  and  name   HG2#  )  (  resid   13  and  name     HN  )   2.920    1.120   1.120 
assign (  resid  12  and  name     HN  )  (  resid   13  and  name     HN  )   2.595    0.795   0.795 
assign (  resid  12  and  name   HD1#  )  (  resid   13  and  name     HN  )   2.980    1.180   1.180 
assign (  resid  12  and  name     HA  )  (  resid   15  and  name     HN  )   2.825    1.025   1.025 
assign (  resid  12  and  name   HD1#  )  (  resid   16  and  name    HB#  )   3.080    1.280   1.280 
assign (  resid  12  and  name   HG11  )  (  resid   16  and  name    HD#  )   3.050    1.250   1.250 
assign (  resid  12  and  name     HA  )  (  resid   16  and  name     HN  )   3.065    1.265   1.265 
assign (  resid  12  and  name   HD1#  )  (  resid   17  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  12  and  name   HD1#  )  (  resid   20  and  name    HB#  )   2.975    1.175   1.175 
assign (  resid  12  and  name   HD1#  )  (  resid   20  and  name     HN  )   3.570    1.770   1.770 

assign (  resid  13  and  name     HN  )  (  resid   13  and  name    HB2  )   2.535    0.735   0.735 
assign (  resid  13  and  name     HN  )  (  resid   13  and  name    HB1  )   2.535    0.735   0.735 
assign (  resid  13  and  name     HN  )  (  resid   13  and  name    HB#  )   2.305    0.505   0.505 
assign (  resid  13  and  name     HN  )  (  resid   14  and  name     HN  )   2.730    0.930   0.930 
assign (  resid  13  and  name     HA  )  (  resid   14  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid  13  and  name    HB2  )  (  resid   14  and  name     HN  )   2.810    1.010   1.010 
assign (  resid  13  and  name    HB1  )  (  resid   14  and  name     HN  )   2.810    1.010   1.010
assign (  resid  13  and  name     HN  )  (  resid   14  and  name    HB1  )   3.230    1.430   1.430 
assign (  resid  13  and  name    HB#  )  (  resid   14  and  name     HN  )   2.535    0.735   0.735 
assign (  resid  13  and  name     HN  )  (  resid   15  and  name     HN  )   3.375    1.575   1.575 
assign (  resid  13  and  name     HA  )  (  resid   15  and  name     HN  )   3.535    1.735   1.735 
assign (  resid  13  and  name    HB#  )  (  resid   16  and  name     HN  )   3.570    1.770   1.770 
assign (  resid  13  and  name     HA  )  (  resid   16  and  name     HN  )   2.760    0.960   0.960 
assign (  resid  13  and  name     HN  )  (  resid   16  and  name     HN  )   3.380    1.580   1.580 
assign (  resid  13  and  name     HA  )  (  resid   16  and  name    HD#  )   3.170    1.370   1.370  
assign (  resid  13  and  name     HA  )  (  resid   17  and  name     HN  )   3.360    1.560   1.560 

assign (  resid  14  and  name     HA  )  (  resid   14  and  name    HD#  )   2.955    1.155   1.155 
assign (  resid  14  and  name     HN  )  (  resid   14  and  name    HB1  )   2.450    0.650   0.650 
assign (  resid  14  and  name     HN  )  (  resid   14  and  name    HB2  )   2.445    0.645   0.645 
assign (  resid  14  and  name     HN  )  (  resid   14  and  name    HD#  )   2.915    1.115   1.115 
assign (  resid  14  and  name    HB2  )  (  resid   15  and  name     HN  )   2.930    1.130   1.130 
assign (  resid  14  and  name     HA  )  (  resid   15  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  14  and  name    HD#  )  (  resid   15  and  name     HN  )   2.715    0.915   0.915 
assign (  resid  14  and  name    HB1  )  (  resid   15  and  name     HN  )   2.630    0.830   0.830 
assign (  resid  14  and  name     HN  )  (  resid   15  and  name     HN  )   2.575    0.775   0.775 
assign (  resid  14  and  name    HE#  )  (  resid   15  and  name     HN  )   3.325    1.525   1.525 
assign (  resid  14  and  name     HA  )  (  resid   16  and  name    HB#  )   3.445    1.645   1.645 
assign (  resid  14  and  name    HD#  )  (  resid   16  and  name     HN  )   3.385    1.585   1.585 
assign (  resid  14  and  name     HN  )  (  resid   16  and  name     HN  )   3.080    1.280   1.280 
assign (  resid  14  and  name    HB1  )  (  resid   16  and  name     HN  )   3.405    1.605   1.605 
assign (  resid  14  and  name     HA  )  (  resid   17  and  name    HB#  )   3.600    1.800   1.800 
assign (  resid  14  and  name     HA  )  (  resid   17  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid  14  and  name     HN  )  (  resid   17  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  14  and  name    HE#  )  (  resid   29  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  14  and  name    HE#  )  (  resid   29  and  name    HB1  )   3.200    1.400   1.400 
assign (  resid  14  and  name    HE#  )  (  resid   30  and  name     HN  )   3.385    1.585   1.585 
assign (  resid  14  and  name    HD#  )  (  resid   30  and  name     HN  )   3.650    1.850   1.850 

assign (  resid  15  and  name     HA  )  (  resid   15  and  name   HD2#  )   3.045    1.245   1.245 
assign (  resid  15  and  name    HB1  )  (  resid   15  and  name   HD1#  )   2.885    1.085   1.085 
assign (  resid  15  and  name    HB1  )  (  resid   15  and  name   HD2#  )   2.885    1.085   1.085 
assign (  resid  15  and  name    HB2  )  (  resid   15  and  name   HD1#  )   2.835    1.035   1.035 
assign (  resid  15  and  name    HB2  )  (  resid   15  and  name   HD2#  )   2.835    1.035   1.035 
assign (  resid  15  and  name     HN  )  (  resid   15  and  name   HD1#  )   3.090    1.290   1.290 
assign (  resid  15  and  name     HA  )  (  resid   15  and  name   HD1#  )   3.045    1.245   1.245 
assign (  resid  15  and  name     HN  )  (  resid   15  and  name     HG  )   2.950    1.150   1.150 
assign (  resid  15  and  name     HN  )  (  resid   15  and  name    HB2  )   2.800    1.000   1.000 
assign (  resid  15  and  name     HN  )  (  resid   15  and  name    HB1  )   2.510    0.710   0.710 
assign (  resid  15  and  name     HN  )  (  resid   15  and  name   HD2#  )   3.090    1.290   1.290 
assign (  resid  15  and  name    HB1  )  (  resid   16  and  name     HN  )   3.065    1.265   1.265 
assign (  resid  15  and  name     HA  )  (  resid   16  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  15  and  name   HD1#  )  (  resid   16  and  name     HN  )   2.885    1.085   1.085 
assign (  resid  15  and  name    HB2  )  (  resid   16  and  name     HN  )   3.220    1.420   1.420 
assign (  resid  15  and  name   HD2#  )  (  resid   16  and  name     HN  )   2.885    1.085   1.085 
assign (  resid  15  and  name     HN  )  (  resid   16  and  name     HA  )   3.475    1.675   1.675 
assign (  resid  15  and  name     HN  )  (  resid   16  and  name     HN  )   2.570    0.770   0.770 
assign (  resid  15  and  name     HN  )  (  resid   17  and  name     HN  )   3.395    1.595   1.595 
assign (  resid  15  and  name   HD2#  )  (  resid   17  and  name     HN  )   3.485    1.685   1.685 
assign (  resid  15  and  name   HD1#  )  (  resid   17  and  name     HN  )   3.485    1.685   1.685 
assign (  resid  15  and  name   HD1#  )  (  resid   18  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  15  and  name    HB2  )  (  resid   18  and  name     HN  )   3.425    1.625   1.625 
assign (  resid  15  and  name   HD2#  )  (  resid   18  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  15  and  name     HA  )  (  resid   18  and  name     HN  )   2.845    1.045   1.045 

assign (  resid  16  and  name     HA  )  (  resid   16  and  name    HD#  )   3.145    1.345   1.345 
assign (  resid  16  and  name    HB#  )  (  resid   16  and  name    HD#  )   2.860    1.060   1.060 
assign (  resid  16  and  name     HN  )  (  resid   16  and  name    HD#  )   3.540    1.740   1.740 
assign (  resid  16  and  name     HN  )  (  resid   16  and  name    HB#  )   2.215    0.415   0.415 
assign (  resid  16  and  name     HN  )  (  resid   16  and  name    HG1  )   3.200    1.400   1.400 
assign (  resid  16  and  name     HN  )  (  resid   16  and  name    HG2  )   3.200    1.400   1.400 
assign (  resid  16  and  name     HN  )  (  resid   16  and  name    HG#  )   2.795    0.995   0.995 
assign (  resid  16  and  name    HD#  )  (  resid   17  and  name     HN  )   3.245    1.445   1.445 
assign (  resid  16  and  name     HA  )  (  resid   17  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  16  and  name     HN  )  (  resid   17  and  name     HN  )   2.555    0.755   0.755 
assign (  resid  16  and  name    HG1  )  (  resid   17  and  name     HN  )   2.935    1.135   1.135 
assign (  resid  16  and  name    HG2  )  (  resid   17  and  name     HN  )   2.935    1.135   1.135 
assign (  resid  16  and  name     HN  )  (  resid   17  and  name    HG#  )   3.380    1.580   1.580 
assign (  resid  16  and  name     HN  )  (  resid   18  and  name     HN  )   3.160    1.360   1.360 
assign (  resid  16  and  name     HN  )  (  resid   19  and  name     HN  )   3.390    1.590   1.590 
assign (  resid  16  and  name    HB#  )  (  resid   19  and  name     HN  )   3.460    1.660   1.660 

assign (  resid  17  and  name     HN  )  (  resid   17  and  name    HG#  )   2.635    0.835   0.835 
assign (  resid  17  and  name     HN  )  (  resid   17  and  name    HB#  )   2.215    0.415   0.415 
assign (  resid  17  and  name     HN  )  (  resid   18  and  name   HD21  )   3.505    1.705   1.705 
assign (  resid  17  and  name     HN  )  (  resid   18  and  name   HD22  )   3.505    1.705   1.705 
assign (  resid  17  and  name     HN  )  (  resid   18  and  name   HD2#  )   3.185    1.385   1.385 
assign (  resid  17  and  name     HN  )  (  resid   18  and  name     HN  )   2.505    0.705   0.705 
assign (  resid  17  and  name     HA  )  (  resid   18  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  17  and  name    HB#  )  (  resid   18  and  name     HN  )   2.460    0.660   0.660 
assign (  resid  17  and  name    HG#  )  (  resid   18  and  name     HN  )   3.215    1.415   1.415 
assign (  resid  17  and  name     HA  )  (  resid   19  and  name     HN  )   3.075    1.275   1.275 
assign (  resid  17  and  name     HN  )  (  resid   19  and  name     HN  )   2.895    1.095   1.095 
assign (  resid  17  and  name    HB#  )  (  resid   19  and  name     HN  )   3.635    1.835   1.835 

assign (  resid  18  and  name     HN  )  (  resid   18  and  name   HD22  )   2.865    1.065   1.065 
assign (  resid  18  and  name     HN  )  (  resid   18  and  name    HB1  )   2.790    0.990   0.990 
assign (  resid  18  and  name     HN  )  (  resid   18  and  name    HB2  )   2.495    0.695   0.695 
assign (  resid  18  and  name     HN  )  (  resid   18  and  name   HD21  )   2.865    1.065   1.065 
assign (  resid  18  and  name     HN  )  (  resid   18  and  name   HD2#  )   2.600    0.800   0.800 
assign (  resid  18  and  name     HN  )  (  resid   19  and  name     HN  )   2.430    0.630   0.630 
assign (  resid  18  and  name   HD22  )  (  resid   19  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  18  and  name   HD21  )  (  resid   19  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  18  and  name    HB1  )  (  resid   19  and  name     HN  )   3.170    1.370   1.370 
assign (  resid  18  and  name    HB2  )  (  resid   19  and  name     HN  )   2.665    0.865   0.865 
assign (  resid  18  and  name     HN  )  (  resid   19  and  name    HA2  )   3.425    1.625   1.625 
assign (  resid  18  and  name     HN  )  (  resid   19  and  name    HA1  )   3.425    1.625   1.625 
assign (  resid  18  and  name   HD2#  )  (  resid   19  and  name     HN  )   3.230    1.430   1.430 

assign (  resid  19  and  name     HN  )  (  resid   20  and  name    HG#  )   3.615    1.815   1.815 
assign (  resid  19  and  name    HA#  )  (  resid   20  and  name     HN  )   2.295    0.495   0.495 

assign (  resid  20  and  name     HN  )  (  resid   20  and  name    HG#  )   2.430    0.630   0.630 
assign (  resid  20  and  name     HN  )  (  resid   20  and  name    HB#  )   2.315    0.515   0.515 
assign (  resid  20  and  name     HN  )  (  resid   20  and  name    HE#  )   2.910    1.110   1.110 
assign (  resid  20  and  name    HB#  )  (  resid   21  and  name     HN  )   2.480    0.680   0.680 
assign (  resid  20  and  name    HG#  )  (  resid   21  and  name     HN  )   3.160    1.360   1.360 
assign (  resid  20  and  name     HN  )  (  resid   21  and  name     HN  )   3.230    1.430   1.430 
assign (  resid  20  and  name     HA  )  (  resid   21  and  name     HN  )   2.275    0.475   0.475 


assign (  resid  21  and  name     HN  )  (  resid   21  and  name    HB2  )   2.865    1.065   1.065 
assign (  resid  21  and  name     HN  )  (  resid   21  and  name    HB1  )   2.865    1.065   1.065 
assign (  resid  21  and  name     HN  )  (  resid   21  and  name    HB#  )   2.555    0.755   0.755 
assign (  resid  21  and  name     HA  )  (  resid   22  and  name     HN  )   2.310    0.510   0.510 
assign (  resid  21  and  name    HB2  )  (  resid   22  and  name     HN  )   2.780    0.980   0.980 
assign (  resid  21  and  name    HB1  )  (  resid   22  and  name     HN  )   2.780    0.980   0.980 
assign (  resid  21  and  name     HN  )  (  resid   22  and  name     HN  )   3.100    1.300   1.300 
assign (  resid  21  and  name    HB#  )  (  resid   22  and  name     HN  )   2.445    0.645   0.645 
assign (  resid  21  and  name    HB#  )  (  resid   22  and  name   HG2#  )   3.300    1.500   1.500 
assign (  resid  21  and  name    HB#  )  (  resid   25  and  name     HB  )   2.915    1.115   1.115 
assign (  resid  21  and  name    HB#  )  (  resid   25  and  name   HG2#  )   2.730    0.930   0.930 
assign (  resid  21  and  name    HB2  )  (  resid   25  and  name   HG2#  )   3.135    1.335   1.335 
assign (  resid  21  and  name    HB1  )  (  resid   25  and  name   HG2#  )   3.135    1.335   1.335 
assign (  resid  21  and  name     HN  )  (  resid   25  and  name   HG2#  )   3.345    1.545   1.545 
assign (  resid  21  and  name     HN  )  (  resid   26  and  name   HD1#  )   3.430    1.630   1.630 
assign (  resid  21  and  name    HB#  )  (  resid   26  and  name     HN  )   3.135    1.335   1.335 
assign (  resid  21  and  name    HB#  )  (  resid   26  and  name   HG12  )   3.265    1.465   1.465 
assign (  resid  21  and  name    HB#  )  (  resid   26  and  name   HD1#  )   3.570    1.770   1.770 
assign (  resid  21  and  name     HN  )  (  resid   26  and  name     HN  )   3.650    1.850   1.850 

assign (  resid  22  and  name     HN  )  (  resid   22  and  name   HG1#  )   2.355    0.555   0.555 
assign (  resid  22  and  name     HN  )  (  resid   22  and  name   HG2#  )   2.310    0.510   0.510 
assign (  resid  22  and  name   HG2#  )  (  resid   23  and  name     HN  )   2.855    1.055   1.055 
assign (  resid  22  and  name     HN  )  (  resid   23  and  name     HN  )   3.295    1.495   1.495 
assign (  resid  22  and  name     HN  )  (  resid   24  and  name     HN  )   3.535    1.735   1.735 
assign (  resid  22  and  name     HA  )  (  resid   24  and  name     HN  )   3.215    1.415   1.415 
assign (  resid  22  and  name     HB  )  (  resid   25  and  name     HN  )   3.410    1.610   1.610 
assign (  resid  22  and  name     HN  )  (  resid   25  and  name     HN  )   2.860    1.060   1.060 
assign (  resid  22  and  name   HG1#  )  (  resid   25  and  name     HN  )   2.285    0.485   0.485 
assign (  resid  22  and  name     HN  )  (  resid   25  and  name     HB  )   3.030    1.230   1.230 
assign (  resid  22  and  name     HN  )  (  resid   26  and  name     HN  )   3.395    1.595   1.595 
assign (  resid  22  and  name   HG2#  )  (  resid   60  and  name     HN  )   4.500    2.700   1.500 ! added 12/01/2015

assign (  resid  23  and  name     HN  )  (  resid   23  and  name    HB#  )   2.355    0.555   0.555 
assign (  resid  23  and  name     HN  )  (  resid   24  and  name    HB2  )   3.650    1.850   1.850 
assign (  resid  23  and  name     HN  )  (  resid   24  and  name    HB1  )   3.650    1.850   1.850 
assign (  resid  23  and  name     HN  )  (  resid   24  and  name     HN  )   2.685    0.885   0.885 
assign (  resid  23  and  name     HA  )  (  resid   24  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  23  and  name    HB#  )  (  resid   24  and  name     HN  )   2.310    0.510   0.510 
assign (  resid  23  and  name    HB#  )  (  resid   24  and  name     HA  )   2.935    1.135   1.135 
assign (  resid  23  and  name     HN  )  (  resid   25  and  name     HN  )   3.295    1.495   1.495 
assign (  resid  23  and  name     HA  )  (  resid   25  and  name     HN  )   3.170    1.370   1.370 
assign (  resid  23  and  name     HN  )  (  resid   26  and  name   HD1#  )   3.280    1.480   1.480 
assign (  resid  23  and  name     HN  )  (  resid   26  and  name   HG11  )   3.415    1.615   1.615 
assign (  resid  23  and  name     HA  )  (  resid   26  and  name   HD1#  )   2.815    1.015   1.015 
assign (  resid  23  and  name     HA  )  (  resid   26  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid  23  and  name    HB#  )  (  resid   38  and  name   HD21  )   3.065    1.265   1.265 
assign (  resid  23  and  name    HB#  )  (  resid   38  and  name   HD22  )   3.165    1.365   1.365 
assign (  resid  23  and  name     HN  )  (  resid   41  and  name   HD1#  )   4.500    2.700   1.500 ! originally 41 HD2#, 3.39, 1.59. 1.59 changed 12/01/2015
assign (  resid  23  and  name    HB#  )  (  resid   41  and  name   HD1#  )   4.500    2.700   1.500 ! originally 41 HD2#, changed 12/01/2015
assign (  resid  23  and  name     HN  )  (  resid   60  and  name   HD1   )   4.500    2.700   1.500 ! added 12/01/2015
assign (  resid  23  and  name     HN  )  (  resid   60  and  name   HE2   )   4.500    2.700   1.500 ! added 12/01/2015
assign (  resid  23  and  name     HN  )  (  resid   60  and  name   HN    )   4.500    2.700   1.500 ! added 12/01/2015

assign (  resid  24  and  name     HN  )  (  resid   24  and  name    HB#  )   2.195    0.395   0.395 
assign (  resid  24  and  name     HN  )  (  resid   24  and  name    HB2  )   2.440    0.640   0.640 
assign (  resid  24  and  name     HN  )  (  resid   24  and  name    HB1  )   2.440    0.640   0.640 
assign (  resid  24  and  name     HN  )  (  resid   24  and  name    HD#  )   2.850    1.050   1.050 
assign (  resid  24  and  name     HA  )  (  resid   24  and  name    HD#  )   2.665    0.865   0.865 
assign (  resid  24  and  name     HN  )  (  resid   25  and  name    HG1  )   3.225    1.425   1.425 
assign (  resid  24  and  name     HA  )  (  resid   25  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  24  and  name    HB#  )  (  resid   25  and  name     HN  )   2.455    0.655   0.655 
assign (  resid  24  and  name     HN  )  (  resid   25  and  name     HN  )   2.630    0.830   0.830 
assign (  resid  24  and  name    HD#  )  (  resid   25  and  name     HN  )   2.645    0.845   0.845 
assign (  resid  24  and  name     HN  )  (  resid   26  and  name     HN  )   3.090    1.290   1.290 
assign (  resid  24  and  name    HD#  )  (  resid   26  and  name     HN  )   3.405    1.605   1.605 
assign (  resid  24  and  name     HN  )  (  resid   26  and  name   HG11  )   3.580    1.780   1.780 
assign (  resid  24  and  name    HD#  )  (  resid   27  and  name     HN  )   3.270    1.470   1.470 
assign (  resid  24  and  name     HA  )  (  resid   27  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014
assign (  resid  24  and  name     HA  )  (  resid   27  and  name    HB#  )   2.800    1.000   1.000 
assign (  resid  24  and  name    HD#  )  (  resid   28  and  name     HN  )   2.960    1.160   1.160 

assign (  resid  25  and  name     HN  )  (  resid   25  and  name    HG1  )   3.030    1.230   1.230 
assign (  resid  25  and  name     HN  )  (  resid   25  and  name     HB  )   2.425    0.625   0.625  
assign (  resid  25  and  name     HA  )  (  resid   25  and  name   HG2#  )   2.615    0.815   0.815 
assign (  resid  25  and  name     HN  )  (  resid   25  and  name   HG2#  )   3.060    1.260   1.260 
assign (  resid  25  and  name     HN  )  (  resid   26  and  name   HG11  )   3.065    1.265   1.265 
assign (  resid  25  and  name     HN  )  (  resid   26  and  name   HD1#  )   3.550    1.750   1.750 
assign (  resid  25  and  name     HA  )  (  resid   26  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  25  and  name    HG1  )  (  resid   26  and  name     HN  )   3.330    1.530   1.530 
assign (  resid  25  and  name     HB  )  (  resid   26  and  name     HN  )   2.570    0.770   0.770 
assign (  resid  25  and  name   HG2#  )  (  resid   26  and  name     HN  )   2.635    0.835   0.835 
assign (  resid  25  and  name     HN  )  (  resid   26  and  name     HN  )   2.585    0.785   0.785 
assign (  resid  25  and  name     HB  )  (  resid   26  and  name   HG12  )   3.365    1.565   1.565
assign (  resid  25  and  name     HN  )  (  resid   27  and  name     HN  )   3.130    1.330   1.330 
assign (  resid  25  and  name   HG2#  )  (  resid   28  and  name     HN  )   3.010    1.210   1.210 
assign (  resid  25  and  name     HA  )  (  resid   28  and  name     HN  )   2.565    0.765   0.765 
assign (  resid  25  and  name     HA  )  (  resid   28  and  name    HB#  )   2.905    1.105   1.105 
assign (  resid  25  and  name   HG2#  )  (  resid   29  and  name     HN  )   2.810    1.010   1.010 
assign (  resid  25  and  name   HG2#  )  (  resid   29  and  name    HG#  )   2.765    0.965   0.965
assign (  resid  25  and  name     HN  )  (  resid   29  and  name    HG#  )   3.650    1.850   1.850
assign (  resid  25  and  name   HG2#  )  (  resid   30  and  name     HN  )   3.650    1.850   1.850 

assign (  resid  26  and  name     HN  )  (  resid   26  and  name   HG12  )   3.420    1.620   1.620 
assign (  resid  26  and  name     HB  )  (  resid   26  and  name   HD1#  )   2.820    1.020   1.020 
assign (  resid  26  and  name   HG2#  )  (  resid   26  and  name   HD1#  )   2.520    0.720   0.720 
assign (  resid  26  and  name     HN  )  (  resid   26  and  name   HG11  )   2.505    0.705   0.705 
assign (  resid  26  and  name     HN  )  (  resid   26  and  name   HD1#  )   2.690    0.890   0.890 
assign (  resid  26  and  name     HN  )  (  resid   26  and  name   HG2#  )   2.800    1.000   1.000 
assign (  resid  26  and  name     HN  )  (  resid   26  and  name     HB  )   2.405    0.605   0.605 
assign (  resid  26  and  name     HB  )  (  resid   27  and  name    HB#  )   2.920    1.120   1.120 
assign (  resid  26  and  name   HG2#  )  (  resid   27  and  name    HB#  )   3.015    1.215   1.215 
assign (  resid  26  and  name     HA  )  (  resid   27  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  26  and  name     HN  )  (  resid   27  and  name     HN  )   2.595    0.795   0.795 
assign (  resid  26  and  name     HB  )  (  resid   27  and  name     HN  )   2.440    0.640   0.640 
assign (  resid  26  and  name   HD1#  )  (  resid   27  and  name     HN  )   3.180    1.380   1.380 
assign (  resid  26  and  name   HG2#  )  (  resid   27  and  name     HN  )   2.680    0.880   0.880 
assign (  resid  26  and  name     HN  )  (  resid   28  and  name     HN  )   3.155    1.355   1.355 
assign (  resid  26  and  name   HG2#  )  (  resid   28  and  name     HN  )   3.445    1.645   1.645 
assign (  resid  26  and  name     HA  )  (  resid   29  and  name     HN  )   2.970    1.170   1.170 
assign (  resid  26  and  name   HG2#  )  (  resid   29  and  name     HN  )   3.245    1.445   1.445 
assign (  resid  26  and  name     HN  )  (  resid   29  and  name    HG#  )   2.880    1.080   1.080 
assign (  resid  26  and  name   HG2#  )  (  resid   29  and  name    HG#  )   2.965    1.165   1.165 
assign (  resid  26  and  name     HA  )  (  resid   30  and  name     HN  )   3.355    1.555   1.555 
assign (  resid  26  and  name     HB  )  (  resid   37  and  name   HG1#  )   3.040    1.240   1.240 
assign (  resid  26  and  name     HB  )  (  resid   37  and  name   HG2#  )   3.040    1.240   1.240 
assign (  resid  26  and  name   HG2#  )  (  resid   37  and  name   HG1#  )   2.650    0.850   0.850 
assign (  resid  26  and  name   HG2#  )  (  resid   37  and  name   HG2#  )   2.650    0.850   0.850 
assign (  resid  26  and  name   HG2#  )  (  resid   37  and  name     HN  )   3.620    1.820   1.820 
assign (  resid  26  and  name     HB  )  (  resid   37  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  26  and  name   HD1#  )  (  resid   37  and  name     HA  )   3.580    1.780   1.780 
assign (  resid  26  and  name   HG2#  )  (  resid   37  and  name     HA  )   3.060    1.260   1.260 
assign (  resid  26  and  name   HD1#  )  (  resid   41  and  name   HD2#  )   2.935    1.135   1.135 

assign (  resid  27  and  name     HN  )  (  resid   27  and  name    HB#  )   2.270    0.470   0.470 
assign (  resid  27  and  name     HN  )  (  resid   28  and  name     HN  )   2.555    0.755   0.755 
assign (  resid  27  and  name    HB#  )  (  resid   28  and  name     HN  )   2.385    0.585   0.585 
assign (  resid  27  and  name     HA  )  (  resid   28  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  27  and  name    HB#  )  (  resid   28  and  name    HB#  )   3.120    1.320   1.320 
assign (  resid  27  and  name     HA  )  (  resid   29  and  name     HN  )   3.200    1.400   1.400 
assign (  resid  27  and  name    HB#  )  (  resid   29  and  name     HN  )   3.365    1.565   1.565 
assign (  resid  27  and  name     HN  )  (  resid   29  and  name    HG#  )   3.375    1.575   1.575 
assign (  resid  27  and  name     HA  )  (  resid   30  and  name   HD1#  )   3.115    1.315   1.315 
assign (  resid  27  and  name     HA  )  (  resid   30  and  name     HN  )   2.920    1.120   1.120 
assign (  resid  27  and  name     HA  )  (  resid   31  and  name     HN  )   3.255    1.455   1.455 
assign (  resid  27  and  name    HB#  )  (  resid   34  and  name     HA  )   2.720    0.920   0.920 
assign (  resid  27  and  name    HB#  )  (  resid   37  and  name     HB  )   3.195    1.395   1.395 

assign (  resid  28  and  name     HN  )  (  resid   28  and  name    HB#  )   2.255    0.455   0.455 
assign (  resid  28  and  name     HN  )  (  resid   28  and  name    HG#  )   2.545    0.745   0.745 
assign (  resid  28  and  name     HN  )  (  resid   29  and  name     HA  )   3.630    1.830   1.830 
assign (  resid  28  and  name     HN  )  (  resid   29  and  name     HN  )   2.540    0.740   0.740  ! added 05/09/2014
assign (  resid  28  and  name     HA  )  (  resid   29  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  28  and  name     HN  )  (  resid   29  and  name    HG#  )   3.055    1.255   1.255 
assign (  resid  28  and  name    HB#  )  (  resid   29  and  name     HN  )   2.440    0.640   0.640 
assign (  resid  28  and  name    HG#  )  (  resid   29  and  name     HN  )   3.505    1.705   1.705 
assign (  resid  28  and  name     HA  )  (  resid   30  and  name     HN  )   3.140    1.340   1.340 

assign (  resid  29  and  name     HN  )  (  resid   29  and  name    HG#  )   2.410    0.610   0.610
assign (  resid  29  and  name     HN  )  (  resid   29  and  name    HB2  )   2.440    0.640   0.640 
assign (  resid  29  and  name     HN  )  (  resid   30  and  name     HN  )   2.510    0.710   0.710 
assign (  resid  29  and  name    HG#  )  (  resid   30  and  name     HN  )   3.030    1.230   1.230 
assign (  resid  29  and  name     HA  )  (  resid   30  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  29  and  name    HB1  )  (  resid   30  and  name     HN  )   2.905    1.105   1.105 
assign (  resid  29  and  name    HB2  )  (  resid   30  and  name     HN  )   2.675    0.875   0.875 
assign (  resid  29  and  name     HN  )  (  resid   30  and  name     HA  )   3.645    1.845   1.845 
assign (  resid  29  and  name     HA  )  (  resid   31  and  name     HN  )   3.065    1.265   1.265 
assign (  resid  29  and  name    HB2  )  (  resid   31  and  name     HN  )   3.305    1.505   1.505 

assign (  resid  30  and  name     HA  )  (  resid   30  and  name   HG2#  )   2.675    0.875   0.875 
assign (  resid  30  and  name     HB  )  (  resid   30  and  name   HD1#  )   2.675    0.875   0.875 
assign (  resid  30  and  name   HG2#  )  (  resid   30  and  name   HD1#  )   2.460    0.660   0.660 
assign (  resid  30  and  name   HG2#  )  (  resid   30  and  name   HG11  )   2.955    1.155   1.155 
assign (  resid  30  and  name   HG2#  )  (  resid   30  and  name   HG12  )   2.955    1.155   1.155 
assign (  resid  30  and  name     HN  )  (  resid   30  and  name     HB  )   2.770    0.970   0.970 
assign (  resid  30  and  name     HN  )  (  resid   30  and  name   HG12  )   2.590    0.790   0.790 
assign (  resid  30  and  name     HN  )  (  resid   30  and  name   HG11  )   2.590    0.790   0.790 
assign (  resid  30  and  name     HN  )  (  resid   30  and  name   HG2#  )   2.425    0.625   0.625 
assign (  resid  30  and  name     HN  )  (  resid   30  and  name   HD1#  )   2.835    1.035   1.035 
assign (  resid  30  and  name     HN  )  (  resid   30  and  name   HG1#  )   2.360    0.560   0.560 
assign (  resid  30  and  name   HG2#  )  (  resid   31  and  name     HN  )   3.025    1.225   1.225 
assign (  resid  30  and  name   HD1#  )  (  resid   31  and  name     HN  )   3.295    1.495   1.495 
assign (  resid  30  and  name     HB  )  (  resid   31  and  name     HN  )   3.125    1.325   1.325 
assign (  resid  30  and  name   HG11  )  (  resid   31  and  name     HN  )   2.870    1.070   1.070 
assign (  resid  30  and  name   HG12  )  (  resid   31  and  name     HN  )   2.870    1.070   1.070 
assign (  resid  30  and  name     HN  )  (  resid   31  and  name    HA#  )   3.485    1.685   1.685 
assign (  resid  30  and  name   HG1#  )  (  resid   31  and  name     HN  )   2.615    0.815   0.815 
assign (  resid  30  and  name     HN  )  (  resid   31  and  name     HN  )   2.425    0.625   0.625 
assign (  resid  30  and  name     HA  )  (  resid   32  and  name     HN  )   3.275    1.475   1.475 
assign (  resid  30  and  name     HN  )  (  resid   32  and  name     HN  )   3.130    1.330   1.330 
assign (  resid  30  and  name   HD1#  )  (  resid   32  and  name     HN  )   2.925    1.125   1.125 
assign (  resid  30  and  name   HG11  )  (  resid   32  and  name     HN  )   2.730    0.930   0.930 
assign (  resid  30  and  name   HG12  )  (  resid   32  and  name     HN  )   2.730    0.930   0.930 
assign (  resid  30  and  name     HB  )  (  resid   32  and  name     HN  )   2.955    1.155   1.155 
assign (  resid  30  and  name     HN  )  (  resid   32  and  name     HG  )   3.465    1.665   1.665 
assign (  resid  30  and  name     HN  )  (  resid   32  and  name   HD2#  )   3.650    1.850   1.850 
assign (  resid  30  and  name   HD1#  )  (  resid   32  and  name   HD1#  )   2.770    0.970   0.970 
assign (  resid  30  and  name   HG1#  )  (  resid   32  and  name     HN  )   2.475    0.675   0.675 
assign (  resid  30  and  name   HD1#  )  (  resid   36  and  name   HG2#  )   2.940    1.140   1.140 
assign (  resid  30  and  name   HD1#  )  (  resid   37  and  name     HA  )   3.360    1.560   1.560 
assign (  resid  30  and  name   HD1#  )  (  resid   37  and  name     HN  )   3.650    1.850   1.850 

assign (  resid  31  and  name     HN  )  (  resid   31  and  name    HA2  )   2.370    0.570   0.570 
assign (  resid  31  and  name     HN  )  (  resid   31  and  name    HA1  )   2.370    0.570   0.570 
assign (  resid  31  and  name     HN  )  (  resid   32  and  name     HG  )   3.375    1.575   1.575 
assign (  resid  31  and  name     HN  )  (  resid   32  and  name   HD2#  )   3.310    1.510   1.510 
assign (  resid  31  and  name    HA#  )  (  resid   32  and  name     HN  )   2.455    0.655   0.655 
assign (  resid  31  and  name    HA#  )  (  resid   32  and  name     HG  )   3.200    1.400   1.400 

assign (  resid  32  and  name     HN  )  (  resid   32  and  name    HB#  )   2.475    0.675   0.675 
assign (  resid  32  and  name     HN  )  (  resid   32  and  name   HD2#  )   2.795    0.995   0.995 
assign (  resid  32  and  name     HN  )  (  resid   32  and  name     HG  )   2.605    0.805   0.805 
assign (  resid  32  and  name     HN  )  (  resid   33  and  name     HN  )   3.310    1.510   1.510 
assign (  resid  32  and  name    HB2  )  (  resid   33  and  name     HN  )   2.740    0.940   0.940 
assign (  resid  32  and  name    HB1  )  (  resid   33  and  name     HN  )   2.740    0.940   0.940 
assign (  resid  32  and  name   HD1#  )  (  resid   33  and  name     HN  )   3.145    1.345   1.345 
assign (  resid  32  and  name   HD2#  )  (  resid   33  and  name     HN  )   2.900    1.100   1.100 
assign (  resid  32  and  name    HB#  )  (  resid   33  and  name     HN  )   2.435    0.635   0.635 
assign (  resid  32  and  name   HD1#  )  (  resid   36  and  name   HG2#  )   2.720    0.920   0.920 

assign (  resid  33  and  name     HN  )  (  resid   33  and  name    HB1  )   2.630    0.830   0.830 
assign (  resid  33  and  name     HN  )  (  resid   33  and  name    HB2  )   2.630    0.830   0.830 
assign (  resid  33  and  name     HN  )  (  resid   33  and  name    HB#  )   2.400    0.600   0.600 
assign (  resid  33  and  name    HB#  )  (  resid   35  and  name     HN  )   3.345    1.545   1.545 
assign (  resid  33  and  name     HA  )  (  resid   36  and  name     HN  )   3.490    1.690   1.690 
assign (  resid  33  and  name    HB1  )  (  resid   36  and  name     HN  )   3.130    1.330   1.330 
assign (  resid  33  and  name    HB2  )  (  resid   36  and  name     HN  )   3.130    1.330   1.330 
assign (  resid  33  and  name     HN  )  (  resid   36  and  name     HB  )   3.120    1.320   1.320 
assign (  resid  33  and  name     HN  )  (  resid   36  and  name   HG2#  )   2.930    1.130   1.130 
assign (  resid  33  and  name    HB#  )  (  resid   36  and  name     HN  )   2.735    0.935   0.935 

assign (  resid  34  and  name    HB#  )  (  resid   35  and  name     HN  )   2.995    1.195   1.195 
assign (  resid  34  and  name    HG#  )  (  resid   35  and  name     HN  )   3.210    1.410   1.410 
assign (  resid  34  and  name     HA  )  (  resid   35  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  34  and  name     HN  )  (  resid   35  and  name     HN  )   2.540    0.740   0.740  ! added 05/09/2014
assign (  resid  34  and  name     HA  )  (  resid   37  and  name     HB  )   2.815    1.015   1.015 
assign (  resid  34  and  name     HA  )  (  resid   37  and  name     HN  )   2.575    0.775   0.775 

assign (  resid  35  and  name     HN  )  (  resid   35  and  name    HB#  )   2.875    1.075   1.075 
assign (  resid  35  and  name    HB#  )  (  resid   36  and  name     HN  )   2.455    0.655   0.655 
assign (  resid  35  and  name     HN  )  (  resid   36  and  name     HN  )   2.815    1.015   1.015 
assign (  resid  35  and  name     HA  )  (  resid   36  and  name     HN  )   2.680    0.880   0.880 
assign (  resid  35  and  name     HN  )  (  resid   36  and  name   HG2#  )   3.350    1.550   1.550 
assign (  resid  35  and  name     HA  )  (  resid   38  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014

assign (  resid  36  and  name     HA  )  (  resid   36  and  name   HG2#  )   2.695    0.895   0.895 
assign (  resid  36  and  name     HN  )  (  resid   36  and  name     HB  )   2.540    0.740   0.740 
assign (  resid  36  and  name     HN  )  (  resid   36  and  name   HG2#  )   2.545    0.745   0.745 
assign (  resid  36  and  name   HG2#  )  (  resid   37  and  name     HN  )   3.195    1.395   1.395 
assign (  resid  36  and  name     HA  )  (  resid   37  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  36  and  name     HN  )  (  resid   37  and  name     HN  )   2.540    0.740   0.740  ! added 05/09/2014
assign (  resid  36  and  name     HA  )  (  resid   39  and  name    HB#  )   2.865    1.065   1.065 
assign (  resid  36  and  name     HA  )  (  resid   39  and  name    HG1  )   3.650    1.850   1.850 
assign (  resid  36  and  name     HA  )  (  resid   39  and  name     HN  )   2.845    1.045   1.045 
assign (  resid  36  and  name   HG2#  )  (  resid   40  and  name    HD2  )   2.745    0.945   0.945 
assign (  resid  36  and  name     HA  )  (  resid   40  and  name     HN  )   3.365    1.565   1.565 

assign (  resid  37  and  name     HA  )  (  resid   37  and  name   HG2#  )   2.845    1.045   1.045 
assign (  resid  37  and  name     HA  )  (  resid   37  and  name   HG1#  )   2.845    1.045   1.045 
assign (  resid  37  and  name     HN  )  (  resid   37  and  name     HB  )   2.350    0.550   0.550 
assign (  resid  37  and  name     HB  )  (  resid   38  and  name     HN  )   2.520    0.720   0.720 
assign (  resid  37  and  name     HN  )  (  resid   38  and  name     HN  )   2.505    0.705   0.705 
assign (  resid  37  and  name     HA  )  (  resid   39  and  name     HN  )   3.170    1.370   1.370 
assign (  resid  37  and  name     HN  )  (  resid   39  and  name     HN  )   3.060    1.260   1.260 
assign (  resid  37  and  name     HA  )  (  resid   40  and  name    HD2  )   3.145    1.345   1.345 
assign (  resid  37  and  name     HA  )  (  resid   40  and  name    HB2  )   3.285    1.485   1.485 
assign (  resid  37  and  name     HA  )  (  resid   40  and  name    HB1  )   3.190    1.390   1.390 
assign (  resid  37  and  name     HA  )  (  resid   40  and  name     HN  )   2.785    0.985   0.985 
assign (  resid  37  and  name     HN  )  (  resid   40  and  name     HN  )   3.380    1.580   1.580 
assign (  resid  37  and  name     HB  )  (  resid   40  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  37  and  name     HN  )  (  resid   40  and  name    HD2  )   3.220    1.420   1.420 
assign (  resid  37  and  name     HA  )  (  resid   41  and  name     HN  )   3.010    1.210   1.210 
assign (  resid  37  and  name     HN  )  (  resid   41  and  name   HD2#  )   3.650    1.850   1.850 

assign (  resid  38  and  name     HN  )  (  resid   38  and  name    HB1  )   2.695    0.895   0.895 
assign (  resid  38  and  name     HN  )  (  resid   38  and  name    HB2  )   2.410    0.610   0.610 
assign (  resid  38  and  name     HN  )  (  resid   38  and  name   HD21  )   2.935    1.135   1.135 
assign (  resid  38  and  name     HA  )  (  resid   38  and  name   HD22  )   3.265    1.465   1.465 
assign (  resid  38  and  name     HA  )  (  resid   38  and  name   HD21  )   3.010    1.210   1.210 
assign (  resid  38  and  name     HN  )  (  resid   38  and  name   HD22  )   3.185    1.385   1.385 
assign (  resid  38  and  name     HA  )  (  resid   39  and  name     HN  )   2.680    0.880   0.880 
assign (  resid  38  and  name     HN  )  (  resid   39  and  name     HN  )   2.535    0.735   0.735 
assign (  resid  38  and  name    HB1  )  (  resid   39  and  name     HN  )   2.630    0.830   0.830 
assign (  resid  38  and  name   HD21  )  (  resid   39  and  name     HN  )   3.225    1.425   1.425 
assign (  resid  38  and  name    HB2  )  (  resid   39  and  name     HN  )   2.585    0.785   0.785 
assign (  resid  38  and  name     HA  )  (  resid   40  and  name     HN  )   3.160    1.360   1.360 
assign (  resid  38  and  name     HN  )  (  resid   40  and  name     HN  )   3.105    1.305   1.305 
assign (  resid  38  and  name    HB2  )  (  resid   40  and  name     HN  )   3.505    1.705   1.705 
assign (  resid  38  and  name     HA  )  (  resid   41  and  name    HB1  )   3.225    1.425   1.425 
assign (  resid  38  and  name     HA  )  (  resid   41  and  name   HD2#  )   2.760    0.960   0.960 
assign (  resid  38  and  name     HA  )  (  resid   41  and  name    HB2  )   3.320    1.520   1.520 
assign (  resid  38  and  name     HA  )  (  resid   41  and  name     HG  )   3.195    1.395   1.395 
assign (  resid  38  and  name     HN  )  (  resid   41  and  name   HD2#  )   3.020    1.220   1.220 
assign (  resid  38  and  name    HB1  )  (  resid   42  and  name     HN  )   3.615    1.815   1.815 
assign (  resid  38  and  name     HA  )  (  resid   41  and  name     HN  )   2.740    0.940   0.940 
assign (  resid  38  and  name     HA  )  (  resid   42  and  name     HN  )   3.080    1.280   1.280 

assign (  resid  39  and  name     HA  )  (  resid   39  and  name    HG1  )   2.885    1.085   1.085 
assign (  resid  39  and  name     HN  )  (  resid   39  and  name    HB#  )   2.250    0.450   0.450 
assign (  resid  39  and  name     HN  )  (  resid   39  and  name    HG2  )   2.920    1.120   1.120 
assign (  resid  39  and  name     HN  )  (  resid   39  and  name    HG1  )   3.190    1.390   1.390 
assign (  resid  39  and  name     HN  )  (  resid   39  and  name    HD#  )   3.105    1.305   1.305 
assign (  resid  39  and  name    HG1  )  (  resid   40  and  name     HN  )   3.015    1.215   1.215 
assign (  resid  39  and  name     HA  )  (  resid   40  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  39  and  name     HN  )  (  resid   40  and  name    HD2  )   3.650    1.850   1.850 
assign (  resid  39  and  name     HN  )  (  resid   40  and  name    HB2  )   3.320    1.520   1.520 
assign (  resid  39  and  name    HB#  )  (  resid   40  and  name     HN  )   2.615    0.815   0.815 
assign (  resid  39  and  name    HG2  )  (  resid   40  and  name     HN  )   2.765    0.965   0.965 
assign (  resid  39  and  name    HD#  )  (  resid   40  and  name     HN  )   3.170    1.370   1.370 
assign (  resid  39  and  name     HN  )  (  resid   40  and  name     HN  )   2.540    0.740   0.740  ! added 05/09/2014
assign (  resid  39  and  name    HG2  )  (  resid   41  and  name     HN  )   3.615    1.815   1.815 
assign (  resid  39  and  name     HN  )  (  resid   41  and  name     HN  )   3.145    1.345   1.345 
assign (  resid  39  and  name     HA  )  (  resid   41  and  name     HN  )   3.345    1.545   1.545 
assign (  resid  39  and  name     HN  )  (  resid   41  and  name   HD2#  )   3.365    1.565   1.565 
assign (  resid  39  and  name     HA  )  (  resid   42  and  name     HN  )   2.765    0.965   0.965 
assign (  resid  39  and  name    HB#  )  (  resid   42  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  39  and  name     HN  )  (  resid   42  and  name    HB#  )   3.570    1.770   1.770 
assign (  resid  39  and  name    HB#  )  (  resid   43  and  name   HD2#  )   3.495    1.695   1.695 
assign (  resid  39  and  name    HG2  )  (  resid   43  and  name   HD2#  )   3.545    1.745   1.745 
assign (  resid  39  and  name    HG1  )  (  resid   43  and  name   HD2#  )   3.205    1.405   1.405 
assign (  resid  39  and  name     HA  )  (  resid   43  and  name     HN  )   3.325    1.525   1.525 

assign (  resid  40  and  name     HN  )  (  resid   40  and  name    HD2  )   2.730    0.930   0.930 
assign (  resid  40  and  name     HN  )  (  resid   40  and  name    HB1  )   2.755    0.955   0.955 
assign (  resid  40  and  name     HN  )  (  resid   40  and  name    HB2  )   2.470    0.670   0.670 
assign (  resid  40  and  name     HN  )  (  resid   41  and  name     HN  )   2.495    0.695   0.695 
assign (  resid  40  and  name     HA  )  (  resid   41  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  40  and  name    HD2  )  (  resid   41  and  name     HN  )   3.580    1.780   1.780 
assign (  resid  40  and  name    HB1  )  (  resid   41  and  name     HN  )   2.705    0.905   0.905 
assign (  resid  40  and  name    HB2  )  (  resid   41  and  name     HN  )   2.655    0.855   0.855 
assign (  resid  40  and  name     HN  )  (  resid   41  and  name   HD2#  )   3.310    1.510   1.510 
assign (  resid  40  and  name     HN  )  (  resid   41  and  name   HD1#  )   3.465    1.665   1.665 
assign (  resid  40  and  name     HN  )  (  resid   41  and  name     HA  )   3.650    1.850   1.850 
assign (  resid  40  and  name     HN  )  (  resid   41  and  name    HB1  )   3.630    1.830   1.830 
assign (  resid  40  and  name     HN  )  (  resid   41  and  name     HG  )   3.025    1.225   1.225 
assign (  resid  40  and  name     HA  )  (  resid   42  and  name     HN  )   3.195    1.395   1.395 
assign (  resid  40  and  name     HN  )  (  resid   42  and  name    HB#  )   3.570    1.770   1.770 
assign (  resid  40  and  name    HB1  )  (  resid   42  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  40  and  name     HN  )  (  resid   42  and  name     HN  )   3.155    1.355   1.355 
assign (  resid  40  and  name     HN  )  (  resid   43  and  name     HN  )   3.545    1.745   1.745 
assign (  resid  40  and  name     HA  )  (  resid   43  and  name   HD2#  )   3.085    1.285   1.285 
assign (  resid  40  and  name    HB1  )  (  resid   43  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  40  and  name     HA  )  (  resid   43  and  name     HN  )   3.000    1.200   1.500  ! added 05/09/2014

assign (  resid  41  and  name     HA  )  (  resid   41  and  name   HD2#  )   3.160    1.360   1.360 
assign (  resid  41  and  name     HA  )  (  resid   41  and  name     HG  )   2.875    1.075   1.075 
assign (  resid  41  and  name     HN  )  (  resid   41  and  name   HD1#  )   2.705    0.905   0.905 
assign (  resid  41  and  name     HN  )  (  resid   41  and  name    HB2  )   2.740    0.940   0.940 
assign (  resid  41  and  name     HN  )  (  resid   41  and  name   HD2#  )   2.540    0.740   0.740 
assign (  resid  41  and  name     HN  )  (  resid   41  and  name    HB1  )   2.470    0.670   0.670 
assign (  resid  41  and  name     HN  )  (  resid   41  and  name     HG  )   2.425    0.625   0.625 
assign (  resid  41  and  name    HB2  )  (  resid   41  and  name   HD1#  )   2.815    1.015   1.015 
assign (  resid  41  and  name    HB1  )  (  resid   41  and  name   HD1#  )   2.685    0.885   0.885 
assign (  resid  41  and  name     HA  )  (  resid   41  and  name   HD1#  )   2.810    1.010   1.010 
assign (  resid  41  and  name    HB2  )  (  resid   41  and  name   HD2#  )   2.795    0.995   0.995 
assign (  resid  41  and  name    HB2  )  (  resid   42  and  name     HN  )   2.920    1.120   1.120 
assign (  resid  41  and  name     HA  )  (  resid   42  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  41  and  name     HN  )  (  resid   42  and  name     HN  )   2.560    0.760   0.760 
assign (  resid  41  and  name     HN  )  (  resid   42  and  name    HB2  )   3.650    1.850   1.850 
assign (  resid  41  and  name     HN  )  (  resid   42  and  name    HB1  )   3.650    1.850   1.850 
assign (  resid  41  and  name   HD2#  )  (  resid   42  and  name     HN  )   3.025    1.225   1.225 
assign (  resid  41  and  name   HD1#  )  (  resid   42  and  name     HN  )   2.925    1.125   1.125 
assign (  resid  41  and  name     HN  )  (  resid   42  and  name     HA  )   3.490    1.690   1.690 
assign (  resid  41  and  name     HN  )  (  resid   42  and  name    HB#  )   3.240    1.440   1.440 
assign (  resid  41  and  name     HG  )  (  resid   42  and  name     HN  )   2.925    1.125   1.125 
assign (  resid  41  and  name     HG  )  (  resid   42  and  name     HA  )   3.205    1.405   1.405 
assign (  resid  41  and  name    HB1  )  (  resid   42  and  name     HN  )   3.030    1.230   1.230 
assign (  resid  41  and  name     HA  )  (  resid   43  and  name     HN  )   3.150    1.350   1.350 
assign (  resid  41  and  name     HN  )  (  resid   43  and  name     HN  )   3.160    1.360   1.360 
assign (  resid  41  and  name     HG  )  (  resid   43  and  name     HN  )   3.570    1.770   1.770 
assign (  resid  41  and  name    HB2  )  (  resid   43  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  41  and  name     HA  )  (  resid   44  and  name     HN  )   2.865    1.065   1.065 
assign (  resid  41  and  name     HN  )  (  resid   44  and  name     HN  )   3.620    1.820   1.820 
assign (  resid  41  and  name     HA  )  (  resid   44  and  name    HB2  )   3.025    1.225   1.225 
assign (  resid  41  and  name   HD1#  )  (  resid   44  and  name     HN  )   3.535    1.735   1.735 
assign (  resid  41  and  name     HA  )  (  resid   45  and  name     HN  )   3.385    1.585   1.585 
assign (  resid  41  and  name   HD1#  )  (  resid   45  and  name     HN  )   3.445    1.645   1.645 
assign (  resid  41  and  name    HB2  )  (  resid   50  and  name    HG#  )   3.180    1.380   1.380 
assign (  resid  41  and  name     HG  )  (  resid   50  and  name    HG#  )   3.390    1.590   1.590 
assign (  resid  41  and  name   HD1#  )  (  resid   60  and  name    HE2  )   4.500    2.700   1.500 ! added 12/01/2015

assign (  resid  42  and  name     HA  )  (  resid   42  and  name    HD#  )   2.960    1.160   1.160 
assign (  resid  42  and  name     HN  )  (  resid   42  and  name    HD#  )   3.055    1.255   1.255 
assign (  resid  42  and  name     HN  )  (  resid   42  and  name    HB1  )   2.430    0.630   0.630 
assign (  resid  42  and  name     HN  )  (  resid   42  and  name    HB2  )   2.430    0.630   0.630 
assign (  resid  42  and  name     HN  )  (  resid   43  and  name     HN  )   2.500    0.700   0.700 
assign (  resid  42  and  name     HA  )  (  resid   43  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  42  and  name    HD#  )  (  resid   43  and  name     HN  )   3.095    1.295   1.295 
assign (  resid  42  and  name     HN  )  (  resid   44  and  name     HN  )   3.255    1.455   1.455 
assign (  resid  42  and  name     HN  )  (  resid   44  and  name     HG  )   3.650    1.850   1.850 
assign (  resid  42  and  name     HN  )  (  resid   44  and  name    HB2  )   3.650    1.850   1.850 
assign (  resid  42  and  name     HA  )  (  resid   44  and  name     HN  )   3.355    1.555   1.555 
assign (  resid  42  and  name     HA  )  (  resid   45  and  name    HB1  )   2.950    1.150   1.150 
assign (  resid  42  and  name     HA  )  (  resid   45  and  name    HB2  )   3.135    1.335   1.335 
assign (  resid  42  and  name     HA  )  (  resid   45  and  name     HN  )   2.720    0.920   0.920 
assign (  resid  42  and  name    HD#  )  (  resid   45  and  name     HN  )   3.535    1.735   1.735 
assign (  resid  42  and  name     HN  )  (  resid   45  and  name     HN  )   3.530    1.730   1.730 
assign (  resid  42  and  name    HB#  )  (  resid   45  and  name     HN  )   3.570    1.770   1.770 

assign (  resid  43  and  name     HN  )  (  resid   43  and  name     HA  )   2.355    0.555   0.555 
assign (  resid  43  and  name     HN  )  (  resid   43  and  name   HD21  )   2.915    1.115   1.115 
assign (  resid  43  and  name     HN  )  (  resid   43  and  name   HD22  )   2.915    1.115   1.115 
assign (  resid  43  and  name     HN  )  (  resid   43  and  name    HB#  )   2.605    0.805   0.805 
assign (  resid  43  and  name     HN  )  (  resid   43  and  name   HD2#  )   2.615    0.815   0.815 
assign (  resid  43  and  name    HB#  )  (  resid   43  and  name   HD2#  )   2.450    0.650   0.650 
assign (  resid  43  and  name    HB#  )  (  resid   44  and  name     HN  )   2.610    0.810   0.810 
assign (  resid  43  and  name     HA  )  (  resid   44  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  43  and  name   HD2#  )  (  resid   44  and  name     HN  )   3.570    1.770   1.770 
assign (  resid  43  and  name    HB1  )  (  resid   44  and  name     HN  )   2.930    1.130   1.130 
assign (  resid  43  and  name    HB2  )  (  resid   44  and  name     HN  )   2.930    1.130   1.130 
assign (  resid  43  and  name     HN  )  (  resid   44  and  name     HA  )   3.600    1.800   1.800 
assign (  resid  43  and  name     HN  )  (  resid   44  and  name    HB2  )   3.360    1.560   1.560 
assign (  resid  43  and  name     HN  )  (  resid   44  and  name     HG  )   3.235    1.435   1.435 
assign (  resid  43  and  name     HN  )  (  resid   44  and  name     HN  )   2.490    0.690   0.690 
assign (  resid  43  and  name    HB#  )  (  resid   45  and  name     HN  )   3.550    1.750   1.750 
assign (  resid  43  and  name     HN  )  (  resid   45  and  name     HN  )   2.940    1.140   1.140 
assign (  resid  43  and  name     HN  )  (  resid   45  and  name    HB1  )   3.650    1.850   1.850 
assign (  resid  43  and  name     HN  )  (  resid   46  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  43  and  name     HA  )  (  resid   46  and  name    HB#  )   3.320    1.520   1.520 
assign (  resid  43  and  name    HB#  )  (  resid   46  and  name     HN  )   3.570    1.770   1.770 
assign (  resid  43  and  name     HA  )  (  resid   46  and  name     HN  )   2.930    1.130   1.130 
assign (  resid  43  and  name     HN  )  (  resid   50  and  name    HG#  )   3.400    1.600   1.600 

assign (  resid  44  and  name     HA  )  (  resid   44  and  name     HG  )   2.705    0.905   0.905 
assign (  resid  44  and  name    HB1  )  (  resid   44  and  name   HD1#  )   2.710    0.910   0.910 
assign (  resid  44  and  name    HB2  )  (  resid   44  and  name   HD1#  )   2.690    0.890   0.890 
assign (  resid  44  and  name    HB2  )  (  resid   44  and  name   HD2#  )   2.690    0.890   0.890 
assign (  resid  44  and  name     HN  )  (  resid   44  and  name     HG  )   2.520    0.720   0.720 
assign (  resid  44  and  name     HN  )  (  resid   44  and  name   HD2#  )   2.980    1.180   1.180 
assign (  resid  44  and  name     HN  )  (  resid   44  and  name   HD1#  )   2.980    1.180   1.180 
assign (  resid  44  and  name     HN  )  (  resid   44  and  name    HB1  )   2.800    1.000   1.000 
assign (  resid  44  and  name     HN  )  (  resid   44  and  name    HB2  )   2.555    0.755   0.755 
assign (  resid  44  and  name    HB1  )  (  resid   44  and  name   HD2#  )   2.710    0.910   0.910 
assign (  resid  44  and  name     HN  )  (  resid   45  and  name     HN  )   2.630    0.830   0.830 
assign (  resid  44  and  name     HA  )  (  resid   45  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  44  and  name    HB2  )  (  resid   45  and  name     HN  )   2.665    0.865   0.865 
assign (  resid  44  and  name     HG  )  (  resid   45  and  name     HN  )   3.280    1.480   1.480 
assign (  resid  44  and  name    HB1  )  (  resid   45  and  name     HN  )   2.985    1.185   1.185 
assign (  resid  44  and  name     HN  )  (  resid   45  and  name    HB2  )   3.340    1.540   1.540 
assign (  resid  44  and  name     HN  )  (  resid   45  and  name    HB1  )   3.650    1.850   1.850 
assign (  resid  44  and  name     HN  )  (  resid   46  and  name     HN  )   3.185    1.385   1.385 
assign (  resid  44  and  name     HN  )  (  resid   47  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  44  and  name     HA  )  (  resid   47  and  name     HN  )   2.850    1.050   1.050 
assign (  resid  44  and  name     HA  )  (  resid   49  and  name     HN  )   3.420    1.620   1.620 
assign (  resid  44  and  name    HB2  )  (  resid   49  and  name     HN  )   3.455    1.655   1.655 
assign (  resid  44  and  name    HB1  )  (  resid   49  and  name     HN  )   3.040    1.240   1.240 
assign (  resid  44  and  name    HB1  )  (  resid   50  and  name     HN  )   3.105    1.305   1.305 
assign (  resid  44  and  name     HA  )  (  resid   50  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  44  and  name    HB2  )  (  resid   50  and  name     HN  )   3.110    1.310   1.310 
assign (  resid  44  and  name     HN  )  (  resid   50  and  name     HB  )   3.650    1.850   1.850 
assign (  resid  44  and  name     HN  )  (  resid   50  and  name    HG#  )   3.100    1.300   1.300 
assign (  resid  44  and  name    HB2  )  (  resid   50  and  name    HG#  )   2.765    0.965   0.965 
assign (  resid  44  and  name    HB2  )  (  resid   51  and  name     HN  )   3.650    1.850   1.850 


assign (  resid  45  and  name     HN  )  (  resid   45  and  name    HG2  )   3.260    1.460   1.460 
assign (  resid  45  and  name     HA  )  (  resid   45  and  name   HE22  )   3.450    1.650   1.650 
assign (  resid  45  and  name     HN  )  (  resid   45  and  name    HG#  )   2.970    1.170   1.170 
assign (  resid  45  and  name     HN  )  (  resid   45  and  name    HB1  )   2.455    0.655   0.655 
assign (  resid  45  and  name     HN  )  (  resid   45  and  name   HE21  )   3.555    1.755   1.755 
assign (  resid  45  and  name     HN  )  (  resid   45  and  name    HG1  )   3.260    1.460   1.460 
assign (  resid  45  and  name     HN  )  (  resid   45  and  name    HB2  )   2.470    0.670   0.670 
assign (  resid  45  and  name    HB2  )  (  resid   45  and  name   HE21  )   3.280    1.480   1.480 
assign (  resid  45  and  name    HB2  )  (  resid   45  and  name   HE22  )   3.230    1.430   1.430 
assign (  resid  45  and  name     HA  )  (  resid   45  and  name   HE21  )   3.360    1.560   1.560 
assign (  resid  45  and  name    HB2  )  (  resid   46  and  name     HN  )   2.815    1.015   1.015 
assign (  resid  45  and  name     HN  )  (  resid   46  and  name     HN  )   2.535    0.735   0.735 
assign (  resid  45  and  name     HA  )  (  resid   46  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  45  and  name    HB2  )  (  resid   46  and  name     HE  )   3.280    1.480   1.480 
assign (  resid  45  and  name    HB1  )  (  resid   46  and  name     HN  )   2.550    0.750   0.750 
assign (  resid  45  and  name     HN  )  (  resid   46  and  name     HE  )   3.020    1.220   1.220 
assign (  resid  45  and  name    HG#  )  (  resid   46  and  name     HN  )   3.275    1.475   1.475 
assign (  resid  45  and  name     HN  )  (  resid   47  and  name     HN  )   3.100    1.300   1.300 
assign (  resid  45  and  name     HA  )  (  resid   47  and  name     HN  )   3.060    1.260   1.260 
assign (  resid  45  and  name    HB1  )  (  resid   47  and  name     HN  )   3.525    1.725   1.725 
assign (  resid  45  and  name     HA  )  (  resid   48  and  name     HN  )   2.865    1.065   1.065 
assign (  resid  45  and  name    HB1  )  (  resid   48  and  name     HN  )   3.560    1.760   1.760 
assign (  resid  45  and  name    HG#  )  (  resid   48  and  name     HN  )   3.340    1.540   1.540 
assign (  resid  45  and  name     HN  )  (  resid   48  and  name     HN  )   3.480    1.680   1.680 
assign (  resid  45  and  name     HA  )  (  resid   49  and  name     HN  )   2.790    0.990   0.990 
assign (  resid  45  and  name     HN  )  (  resid   49  and  name     HN  )   3.650    1.850   1.850 
assign (  resid  45  and  name     HN  )  (  resid   50  and  name     HN  )   3.355    1.555   1.555 
assign (  resid  45  and  name     HA  )  (  resid   50  and  name     HN  )   2.555    0.755   0.755 
assign (  resid  45  and  name     HN  )  (  resid   50  and  name    HG#  )   2.445    0.645   0.645 
assign (  resid  45  and  name     HA  )  (  resid   50  and  name    HG#  )   2.800    1.000   1.000 
assign (  resid  45  and  name    HB2  )  (  resid   50  and  name    HG#  )   3.045    1.245   1.245 
assign (  resid  45  and  name    HG#  )  (  resid   50  and  name     HN  )   3.480    1.680   1.680 
assign (  resid  45  and  name    HG#  )  (  resid   50  and  name    HG#  )   3.210    1.410   1.410 
assign (  resid  45  and  name     HA  )  (  resid   51  and  name     HN  )   3.225    1.425   1.425 
assign (  resid  45  and  name   HE21  )  (  resid   51  and  name     HA  )   3.150    1.350   1.350 
assign (  resid  45  and  name   HE22  )  (  resid   51  and  name     HA  )   3.370    1.570   1.570 
assign (  resid  45  and  name    HG#  )  (  resid   51  and  name     HN  )   3.570    1.770   1.770 
assign (  resid  45  and  name   HE22  )  (  resid   51  and  name    HB#  )   3.570    1.770   1.770 
assign (  resid  45  and  name   HE21  )  (  resid   52  and  name     HN  )   3.205    1.405   1.405 
assign (  resid  45  and  name   HE22  )  (  resid   52  and  name     HN  )   3.265    1.465   1.465 
assign (  resid  45  and  name   HE21  )  (  resid   52  and  name   HD2#  )   3.570    1.770   1.770 

assign (  resid  46  and  name     HA  )  (  resid   46  and  name    HG1  )   2.930    1.130   1.130 
assign (  resid  46  and  name     HA  )  (  resid   46  and  name    HG2  )   2.930    1.130   1.130 
assign (  resid  46  and  name    HB#  )  (  resid   46  and  name    HD#  )   2.750    0.950   0.950 
assign (  resid  46  and  name     HN  )  (  resid   46  and  name    HB#  )   2.250    0.450   0.450 
assign (  resid  46  and  name     HN  )  (  resid   46  and  name    HG2  )   2.875    1.075   1.075 
assign (  resid  46  and  name     HN  )  (  resid   46  and  name    HG1  )   2.875    1.075   1.075 
assign (  resid  46  and  name     HA  )  (  resid   46  and  name    HG#  )   2.655    0.855   0.855 
assign (  resid  46  and  name     HN  )  (  resid   46  and  name     HE  )   3.285    1.485   1.485 
assign (  resid  46  and  name     HN  )  (  resid   46  and  name    HG#  )   2.575    0.775   0.775 
assign (  resid  46  and  name     HN  )  (  resid   47  and  name     HN  )   2.480    0.680   0.680 
assign (  resid  46  and  name     HA  )  (  resid   47  and  name     HN  )   3.000    1.200   1.500 ! added 05/09/2014
assign (  resid  46  and  name    HG#  )  (  resid   47  and  name     HN  )   3.085    1.285   1.285 
assign (  resid  46  and  name    HB#  )  (  resid   47  and  name     HN  )   2.545    0.745   0.745 
assign (  resid  46  and  name    HD#  )  (  resid   47  and  name     HN  )   3.390    1.590   1.590 
assign (  resid  46  and  name     HN  )  (  resid   47  and  name    HB#  )   3.455    1.655   1.655 
assign (  resid  46  and  name     HN  )  (  resid   48  and  name     HN  )   2.945    1.145   1.145 
assign (  resid  46  and  name     HA  )  (  resid   48  and  name     HN  )   2.865    1.065   1.065 
assign (  resid  46  and  name    HB#  )  (  resid   48  and  name     HN  )   3.180    1.380   1.380 
assign (  resid  46  and  name     HN  )  (  resid   50  and  name    HG#  )   3.120    1.320   1.320 

assign (  resid  47  and  name     HN  )  (  resid   47  and  name    HB#  )   2.535    0.735   0.735 
assign (  resid  47  and  name     HN  )  (  resid   48  and  name     HN  )   2.400    0.600   0.600 
assign (  resid  47  and  name     HN  )  (  resid   48  and  name    HB2  )   3.605    1.805   1.805 
assign (  resid  47  and  name    HB#  )  (  resid   48  and  name     HN  )   2.915    1.115   1.115 
assign (  resid  47  and  name    HB#  )  (  resid   49  and  name     HN  )   3.235    1.435   1.435 
assign (  resid  47  and  name    HB#  )  (  resid   49  and  name    HB#  )   2.785    0.985   0.985 
assign (  resid  47  and  name     HN  )  (  resid   49  and  name     HN  )   2.965    1.165   1.165 
assign (  resid  47  and  name    HB1  )  (  resid   49  and  name     HN  )   3.595    1.795   1.795 
assign (  resid  47  and  name    HB2  )  (  resid   49  and  name     HN  )   3.595    1.795   1.795 
assign (  resid  47  and  name     HN  )  (  resid   49  and  name    HB#  )   3.570    1.770   1.770 
assign (  resid  47  and  name     HN  )  (  resid   50  and  name     HN  )   3.650    1.850   1.850 

assign (  resid  48  and  name    HB2  )  (  resid   48  and  name   HD2#  )   2.625    0.825   0.825 
assign (  resid  48  and  name     HN  )  (  resid   48  and  name    HB2  )   2.600    0.800   0.800 
assign (  resid  48  and  name    HB2  )  (  resid   48  and  name   HD21  )   2.930    1.130   1.130 
assign (  resid  48  and  name    HB2  )  (  resid   48  and  name   HD22  )   2.930    1.130   1.130
assign (  resid  48  and  name     HN  )  (  resid   48  and  name     HA  )   2.130    0.330   0.330 
assign (  resid  48  and  name     HN  )  (  resid   48  and  name   HD2#  )   3.470    1.670   1.670 
assign (  resid  48  and  name     HN  )  (  resid   49  and  name    HB#  )   3.340    1.540   1.540 
assign (  resid  48  and  name     HN  )  (  resid   49  and  name     HN  )   2.510    0.710   0.710 
assign (  resid  48  and  name     HA  )  (  resid   49  and  name     HN  )   2.525    0.725   0.725 
assign (  resid  48  and  name    HB2  )  (  resid   49  and  name     HN  )   3.130    1.330   1.330 
assign (  resid  48  and  name    HB1  )  (  resid   49  and  name     HN  )   3.420    1.620   1.620 
assign (  resid  48  and  name     HN  )  (  resid   50  and  name     HN  )   3.005    1.205   1.205 
assign (  resid  48  and  name     HA  )  (  resid   50  and  name     HN  )   2.830    1.030   1.030 
assign (  resid  48  and  name     HN  )  (  resid   51  and  name    HE#  )   3.330    1.530   1.530 
assign (  resid  48  and  name     HN  )  (  resid   51  and  name    HD#  )   3.205    1.405   1.405 
assign (  resid  48  and  name     HN  )  (  resid   51  and  name    HB#  )   3.310    1.510   1.510 

assign (  resid  49  and  name     HN  )  (  resid   49  and  name    HB2  )   2.560    0.760   0.760 
assign (  resid  49  and  name     HN  )  (  resid   49  and  name    HB1  )   2.560    0.760   0.760 
assign (  resid  49  and  name     HN  )  (  resid   49  and  name    HB#  )   2.350    0.550   0.550 
assign (  resid  49  and  name    HB#  )  (  resid   49  and  name   HE2#  )   3.090    1.290   1.290 
assign (  resid  49  and  name     HN  )  (  resid   50  and  name     HA  )   3.455    1.655   1.655 
assign (  resid  49  and  name     HN  )  (  resid   50  and  name     HN  )   2.405    0.605   0.605 
assign (  resid  49  and  name    HB2  )  (  resid   50  and  name     HN  )   2.995    1.195   1.195 
assign (  resid  49  and  name    HB1  )  (  resid   50  and  name     HN  )   2.995    1.195   1.195 
assign (  resid  49  and  name     HN  )  (  resid   50  and  name    HG#  )   2.810    1.010   1.010 
assign (  resid  49  and  name    HB#  )  (  resid   50  and  name     HN  )   2.630    0.830   0.830 
assign (  resid  49  and  name   HE2#  )  (  resid   50  and  name     HN  )   3.570    1.770   1.770 
assign (  resid  49  and  name   HE2#  )  (  resid   50  and  name     HA  )   3.075    1.275   1.275 
assign (  resid  49  and  name   HE2#  )  (  resid   50  and  name     HB  )   2.810    1.010   1.010 
assign (  resid  49  and  name   HE2#  )  (  resid   50  and  name    HG#  )   3.405    1.605   1.605 
!assign (  resid  49  and  name    HB#  )  (  resid   51  and  name     HN  )   3.505    1.705   1.705 removed 7/14/2015
assign (  resid  49  and  name     HN  )  (  resid   51  and  name    HB#  )   3.570    1.770   1.770 

assign (  resid  50  and  name     HN  )  (  resid   50  and  name     HB  )   2.715    0.915   0.915 
assign (  resid  50  and  name     HN  )  (  resid   50  and  name    HG#  )   2.345    0.545   0.545 
assign (  resid  50  and  name     HN  )  (  resid   51  and  name    HB#  )   3.260    1.460   1.460 
assign (  resid  50  and  name    HG#  )  (  resid   51  and  name     HN  )   2.390    0.590   0.590 
assign (  resid  50  and  name    HG#  )  (  resid   51  and  name     HA  )   3.180    1.380   1.380 
assign (  resid  50  and  name    HG#  )  (  resid   51  and  name    HE#  )   3.620    1.820   1.820 
assign (  resid  50  and  name     HA  )  (  resid   51  and  name     HN  )   2.680    0.880   0.880 
assign (  resid  50  and  name     HN  )  (  resid   51  and  name     HN  )   3.085    1.285   1.285 
assign (  resid  50  and  name     HB  )  (  resid   51  and  name     HN  )   3.080    1.280   1.280 
!assign (  resid  50  and  name    HG#  )  (  resid   52  and  name     HN  )   3.555    1.755   1.755 removed 7/13/2015

assign (  resid  51  and  name     HN  )  (  resid   51  and  name    HD#  )   2.690    0.890   0.890 
assign (  resid  51  and  name     HA  )  (  resid   52  and  name     HN  )   2.380    0.580   0.580 
assign (  resid  51  and  name    HE#  )  (  resid   52  and  name     HN  )   3.000    1.200   3.000 ! relased 7/15/2015
assign (  resid  51  and  name     HN  )  (  resid   52  and  name     HN  )   3.275    1.475   1.475 
assign (  resid  51  and  name    HD#  )  (  resid   52  and  name     HN  )   2.745    0.945   0.945 
assign (  resid  51  and  name     HN  )  (  resid   51  and  name    HB#  )   2.730    0.930   0.930 
assign (  resid  51  and  name    HB#  )  (  resid   52  and  name     HN  )   2.475    0.675   0.675 
assign (  resid  51  and  name     HN  )  (  resid   62  and  name     HA  )   3.000    1.200   1.500 ! added 5/9/2014
assign (  resid  51  and  name     HN  )  (  reside  61  and  name     HN  )   3.000    1.200   1.500 ! added 5/9/2014
assign (  resid  51  and  name     HN  )  (  resid   61  and  name     HA  )   3.000    1.200   3.000 

assign (  resid  52  and  name     HN  )  (  resid   52  and  name    HB2  )   2.960    1.160   1.160 
assign (  resid  52  and  name     HN  )  (  resid   52  and  name    HB1  )   2.960    1.160   1.160 
assign (  resid  52  and  name     HN  )  (  resid   52  and  name    HB#  )   2.700    0.900   0.900 
assign (  resid  52  and  name     HN  )  (  resid   52  and  name   HD2#  )   3.110    1.310   1.310 
assign (  resid  52  and  name   HD2#  )  (  resid   53  and  name     HN  )   3.365    1.565   1.565 
assign (  resid  52  and  name    HB1  )  (  resid   53  and  name     HN  )   2.760    0.960   0.960 
assign (  resid  52  and  name    HB2  )  (  resid   53  and  name     HN  )   2.760    0.960   0.960 
assign (  resid  52  and  name     HA  )  (  resid   53  and  name     HN  )   2.395    0.595   0.595 
assign (  resid  52  and  name     HN  )  (  resid   53  and  name     HA  )   3.650    1.850   1.850 
assign (  resid  52  and  name     HN  )  (  resid   53  and  name     HN  )   3.205    1.405   1.405 
assign (  resid  52  and  name    HB#  )  (  resid   53  and  name     HN  )   2.505    0.705   0.705 
assign (  resid  52  and  name    HB#  )  (  resid   59  and  name     HN  )   3.135    1.335   1.335 
assign (  resid  52  and  name     HA  )  (  resid   59  and  name     HN  )   3.030    1.230   1.230 

assign (  resid  53  and  name     HN  )  (  resid   53  and  name    HB1  )   2.660    0.860   0.860 
assign (  resid  53  and  name     HN  )  (  resid   53  and  name    HB2  )   2.660    0.860   0.860 
assign (  resid  53  and  name     HN  )  (  resid   54  and  name     HN  )   3.300    1.500   1.500 
assign (  resid  53  and  name     HN  )  (  resid   54  and  name    HB#  )   3.570    1.770   1.770 
assign (  resid  53  and  name     HN  )  (  resid   55  and  name     HN  )   3.200    1.400   1.400 
assign (  resid  53  and  name     HN  )  (  resid   55  and  name    HG1  )   3.650    1.850   1.850 
assign (  resid  53  and  name     HN  )  (  resid   59  and  name     HN  )   2.745    0.945   0.945 
assign (  resid  53  and  name     HN  )  (  resid   59  and  name     HB  )   2.965    1.165   1.165 
assign (  resid  53  and  name    HB#  )  (  resid   59  and  name     HN  )   3.035    1.235   1.235 
assign (  resid  53  and  name     HN  )  (  resid   60  and  name     HA  )   3.000    1.200   1.500 ! added 5/9/2014

assign (  resid  54  and  name    HB#  )  (  resid   54  and  name   HD2#  )   2.500    0.700   0.700 
assign (  resid  54  and  name   HD22  )  (  resid   55  and  name    HG2  )   2.865    1.065   1.065 
assign (  resid  54  and  name   HD21  )  (  resid   55  and  name    HG2  )   2.865    1.065   1.065 
assign (  resid  54  and  name   HD2#  )  (  resid   55  and  name    HB#  )   3.105    1.305   1.305 
assign (  resid  54  and  name   HD2#  )  (  resid   55  and  name    HG2  )   2.585    0.785   0.785 
assign (  resid  54  and  name     HN  )  (  resid   59  and  name     HN  )   3.480    1.680   1.680 

assign (  resid  55  and  name     HA  )  (  resid   55  and  name    HG1  )   3.015    1.215   1.215 
assign (  resid  55  and  name     HN  )  (  resid   55  and  name    HG2  )   3.045    1.245   1.245 
assign (  resid  55  and  name     HN  )  (  resid   55  and  name    HG1  )   2.880    1.080   1.080 
assign (  resid  55  and  name     HN  )  (  resid   55  and  name    HB2  )   2.935    1.135   1.135 
assign (  resid  55  and  name     HN  )  (  resid   55  and  name    HB1  )   2.935    1.135   1.135 
assign (  resid  55  and  name    HG1  )  (  resid   56  and  name     HN  )   2.850    1.050   1.050 
assign (  resid  55  and  name    HB#  )  (  resid   56  and  name     HN  )   2.390    0.590   0.590 
assign (  resid  55  and  name     HN  )  (  resid   56  and  name     HN  )   3.235    1.435   1.435 
assign (  resid  55  and  name     HA  )  (  resid   56  and  name     HN  )   2.310    0.510   0.510 
assign (  resid  55  and  name     HN  )  (  resid   59  and  name     HN  )   3.455    1.655   1.655 
assign (  resid  55  and  name    HG1  )  (  resid   59  and  name     HN  )   3.015    1.215   1.215 
assign (  resid  55  and  name    HG2  )  (  resid   59  and  name     HN  )   3.100    1.300   1.300 

assign (  resid  56  and  name     HN  )  (  resid   56  and  name    HB#  )   2.380    0.580   0.580 
assign (  resid  56  and  name     HN  )  (  resid   56  and  name    HG2  )   2.960    1.160   1.160 
assign (  resid  56  and  name     HN  )  (  resid   56  and  name    HG1  )   2.960    1.160   1.160 
assign (  resid  56  and  name     HN  )  (  resid   56  and  name    HG#  )   2.665    0.865   0.865 

assign (  resid  59  and  name     HN  )  (  resid   59  and  name     HB  )   2.470    0.670   0.670 
assign (  resid  59  and  name     HA  )  (  resid   59  and  name   HG1#  )   2.765    0.965   0.965 
assign (  resid  59  and  name     HA  )  (  resid   59  and  name   HG2#  )   2.765    0.965   0.965 
assign (  resid  59  and  name   HG2#  )  (  resid   60  and  name     HN  )   2.915    1.115   1.115 
assign (  resid  59  and  name     HA  )  (  resid   60  and  name     HN  )   2.435    0.635   0.635 
assign (  resid  59  and  name   HG1#  )  (  resid   60  and  name     HN  )   2.915    1.115   1.115 
assign (  resid  59  and  name     HB  )  (  resid   60  and  name     HN  )   3.040    1.240   1.240 
assign (  resid  59  and  name     HN  )  (  resid   60  and  name     HN  )   3.645    1.845   1.845 
assign (  resid  59  and  name   HG1#  )  (  resid   61  and  name     HN  )   3.165    1.365   1.365 
assign (  resid  59  and  name   HG2#  )  (  resid   61  and  name     HN  )   3.165    1.365   1.365 
assign (  resid  59  and  name     HA  )  (  resid   61  and  name     HN  )   3.355    1.555   1.555 
assign (  resid  59  and  name   HG1#  )  (  resid   62  and  name     HN  )   3.175    1.375   1.375 
assign (  resid  59  and  name   HG2#  )  (  resid   62  and  name     HN  )   3.175    1.375   1.375 

assign (  resid  60  and  name     HN  )  (  resid   60  and  name    HB2  )   2.785    0.985   0.985 
assign (  resid  60  and  name     HN  )  (  resid   60  and  name    HB1  )   2.785    0.985   0.985 
assign (  resid  60  and  name     HN  )  (  resid   60  and  name    HD1  )   2.730    0.930   0.930 
assign (  resid  60  and  name     HN  )  (  resid   61  and  name     HN  )   3.000    1.200   1.200 
assign (  resid  60  and  name    HD1  )  (  resid   61  and  name     HN  )   3.620    1.820   1.820 
assign (  resid  60  and  name    HB#  )  (  resid   61  and  name     HN  )   2.660    0.860   0.860 
assign (  resid  60  and  name     HA  )  (  resid   61  and  name     HN  )   2.655    0.855   0.855  ! added 05/09/2014

assign (  resid  61  and  name     HN  )  (  resid   61  and  name    HB#  )   2.615    0.815   0.815 
assign (  resid  61  and  name     HA  )  (  resid   62  and  name     HN  )   2.655    0.855   0.855 
assign (  resid  61  and  name    HB2  )  (  resid   62  and  name     HN  )   3.240    1.440   1.440 
assign (  resid  61  and  name    HB1  )  (  resid   62  and  name     HN  )   3.240    1.440   1.440 
assign (  resid  61  and  name     HN  )  (  resid   62  and  name    HB#  )   3.195    1.395   1.395 
assign (  resid  61  and  name    HB#  )  (  resid   62  and  name     HN  )   2.920    1.120   1.120 

assign (  resid  62  and  name     HN  )  (  resid   62  and  name    HB#  )   2.415    0.615   0.615 
assign (  resid  62  and  name     HA  )  (  resid   63  and  name     HN  )   2.665    0.865   0.865 
assign (  resid  62  and  name    HB#  )  (  resid   63  and  name     HN  )   2.630    0.830   0.830 

assign (  resid  63  and  name     HN  )  (  resid   63  and  name    HB#  )   2.735    0.935   0.935 
assign (  resid  63  and  name    HB#  )  (  resid   64  and  name    HB#  )   2.785    0.985   0.985 
assign (  resid  63  and  name    HB#  )  (  resid   64  and  name     HN  )   2.995    1.195   1.195 
assign (  resid  63  and  name     HN  )  (  resid   64  and  name     HN  )   3.080    1.280   1.280 
assign (  resid  63  and  name     HN  )  (  resid   64  and  name    HB#  )   2.980    1.180   1.180 

assign (  resid  64  and  name     HN  )  (  resid   64  and  name    HG#  )   3.140    1.340   1.340 
assign (  resid  64  and  name     HN  )  (  resid   64  and  name    HB#  )   2.880    1.080   1.080 




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1  11.504 -11.403   6.937
    2    HB2  MET   1           2HB      MET   1  13.882 -11.863   6.339
    3    HB3  MET   1           1HB      MET   1  13.532 -12.207   8.019
    4    HG2  MET   1           2HG      MET   1  13.437 -14.607   7.487
    5    HG3  MET   1           1HG      MET   1  13.829 -14.236   5.808
    6    HE1  MET   1           2HE      MET   1  17.161 -15.845   7.097
    7    HE2  MET   1           3HE      MET   1  15.912 -15.889   5.851
    8    HE3  MET   1           1HE      MET   1  15.517 -16.323   7.514
    9    H    SER   2           H        SER   2  10.152 -11.194   5.314
   10    HA   SER   2           HA       SER   2  11.027 -12.285   2.781
   11    HB2  SER   2           2HB      SER   2   8.170 -12.568   3.770
   12    HB3  SER   2           1HB      SER   2   8.752 -13.012   2.165
   13    HG   SER   2           HG       SER   2  10.344 -14.243   3.729
   14    H    ALA   3           H        ALA   3   8.348 -10.435   4.291
   15    HA   ALA   3           HA       ALA   3   9.064  -7.956   3.187
   16    HB1  ALA   3           1HB      ALA   3   8.356  -9.049   1.044
   17    HB2  ALA   3           2HB      ALA   3   7.342  -7.670   1.469
   18    HB3  ALA   3           3HB      ALA   3   6.758  -9.311   1.743
   19    H    GLU   4           H        GLU   4   8.372  -9.007   5.573
   20    HA   GLU   4           HA       GLU   4   5.835  -8.476   6.505
   21    HB2  GLU   4           2HB      GLU   4   8.546  -8.331   7.557
   22    HB3  GLU   4           1HB      GLU   4   7.196  -8.045   8.683
   23    HG2  GLU   4           2HG      GLU   4   7.655 -10.300   9.067
   24    HG3  GLU   4           1HG      GLU   4   6.521 -10.467   7.737
   25    H    THR   5           H        THR   5   8.687  -6.421   7.139
   26    HA   THR   5           HA       THR   5   7.341  -4.149   8.008
   27    HB   THR   5           HB       THR   5  10.101  -4.214   6.806
   28    HG1  THR   5           HG1      THR   5   9.353  -5.146   9.394
   29   HG21  THR   5          3HG2      THR   5   8.946  -2.887   9.279
   30   HG22  THR   5          1HG2      THR   5   9.286  -2.081   7.746
   31   HG23  THR   5          2HG2      THR   5  10.609  -2.739   8.710
   32    H    GLN   6           H        GLN   6   7.799  -5.327   4.904
   33    HA   GLN   6           HA       GLN   6   8.117  -2.974   3.356
   34    HB2  GLN   6           2HB      GLN   6   8.571  -5.278   2.519
   35    HB3  GLN   6           1HB      GLN   6   6.847  -5.604   2.576
   36    HG2  GLN   6           2HG      GLN   6   6.572  -3.658   0.980
   37    HG3  GLN   6           1HG      GLN   6   8.320  -3.718   0.768
   38   HE21  GLN   6          2HE2      GLN   6   8.262  -6.582  -1.227
   39   HE22  GLN   6          1HE2      GLN   6   9.227  -5.505  -0.294
   40    H    MET   7           H        MET   7   5.409  -4.556   4.906
   41    HA   MET   7           HA       MET   7   3.355  -3.456   3.276
   42    HB2  MET   7           2HB      MET   7   3.143  -4.389   6.146
   43    HB3  MET   7           1HB      MET   7   1.807  -4.163   5.029
   44    HG2  MET   7           2HG      MET   7   3.983  -6.234   4.837
   45    HG3  MET   7           1HG      MET   7   2.304  -6.511   5.290
   46    HE1  MET   7           3HE      MET   7   2.134  -8.465   3.543
   47    HE2  MET   7           1HE      MET   7   3.823  -8.207   3.100
   48    HE3  MET   7           2HE      MET   7   2.592  -8.320   1.844
   49    H    GLU   8           H        GLU   8   4.634  -2.606   6.427
   50    HA   GLU   8           HA       GLU   8   3.286  -0.296   7.001
   51    HB2  GLU   8           2HB      GLU   8   6.147  -1.113   7.452
   52    HB3  GLU   8           1HB      GLU   8   5.480   0.360   8.118
   53    HG2  GLU   8           2HG      GLU   8   5.606  -1.368   9.794
   54    HG3  GLU   8           1HG      GLU   8   3.938  -0.949   9.457
   55    H    ARG   9           H        ARG   9   6.148  -0.716   5.051
   56    HA   ARG   9           HA       ARG   9   6.565   2.109   4.625
   57    HB2  ARG   9           2HB      ARG   9   8.312   0.254   4.746
   58    HB3  ARG   9           1HB      ARG   9   7.771  -0.266   3.176
   59    HG2  ARG   9           2HG      ARG   9   8.972   2.448   3.703
   60    HG3  ARG   9           1HG      ARG   9   9.923   1.036   3.290
   61    HD2  ARG   9           2HD      ARG   9   8.349   0.937   1.204
   62    HD3  ARG   9           1HD      ARG   9   8.037   2.631   1.609
   63    HE   ARG   9           HE       ARG   9  10.836   1.923   1.550
   64   HH11  ARG   9          1HH1      ARG   9   8.214   3.303  -0.434
   65   HH12  ARG   9          2HH1      ARG   9   9.264   3.892  -1.587
   66   HH21  ARG   9          2HH2      ARG   9  11.687   3.595  -1.281
   67   HH22  ARG   9          1HH2      ARG   9  12.145   2.632   0.066
   68    H    LYS  10           H        LYS  10   4.898  -0.388   2.885
   69    HA   LYS  10           HA       LYS  10   4.705   1.140   0.468
   70    HB2  LYS  10           2HB      LYS  10   3.207  -1.288   1.401
   71    HB3  LYS  10           1HB      LYS  10   2.877  -0.517  -0.144
   72    HG2  LYS  10           2HG      LYS  10   5.153  -0.945  -0.868
   73    HG3  LYS  10           1HG      LYS  10   5.539  -1.636   0.705
   74    HD2  LYS  10           2HD      LYS  10   3.516  -2.730  -1.264
   75    HD3  LYS  10           1HD      LYS  10   5.129  -3.384  -0.976
   76    HE2  LYS  10           2HE      LYS  10   4.439  -3.701   1.436
   77    HE3  LYS  10           1HE      LYS  10   2.799  -3.301   0.936
   78    HZ1  LYS  10           3HZ      LYS  10   4.438  -5.553  -0.056
   79    HZ2  LYS  10           1HZ      LYS  10   2.854  -5.205  -0.579
   80    HZ3  LYS  10           2HZ      LYS  10   3.152  -5.655   1.035
   81    H    ILE  11           H        ILE  11   2.686   0.909   3.388
   82    HA   ILE  11           HA       ILE  11   0.533   2.166   2.041
   83    HB   ILE  11           HB       ILE  11  -0.441   2.394   4.229
   84   HG12  ILE  11          2HG1      ILE  11   2.148   1.190   5.180
   85   HG13  ILE  11          1HG1      ILE  11   1.439   2.731   5.639
   86   HG21  ILE  11          1HG2      ILE  11  -0.774   0.349   2.925
   87   HG22  ILE  11          2HG2      ILE  11  -0.637  -0.093   4.645
   88   HG23  ILE  11          3HG2      ILE  11   0.756  -0.265   3.560
   89   HD11  ILE  11          3HD1      ILE  11   0.412   0.035   6.215
   90   HD12  ILE  11          1HD1      ILE  11  -0.369   1.532   6.756
   91   HD13  ILE  11          2HD1      ILE  11   1.251   1.091   7.360
   92    H    ILE  12           H        ILE  12   3.204   3.187   4.097
   93    HA   ILE  12           HA       ILE  12   2.128   5.813   4.186
   94    HB   ILE  12           HB       ILE  12   3.957   6.495   5.404
   95   HG12  ILE  12          2HG1      ILE  12   6.131   4.803   5.155
   96   HG13  ILE  12          1HG1      ILE  12   5.464   4.868   3.545
   97   HG21  ILE  12          1HG2      ILE  12   4.668   4.780   6.967
   98   HG22  ILE  12          2HG2      ILE  12   3.954   3.555   5.919
   99   HG23  ILE  12          3HG2      ILE  12   2.931   4.782   6.663
  100   HD11  ILE  12          3HD1      ILE  12   6.204   7.373   5.090
  101   HD12  ILE  12          1HD1      ILE  12   5.464   7.335   3.499
  102   HD13  ILE  12          2HD1      ILE  12   7.084   6.706   3.710
  103    H    ASP  13           H        ASP  13   4.033   3.967   1.942
  104    HA   ASP  13           HA       ASP  13   5.204   6.166   0.628
  105    HB2  ASP  13           2HB      ASP  13   5.950   3.751   0.382
  106    HB3  ASP  13           1HB      ASP  13   4.578   3.532  -0.703
  107    H    PHE  14           H        PHE  14   2.212   4.403   0.192
  108    HA   PHE  14           HA       PHE  14   1.188   5.689  -2.048
  109    HB2  PHE  14           2HB      PHE  14   0.047   3.797  -1.122
  110    HB3  PHE  14           1HB      PHE  14  -0.088   4.566   0.450
  111    HD1  PHE  14           HD1      PHE  14  -1.756   6.119   0.903
  112    HD2  PHE  14           HD2      PHE  14  -1.427   4.419  -2.945
  113    HE1  PHE  14           HE1      PHE  14  -4.006   6.953   0.380
  114    HE2  PHE  14           HE2      PHE  14  -3.690   5.241  -3.524
  115    HZ   PHE  14           HZ       PHE  14  -4.988   6.517  -1.855
  116    H    LEU  15           H        LEU  15   0.867   6.511   1.377
  117    HA   LEU  15           HA       LEU  15  -0.458   8.942   1.268
  118    HB2  LEU  15           2HB      LEU  15  -0.280   8.263   3.251
  119    HB3  LEU  15           1HB      LEU  15   1.322   7.520   3.118
  120    HG   LEU  15           HG       LEU  15   1.915  10.116   2.925
  121   HD11  LEU  15          1HD1      LEU  15  -0.180  10.912   3.111
  122   HD12  LEU  15          2HD1      LEU  15   0.779  11.459   4.494
  123   HD13  LEU  15          3HD1      LEU  15  -0.447  10.186   4.708
  124   HD21  LEU  15          3HD2      LEU  15   3.119   8.811   4.308
  125   HD22  LEU  15          1HD2      LEU  15   1.754   8.428   5.365
  126   HD23  LEU  15          2HD2      LEU  15   2.454  10.063   5.370
  127    H    ARG  16           H        ARG  16   2.881   8.196   1.318
  128    HA   ARG  16           HA       ARG  16   4.138  10.552   1.311
  129    HB2  ARG  16           2HB      ARG  16   5.407   8.630   1.484
  130    HB3  ARG  16           1HB      ARG  16   4.685   7.950   0.037
  131    HG2  ARG  16           2HG      ARG  16   5.898   9.363  -1.335
  132    HG3  ARG  16           1HG      ARG  16   6.524  10.261   0.043
  133    HD2  ARG  16           2HD      ARG  16   7.519   8.040   0.820
  134    HD3  ARG  16           1HD      ARG  16   7.022   7.371  -0.717
  135    HE   ARG  16           HE       ARG  16   8.594   9.697  -1.058
  136   HH11  ARG  16          1HH1      ARG  16   8.712   6.172  -0.828
  137   HH12  ARG  16          2HH1      ARG  16  10.449   6.116  -0.893
  138   HH21  ARG  16          2HH2      ARG  16  11.718   8.001  -1.283
  139   HH22  ARG  16          1HH2      ARG  16  10.989   9.533  -1.379
  140    H    GLN  17           H        GLN  17   2.833   8.836  -1.272
  141    HA   GLN  17           HA       GLN  17   3.636  10.574  -3.379
  142    HB2  GLN  17           2HB      GLN  17   1.588   8.357  -3.412
  143    HB3  GLN  17           1HB      GLN  17   2.139   9.225  -4.837
  144    HG2  GLN  17           2HG      GLN  17   4.405   8.386  -4.490
  145    HG3  GLN  17           1HG      GLN  17   3.882   7.564  -3.024
  146   HE21  GLN  17          2HE2      GLN  17   3.576   4.746  -5.040
  147   HE22  GLN  17          1HE2      GLN  17   4.463   5.504  -3.779
  148    H    ASN  18           H        ASN  18   0.716  10.427  -1.298
  149    HA   ASN  18           HA       ASN  18  -0.398  12.458  -3.110
  150    HB2  ASN  18           2HB      ASN  18  -1.682  11.495  -0.530
  151    HB3  ASN  18           1HB      ASN  18  -2.449  12.436  -1.802
  152   HD21  ASN  18          2HD2      ASN  18  -2.353   8.450  -1.903
  153   HD22  ASN  18          1HD2      ASN  18  -1.852   9.462  -0.584
  154    H    GLY  19           H        GLY  19   1.138  12.106  -0.134
  155    HA2  GLY  19           2HA      GLY  19   2.393  14.407   0.111
  156    HA3  GLY  19           1HA      GLY  19   0.773  14.872   0.608
  157    H    LYS  20           H        LYS  20   3.495  12.597   1.403
  158    HA   LYS  20           HA       LYS  20   3.054  11.656   3.794
  159    HB2  LYS  20           2HB      LYS  20   5.447  12.841   4.284
  160    HB3  LYS  20           1HB      LYS  20   5.229  11.335   3.418
  161    HG2  LYS  20           2HG      LYS  20   6.765  12.777   2.271
  162    HG3  LYS  20           1HG      LYS  20   5.313  12.520   1.302
  163    HD2  LYS  20           2HD      LYS  20   6.022  14.849   1.072
  164    HD3  LYS  20           1HD      LYS  20   4.533  14.800   2.004
  165    HE2  LYS  20           2HE      LYS  20   6.062  16.396   2.963
  166    HE3  LYS  20           1HE      LYS  20   5.830  15.046   4.062
  167    HZ1  LYS  20           3HZ      LYS  20   8.148  15.776   3.898
  168    HZ2  LYS  20           1HZ      LYS  20   8.179  15.445   2.270
  169    HZ3  LYS  20           2HZ      LYS  20   8.043  14.167   3.341
  170    H    SER  21           H        SER  21   3.227  12.297   5.999
  171    HA   SER  21           HA       SER  21   2.926  14.984   6.824
  172    HB2  SER  21           2HB      SER  21   0.947  14.827   5.258
  173    HB3  SER  21           1HB      SER  21   0.313  13.529   6.258
  174    HG   SER  21           HG       SER  21   0.306  16.230   6.618
  175    H    ILE  22           H        ILE  22   0.874  14.508   8.712
  176    HA   ILE  22           HA       ILE  22   2.340  12.785  10.506
  177    HB   ILE  22           HB       ILE  22   0.858  13.486  12.296
  178   HG12  ILE  22          2HG1      ILE  22  -1.200  13.763  10.801
  179   HG13  ILE  22          1HG1      ILE  22  -1.029  14.950  12.095
  180   HG21  ILE  22          1HG2      ILE  22   1.903  15.800  10.699
  181   HG22  ILE  22          2HG2      ILE  22   2.777  14.849  11.901
  182   HG23  ILE  22          3HG2      ILE  22   1.432  15.876  12.397
  183   HD11  ILE  22          3HD1      ILE  22  -0.159  16.522  10.330
  184   HD12  ILE  22          1HD1      ILE  22  -1.831  16.007  10.109
  185   HD13  ILE  22          2HD1      ILE  22  -0.568  15.289   9.133
  186    H    ALA  23           H        ALA  23   1.034  11.381  11.987
  187    HA   ALA  23           HA       ALA  23   0.148   9.144  10.636
  188    HB1  ALA  23           1HB      ALA  23  -0.525   8.309  12.804
  189    HB2  ALA  23           2HB      ALA  23  -0.493   9.955  13.442
  190    HB3  ALA  23           3HB      ALA  23   1.010   9.184  12.926
  191    H    LEU  24           H        LEU  24  -1.650  11.921  11.525
  192    HA   LEU  24           HA       LEU  24  -4.223  10.691  11.696
  193    HB2  LEU  24           2HB      LEU  24  -3.535  12.829  12.835
  194    HB3  LEU  24           1HB      LEU  24  -3.495  13.607  11.275
  195    HG   LEU  24           HG       LEU  24  -6.023  12.458  12.498
  196   HD11  LEU  24          1HD1      LEU  24  -4.974  15.282  12.552
  197   HD12  LEU  24          2HD1      LEU  24  -5.118  14.198  13.939
  198   HD13  LEU  24          3HD1      LEU  24  -6.566  14.764  13.106
  199   HD21  LEU  24          3HD2      LEU  24  -7.157  13.914  10.901
  200   HD22  LEU  24          1HD2      LEU  24  -6.082  12.792  10.062
  201   HD23  LEU  24          2HD2      LEU  24  -5.600  14.476  10.287
  202    H    THR  25           H        THR  25  -2.280  12.222   9.202
  203    HA   THR  25           HA       THR  25  -4.344  12.303   7.262
  204    HB   THR  25           HB       THR  25  -1.361  12.311   6.909
  205    HG1  THR  25           HG1      THR  25  -1.448  14.344   7.506
  206   HG21  THR  25          3HG2      THR  25  -3.592  13.298   5.091
  207   HG22  THR  25          1HG2      THR  25  -2.726  11.776   4.922
  208   HG23  THR  25          2HG2      THR  25  -1.853  13.297   4.724
  209    H    ILE  26           H        ILE  26  -1.543  10.235   7.917
  210    HA   ILE  26           HA       ILE  26  -1.694   8.415   5.885
  211    HB   ILE  26           HB       ILE  26  -1.187   7.547   8.746
  212   HG12  ILE  26          2HG1      ILE  26   0.667   8.973   6.797
  213   HG13  ILE  26          1HG1      ILE  26   0.126   9.556   8.345
  214   HG21  ILE  26          1HG2      ILE  26  -0.192   6.519   6.097
  215   HG22  ILE  26          2HG2      ILE  26  -1.391   5.787   7.172
  216   HG23  ILE  26          3HG2      ILE  26   0.292   5.916   7.696
  217   HD11  ILE  26          3HD1      ILE  26   1.938   7.192   7.935
  218   HD12  ILE  26          1HD1      ILE  26   1.389   7.815   9.492
  219   HD13  ILE  26          2HD1      ILE  26   2.425   8.804   8.463
  220    H    ALA  27           H        ALA  27  -3.565   8.443   8.860
  221    HA   ALA  27           HA       ALA  27  -4.926   6.039   8.541
  222    HB1  ALA  27           1HB      ALA  27  -5.871   8.561   9.884
  223    HB2  ALA  27           2HB      ALA  27  -4.826   7.327  10.588
  224    HB3  ALA  27           3HB      ALA  27  -6.497   6.926  10.164
  225    H    LYS  28           H        LYS  28  -5.740   9.298   7.421
  226    HA   LYS  28           HA       LYS  28  -8.258   8.577   6.297
  227    HB2  LYS  28           2HB      LYS  28  -6.455  10.926   5.718
  228    HB3  LYS  28           1HB      LYS  28  -8.087  10.749   5.092
  229    HG2  LYS  28           2HG      LYS  28  -8.972  10.799   7.359
  230    HG3  LYS  28           1HG      LYS  28  -7.330  10.935   7.998
  231    HD2  LYS  28           2HD      LYS  28  -7.029  13.050   6.852
  232    HD3  LYS  28           1HD      LYS  28  -8.633  12.911   6.128
  233    HE2  LYS  28           2HE      LYS  28  -9.651  13.000   8.332
  234    HE3  LYS  28           1HE      LYS  28  -8.058  13.072   9.080
  235    HZ1  LYS  28           3HZ      LYS  28  -9.057  15.261   8.924
  236    HZ2  LYS  28           1HZ      LYS  28  -9.194  15.111   7.242
  237    HZ3  LYS  28           2HZ      LYS  28  -7.667  15.175   7.966
  238    H    GLU  29           H        GLU  29  -5.013   8.942   4.978
  239    HA   GLU  29           HA       GLU  29  -5.356   8.651   2.264
  240    HB2  GLU  29           2HB      GLU  29  -3.211   7.572   4.074
  241    HB3  GLU  29           1HB      GLU  29  -3.089   7.587   2.324
  242    HG2  GLU  29           2HG      GLU  29  -3.523  10.051   3.961
  243    HG3  GLU  29           1HG      GLU  29  -1.924   9.428   3.552
  244    H    ILE  30           H        ILE  30  -4.861   6.153   4.648
  245    HA   ILE  30           HA       ILE  30  -5.406   4.146   2.582
  246    HB   ILE  30           HB       ILE  30  -4.600   2.446   4.223
  247   HG12  ILE  30          2HG1      ILE  30  -3.806   4.911   5.791
  248   HG13  ILE  30          1HG1      ILE  30  -4.951   3.688   6.310
  249   HG21  ILE  30          1HG2      ILE  30  -2.717   4.669   3.437
  250   HG22  ILE  30          2HG2      ILE  30  -3.182   3.287   2.441
  251   HG23  ILE  30          3HG2      ILE  30  -2.229   3.040   3.907
  252   HD11  ILE  30          3HD1      ILE  30  -1.982   3.337   5.921
  253   HD12  ILE  30          1HD1      ILE  30  -3.098   2.047   6.365
  254   HD13  ILE  30          2HD1      ILE  30  -2.848   3.407   7.456
  255    H    GLY  31           H        GLY  31  -7.165   5.734   4.722
  256    HA2  GLY  31           2HA      GLY  31  -9.324   5.474   5.463
  257    HA3  GLY  31           1HA      GLY  31  -9.427   4.055   4.436
  258    H    LEU  32           H        LEU  32  -7.052   4.359   6.937
  259    HA   LEU  32           HA       LEU  32  -8.458   2.216   8.385
  260    HB2  LEU  32           2HB      LEU  32  -5.469   2.689   8.414
  261    HB3  LEU  32           1HB      LEU  32  -6.322   1.376   9.186
  262    HG   LEU  32           HG       LEU  32  -5.738   1.778   6.270
  263   HD11  LEU  32          1HD1      LEU  32  -5.213  -0.513   8.125
  264   HD12  LEU  32          2HD1      LEU  32  -4.046   0.692   7.604
  265   HD13  LEU  32          3HD1      LEU  32  -4.749  -0.421   6.426
  266   HD21  LEU  32          3HD2      LEU  32  -8.047   1.179   6.353
  267   HD22  LEU  32          1HD2      LEU  32  -7.720  -0.194   7.424
  268   HD23  LEU  32          2HD2      LEU  32  -7.099  -0.181   5.762
  269    H    ASP  33           H        ASP  33  -7.295   2.160  10.759
  270    HA   ASP  33           HA       ASP  33  -8.137   4.696  11.849
  271    HB2  ASP  33           2HB      ASP  33  -8.956   2.587  12.888
  272    HB3  ASP  33           1HB      ASP  33  -7.299   2.160  13.284
  273    H    LYS  34           H        LYS  34  -6.836   5.671  13.574
  274    HA   LYS  34           HA       LYS  34  -4.233   6.209  12.534
  275    HB2  LYS  34           2HB      LYS  34  -4.088   8.035  14.002
  276    HB3  LYS  34           1HB      LYS  34  -5.798   7.923  13.656
  277    HG2  LYS  34           2HG      LYS  34  -4.439   6.955  16.189
  278    HG3  LYS  34           1HG      LYS  34  -5.328   8.458  16.016
  279    HD2  LYS  34           2HD      LYS  34  -6.525   5.705  15.670
  280    HD3  LYS  34           1HD      LYS  34  -6.577   6.625  17.167
  281    HE2  LYS  34           2HE      LYS  34  -7.854   8.383  16.030
  282    HE3  LYS  34           1HE      LYS  34  -7.782   7.460  14.529
  283    HZ1  LYS  34           3HZ      LYS  34  -9.050   6.457  17.031
  284    HZ2  LYS  34           1HZ      LYS  34  -9.003   5.695  15.540
  285    HZ3  LYS  34           2HZ      LYS  34  -9.905   7.088  15.695
  286    H    SER  35           H        SER  35  -5.395   3.882  14.774
  287    HA   SER  35           HA       SER  35  -3.008   3.867  16.402
  288    HB2  SER  35           2HB      SER  35  -5.266   1.850  16.295
  289    HB3  SER  35           1HB      SER  35  -4.151   2.148  17.635
  290    HG   SER  35           HG       SER  35  -6.320   3.620  16.712
  291    H    THR  36           H        THR  36  -4.575   2.238  13.730
  292    HA   THR  36           HA       THR  36  -2.925   0.105  13.354
  293    HB   THR  36           HB       THR  36  -4.186   1.720  11.174
  294    HG1  THR  36           HG1      THR  36  -5.692   0.109  12.996
  295   HG21  THR  36          3HG2      THR  36  -3.165  -0.489  10.826
  296   HG22  THR  36          1HG2      THR  36  -4.930  -0.455  10.523
  297   HG23  THR  36          2HG2      THR  36  -4.308  -1.082  12.065
  298    H    VAL  37           H        VAL  37  -2.941   3.429  12.019
  299    HA   VAL  37           HA       VAL  37  -0.634   3.387  10.497
  300    HB   VAL  37           HB       VAL  37  -1.920   5.550  12.110
  301   HG11  VAL  37          1HG1      VAL  37   0.093   5.790   9.874
  302   HG12  VAL  37          2HG1      VAL  37   0.342   6.158  11.586
  303   HG13  VAL  37          3HG1      VAL  37  -0.767   7.136  10.638
  304   HG21  VAL  37          3HG2      VAL  37  -2.918   6.229   9.959
  305   HG22  VAL  37          1HG2      VAL  37  -3.411   4.614  10.470
  306   HG23  VAL  37          2HG2      VAL  37  -2.191   4.808   9.213
  307    H    ASN  38           H        ASN  38  -1.086   4.322  13.889
  308    HA   ASN  38           HA       ASN  38   1.503   5.001  14.508
  309    HB2  ASN  38           2HB      ASN  38  -0.746   4.000  16.168
  310    HB3  ASN  38           1HB      ASN  38   0.864   3.941  16.873
  311   HD21  ASN  38          2HD2      ASN  38  -1.027   7.468  16.382
  312   HD22  ASN  38          1HD2      ASN  38  -1.636   6.011  15.653
  313    H    ARG  39           H        ARG  39   0.088   1.788  14.662
  314    HA   ARG  39           HA       ARG  39   2.455   0.608  15.749
  315    HB2  ARG  39           2HB      ARG  39   1.679  -1.603  15.188
  316    HB3  ARG  39           1HB      ARG  39   0.286  -0.666  15.727
  317    HG2  ARG  39           2HG      ARG  39  -0.614  -0.583  13.581
  318    HG3  ARG  39           1HG      ARG  39   0.926  -0.945  12.829
  319    HD2  ARG  39           2HD      ARG  39  -0.697  -2.899  14.464
  320    HD3  ARG  39           1HD      ARG  39  -0.627  -2.857  12.703
  321    HE   ARG  39           HE       ARG  39   1.315  -3.926  14.517
  322   HH11  ARG  39          1HH1      ARG  39   0.938  -2.648  11.179
  323   HH12  ARG  39          2HH1      ARG  39   2.344  -3.417  10.608
  324   HH21  ARG  39          2HH2      ARG  39   3.568  -4.789  11.886
  325   HH22  ARG  39          1HH2      ARG  39   3.252  -5.066  13.547
  326    H    HIS  40           H        HIS  40   1.453   1.173  12.485
  327    HA   HIS  40           HA       HIS  40   3.526  -0.359  11.300
  328    HB2  HIS  40           2HB      HIS  40   1.691   1.744  10.143
  329    HB3  HIS  40           1HB      HIS  40   2.953   1.001   9.177
  330    HD1  HIS  40           HD1      HIS  40   2.387  -1.349   8.165
  331    HD2  HIS  40           HD2      HIS  40  -0.388  -0.043  10.959
  332    HE1  HIS  40           HE1      HIS  40   0.454  -2.917   8.000
  333    H    LEU  41           H        LEU  41   3.238   3.002  12.177
  334    HA   LEU  41           HA       LEU  41   5.693   3.663  10.849
  335    HB2  LEU  41           2HB      LEU  41   5.445   5.888  11.840
  336    HB3  LEU  41           1HB      LEU  41   4.051   5.397  10.896
  337    HG   LEU  41           HG       LEU  41   3.099   4.738  13.253
  338   HD11  LEU  41          1HD1      LEU  41   5.089   6.848  14.002
  339   HD12  LEU  41          2HD1      LEU  41   5.089   5.166  14.538
  340   HD13  LEU  41          3HD1      LEU  41   3.785   6.249  15.029
  341   HD21  LEU  41          3HD2      LEU  41   3.293   7.607  12.419
  342   HD22  LEU  41          1HD2      LEU  41   2.042   6.845  13.416
  343   HD23  LEU  41          2HD2      LEU  41   2.233   6.377  11.713
  344    H    TYR  42           H        TYR  42   4.749   2.698  14.086
  345    HA   TYR  42           HA       TYR  42   6.930   3.469  15.491
  346    HB2  TYR  42           2HB      TYR  42   4.839   1.447  15.468
  347    HB3  TYR  42           1HB      TYR  42   6.117   1.201  16.579
  348    HD1  TYR  42           HD1      TYR  42   3.486   1.294  17.565
  349    HD2  TYR  42           HD2      TYR  42   5.934   4.631  16.626
  350    HE1  TYR  42           HE1      TYR  42   2.117   2.710  19.051
  351    HE2  TYR  42           HE2      TYR  42   4.589   6.050  18.103
  352    HH   TYR  42           HH       TYR  42   2.221   6.021  18.949
  353    H    ASN  43           H        ASN  43   6.179   0.681  13.516
  354    HA   ASN  43           HA       ASN  43   8.460  -0.903  14.127
  355    HB2  ASN  43           2HB      ASN  43   6.850  -0.851  11.560
  356    HB3  ASN  43           1HB      ASN  43   7.986  -2.111  12.015
  357   HD21  ASN  43          2HD2      ASN  43   4.397  -2.887  12.838
  358   HD22  ASN  43          1HD2      ASN  43   5.132  -2.226  11.431
  359    H    LEU  44           H        LEU  44   7.767   1.237  11.432
  360    HA   LEU  44           HA       LEU  44  10.291   0.990  10.206
  361    HB2  LEU  44           2HB      LEU  44   8.400   3.318   9.979
  362    HB3  LEU  44           1HB      LEU  44   9.619   2.827   8.860
  363    HG   LEU  44           HG       LEU  44   7.190   1.151   9.438
  364   HD11  LEU  44          1HD1      LEU  44   6.396   1.953   7.243
  365   HD12  LEU  44          2HD1      LEU  44   7.770   3.051   7.165
  366   HD13  LEU  44          3HD1      LEU  44   6.543   3.264   8.412
  367   HD21  LEU  44          3HD2      LEU  44   7.875  -0.006   7.379
  368   HD22  LEU  44          1HD2      LEU  44   9.113  -0.113   8.632
  369   HD23  LEU  44          2HD2      LEU  44   9.302   1.020   7.292
  370    H    GLN  45           H        GLN  45   9.073   3.059  12.753
  371    HA   GLN  45           HA       GLN  45  10.900   5.179  12.610
  372    HB2  GLN  45           2HB      GLN  45   8.759   5.020  14.036
  373    HB3  GLN  45           1HB      GLN  45   9.727   4.089  15.110
  374    HG2  GLN  45           2HG      GLN  45  11.087   5.766  15.787
  375    HG3  GLN  45           1HG      GLN  45  10.849   6.703  14.316
  376   HE21  GLN  45          2HE2      GLN  45   8.137   8.438  15.459
  377   HE22  GLN  45          1HE2      GLN  45   9.119   7.980  14.120
  378    H    ARG  46           H        ARG  46  10.842   2.366  14.543
  379    HA   ARG  46           HA       ARG  46  13.340   2.854  15.886
  380    HB2  ARG  46           2HB      ARG  46  11.623   0.405  15.650
  381    HB3  ARG  46           1HB      ARG  46  13.043   0.519  16.683
  382    HG2  ARG  46           2HG      ARG  46  12.049   2.145  18.053
  383    HG3  ARG  46           1HG      ARG  46  10.755   2.440  16.887
  384    HD2  ARG  46           2HD      ARG  46  11.230  -0.205  18.094
  385    HD3  ARG  46           1HD      ARG  46  10.191   0.992  18.921
  386    HE   ARG  46           HE       ARG  46   9.259   0.832  16.371
  387   HH11  ARG  46          1HH1      ARG  46   9.783  -1.576  18.933
  388   HH12  ARG  46          2HH1      ARG  46   8.534  -2.625  18.444
  389   HH21  ARG  46          2HH2      ARG  46   7.201  -2.071  16.501
  390   HH22  ARG  46          1HH2      ARG  46   7.503  -0.643  15.682
  391    H    SER  47           H        SER  47  12.343   1.294  13.091
  392    HA   SER  47           HA       SER  47  14.790  -0.096  12.595
  393    HB2  SER  47           2HB      SER  47  12.635  -0.964  11.757
  394    HB3  SER  47           1HB      SER  47  12.461   0.461  10.740
  395    HG   SER  47           HG       SER  47  14.669  -0.311   9.951
  396    H    ASN  48           H        ASN  48  13.939   3.271  12.375
  397    HA   ASN  48           HA       ASN  48  14.867   5.020  11.469
  398    HB2  ASN  48           2HB      ASN  48  17.080   3.044  11.081
  399    HB3  ASN  48           1HB      ASN  48  17.287   4.719  10.542
  400   HD21  ASN  48          2HD2      ASN  48  17.517   3.694  14.452
  401   HD22  ASN  48          1HD2      ASN  48  17.028   2.551  13.246
  402    H    GLN  49           H        GLN  49  13.084   3.512  10.037
  403    HA   GLN  49           HA       GLN  49  13.989   3.709   7.260
  404    HB2  GLN  49           2HB      GLN  49  13.037   1.539   8.168
  405    HB3  GLN  49           1HB      GLN  49  11.558   2.378   8.533
  406    HG2  GLN  49           2HG      GLN  49  12.682   1.797   5.785
  407    HG3  GLN  49           1HG      GLN  49  11.322   0.986   6.550
  408   HE21  GLN  49          2HE2      GLN  49  10.825   4.421   4.631
  409   HE22  GLN  49          1HE2      GLN  49  12.356   3.591   4.706
  410    H    VAL  50           H        VAL  50  11.496   4.479   9.628
  411    HA   VAL  50           HA       VAL  50  10.839   6.876   8.103
  412    HB   VAL  50           HB       VAL  50   9.083   4.884   8.252
  413   HG11  VAL  50          1HG1      VAL  50   8.476   6.496  10.758
  414   HG12  VAL  50          2HG1      VAL  50   9.197   4.922  10.763
  415   HG13  VAL  50          3HG1      VAL  50   7.510   5.126  10.177
  416   HG21  VAL  50          3HG2      VAL  50   8.361   7.787   8.592
  417   HG22  VAL  50          1HG2      VAL  50   7.236   6.530   8.073
  418   HG23  VAL  50          2HG2      VAL  50   8.640   6.922   7.081
  419    H    PHE  51           H        PHE  51  10.470   8.502   9.370
  420    HA   PHE  51           HA       PHE  51  10.321   8.568  12.156
  421    HB2  PHE  51           2HB      PHE  51  12.624   9.836  12.498
  422    HB3  PHE  51           1HB      PHE  51  12.593   8.076  12.475
  423    HD1  PHE  51           HD1      PHE  51  13.972   6.914  11.126
  424    HD2  PHE  51           HD2      PHE  51  13.228  10.998  10.225
  425    HE1  PHE  51           HE1      PHE  51  15.653   6.795   9.399
  426    HE2  PHE  51           HE2      PHE  51  14.937  10.917   8.453
  427    HZ   PHE  51           HZ       PHE  51  16.166   8.814   8.023
  428    H    ASN  52           H        ASN  52  11.033  11.108  12.805
  429    HA   ASN  52           HA       ASN  52   9.476  12.623  10.901
  430    HB2  ASN  52           2HB      ASN  52  11.038  13.724  13.213
  431    HB3  ASN  52           1HB      ASN  52   9.812  14.542  12.301
  432   HD21  ASN  52          2HD2      ASN  52   7.059  13.190  13.937
  433   HD22  ASN  52          1HD2      ASN  52   7.611  14.113  12.595
  434    H    SER  53           H        SER  53  10.314  14.148   9.507
  435    HA   SER  53           HA       SER  53  13.170  13.868   9.244
  436    HB2  SER  53           2HB      SER  53  12.133  12.205   7.812
  437    HB3  SER  53           1HB      SER  53  11.134  13.442   7.059
  438    HG   SER  53           HG       SER  53  13.007  12.810   5.879
  439    H    ASN  54           H        ASN  54  14.051  15.526   9.120
  440    HA   ASN  54           HA       ASN  54  15.003  17.556   8.644
  441    HB2  ASN  54           2HB      ASN  54  15.760  17.401   6.512
  442    HB3  ASN  54           1HB      ASN  54  14.970  15.836   6.817
  443   HD21  ASN  54          2HD2      ASN  54  12.492  16.190   4.403
  444   HD22  ASN  54          1HD2      ASN  54  13.095  15.263   5.731
  445    H    GLU  55           H        GLU  55  11.623  17.713   7.730
  446    HA   GLU  55           HA       GLU  55  12.086  20.368   6.794
  447    HB2  GLU  55           2HB      GLU  55   9.615  20.323   6.160
  448    HB3  GLU  55           1HB      GLU  55  10.698  19.264   5.280
  449    HG2  GLU  55           2HG      GLU  55   9.975  17.425   6.778
  450    HG3  GLU  55           1HG      GLU  55   8.733  18.509   7.424
  451    H    LYS  56           H        LYS  56   9.963  21.802   7.423
  452    HA   LYS  56           HA       LYS  56  10.790  22.243  10.088
  453    HB2  LYS  56           2HB      LYS  56   9.263  24.016   8.207
  454    HB3  LYS  56           1HB      LYS  56   9.443  24.425   9.913
  455    HG2  LYS  56           2HG      LYS  56  11.179  25.544   8.689
  456    HG3  LYS  56           1HG      LYS  56  11.918  24.263   9.650
  457    HD2  LYS  56           2HD      LYS  56  11.423  23.017   7.230
  458    HD3  LYS  56           1HD      LYS  56  11.850  24.655   6.737
  459    HE2  LYS  56           2HE      LYS  56  13.871  23.365   6.769
  460    HE3  LYS  56           1HE      LYS  56  13.922  24.443   8.159
  461    HZ1  LYS  56           3HZ      LYS  56  13.097  22.459   9.522
  462    HZ2  LYS  56           1HZ      LYS  56  14.644  22.280   8.864
  463    HZ3  LYS  56           2HZ      LYS  56  13.372  21.506   8.158
  464    HA   PRO  57           HA       PRO  57   6.615  20.842  11.359
  465    HB2  PRO  57           2HB      PRO  57   5.269  19.560   9.124
  466    HB3  PRO  57           1HB      PRO  57   4.664  20.926  10.079
  467    HG2  PRO  57           2HG      PRO  57   5.333  21.136   7.456
  468    HG3  PRO  57           1HG      PRO  57   5.403  22.484   8.609
  469    HD2  PRO  57           2HD      PRO  57   7.622  20.771   7.594
  470    HD3  PRO  57           1HD      PRO  57   7.586  22.525   7.890
  471    HA   PRO  58           HA       PRO  58   9.451  17.247  11.152
  472    HB2  PRO  58           2HB      PRO  58   7.719  16.400  13.441
  473    HB3  PRO  58           1HB      PRO  58   9.493  16.463  13.348
  474    HG2  PRO  58           2HG      PRO  58   8.213  18.289  14.721
  475    HG3  PRO  58           1HG      PRO  58   9.590  18.734  13.693
  476    HD2  PRO  58           2HD      PRO  58   6.677  19.143  13.198
  477    HD3  PRO  58           1HD      PRO  58   8.055  20.198  12.818
  478    H    VAL  59           H        VAL  59   8.891  16.119   9.349
  479    HA   VAL  59           HA       VAL  59   6.170  15.169   8.998
  480    HB   VAL  59           HB       VAL  59   7.515  16.199   7.178
  481   HG11  VAL  59          1HG1      VAL  59   9.093  14.800   5.942
  482   HG12  VAL  59          2HG1      VAL  59   9.038  13.643   7.283
  483   HG13  VAL  59          3HG1      VAL  59   9.651  15.269   7.549
  484   HG21  VAL  59          3HG2      VAL  59   5.573  15.011   6.463
  485   HG22  VAL  59          1HG2      VAL  59   6.377  13.455   6.785
  486   HG23  VAL  59          2HG2      VAL  59   6.947  14.425   5.480
  487    H    TRP  60           H        TRP  60   5.368  13.218   9.031
  488    HA   TRP  60           HA       TRP  60   7.224  11.120   9.699
  489    HB2  TRP  60           2HB      TRP  60   4.188  11.011   9.453
  490    HB3  TRP  60           1HB      TRP  60   5.231   9.745  10.104
  491    HD1  TRP  60           HD1      TRP  60   4.285  13.352  10.876
  492    HE1  TRP  60           HE1      TRP  60   4.267  13.715  13.450
  493    HE3  TRP  60           HE3      TRP  60   5.935   8.764  12.315
  494    HZ2  TRP  60           HZ2      TRP  60   4.895  12.223  15.755
  495    HZ3  TRP  60           HZ3      TRP  60   6.221   8.315  14.727
  496    HH2  TRP  60           HH2      TRP  60   5.709  10.001  16.396
  497    H    ASP  61           H        ASP  61   8.234  10.751   8.079
  498    HA   ASP  61           HA       ASP  61   7.214   9.780   5.598
  499    HB2  ASP  61           2HB      ASP  61   7.124  12.294   5.331
  500    HB3  ASP  61           1HB      ASP  61   8.829  12.363   5.718
  501    H    LEU  62           H        LEU  62   9.499   9.928   4.334
  502    HA   LEU  62           HA       LEU  62  11.399   8.746   6.203
  503    HB2  LEU  62           2HB      LEU  62  11.596   6.746   4.683
  504    HB3  LEU  62           1HB      LEU  62  10.120   7.060   5.602
  505    HG   LEU  62           HG       LEU  62   8.908   7.745   3.636
  506   HD11  LEU  62          1HD1      LEU  62   9.776   7.677   1.422
  507   HD12  LEU  62          2HD1      LEU  62  11.322   7.099   2.010
  508   HD13  LEU  62          3HD1      LEU  62  10.792   8.743   2.402
  509   HD21  LEU  62          3HD2      LEU  62  10.339   5.160   3.094
  510   HD22  LEU  62          1HD2      LEU  62   8.788   5.653   2.426
  511   HD23  LEU  62          2HD2      LEU  62   8.946   5.355   4.160
  512    H    MET  63           H        MET  63  13.233   7.741   4.402
  513    HA   MET  63           HA       MET  63  14.204  10.106   2.930
  514    HB2  MET  63           2HB      MET  63  15.178   9.873   5.279
  515    HB3  MET  63           1HB      MET  63  15.828   8.329   4.738
  516    HG2  MET  63           2HG      MET  63  17.224   9.441   3.095
  517    HG3  MET  63           1HG      MET  63  16.531  11.004   3.523
  518    HE1  MET  63           3HE      MET  63  16.948  12.211   5.869
  519    HE2  MET  63           1HE      MET  63  17.917  11.515   7.169
  520    HE3  MET  63           2HE      MET  63  16.379  10.779   6.730
  521    H    GLU  64           H        GLU  64  12.883   7.759   2.047
  522    HA   GLU  64           HA       GLU  64  15.005   6.218   0.746
  523    HB2  GLU  64           2HB      GLU  64  13.984   5.262   2.868
  524    HB3  GLU  64           1HB      GLU  64  12.487   5.107   1.975
  525    HG2  GLU  64           2HG      GLU  64  13.737   3.644   0.354
  526    HG3  GLU  64           1HG      GLU  64  15.082   3.666   1.502
  Start of MODEL    2
    1    HA   MET   1           HA       MET   1  12.452 -11.932   1.719
    2    HB2  MET   1           2HB      MET   1  12.746 -10.519   4.396
    3    HB3  MET   1           1HB      MET   1  12.175 -12.165   4.194
    4    HG2  MET   1           2HG      MET   1  14.345 -12.840   3.347
    5    HG3  MET   1           1HG      MET   1  14.920 -11.174   3.445
    6    HE1  MET   1           2HE      MET   1  17.028 -12.026   4.873
    7    HE2  MET   1           3HE      MET   1  16.431 -13.684   4.803
    8    HE3  MET   1           1HE      MET   1  16.872 -12.969   6.355
    9    H    SER   2           H        SER   2  10.257 -12.440   2.959
   10    HA   SER   2           HA       SER   2   8.493 -10.203   2.369
   11    HB2  SER   2           2HB      SER   2   8.091 -12.380   1.153
   12    HB3  SER   2           1HB      SER   2   7.850 -13.158   2.717
   13    HG   SER   2           HG       SER   2   5.845 -12.618   2.225
   14    H    ALA   3           H        ALA   3   7.499  -9.260   4.066
   15    HA   ALA   3           HA       ALA   3   7.077 -10.600   6.540
   16    HB1  ALA   3           1HB      ALA   3   9.065  -8.318   6.419
   17    HB2  ALA   3           2HB      ALA   3   9.444  -9.994   6.814
   18    HB3  ALA   3           3HB      ALA   3   8.422  -9.043   7.892
   19    H    GLU   4           H        GLU   4   6.001  -9.067   8.055
   20    HA   GLU   4           HA       GLU   4   3.958  -7.705   6.705
   21    HB2  GLU   4           2HB      GLU   4   3.647  -8.824   8.865
   22    HB3  GLU   4           1HB      GLU   4   4.722  -7.668   9.629
   23    HG2  GLU   4           2HG      GLU   4   3.166  -5.880   9.180
   24    HG3  GLU   4           1HG      GLU   4   2.108  -6.990   8.317
   25    H    THR   5           H        THR   5   7.040  -6.639   7.923
   26    HA   THR   5           HA       THR   5   6.523  -3.897   8.157
   27    HB   THR   5           HB       THR   5   9.091  -3.834   7.787
   28    HG1  THR   5           HG1      THR   5  10.075  -5.786   7.752
   29   HG21  THR   5          3HG2      THR   5   8.002  -3.718  10.003
   30   HG22  THR   5          1HG2      THR   5   9.466  -4.700  10.067
   31   HG23  THR   5          2HG2      THR   5   7.883  -5.476  10.030
   32    H    GLN   6           H        GLN   6   6.953  -5.927   5.420
   33    HA   GLN   6           HA       GLN   6   7.819  -3.888   3.597
   34    HB2  GLN   6           2HB      GLN   6   8.118  -6.502   3.490
   35    HB3  GLN   6           1HB      GLN   6   6.500  -6.501   2.823
   36    HG2  GLN   6           2HG      GLN   6   8.728  -4.905   1.591
   37    HG3  GLN   6           1HG      GLN   6   8.477  -6.600   1.211
   38   HE21  GLN   6          2HE2      GLN   6   6.820  -4.213  -1.193
   39   HE22  GLN   6          1HE2      GLN   6   8.367  -4.220  -0.437
   40    H    MET   7           H        MET   7   4.864  -5.109   4.873
   41    HA   MET   7           HA       MET   7   3.067  -3.929   2.965
   42    HB2  MET   7           2HB      MET   7   2.604  -4.931   5.784
   43    HB3  MET   7           1HB      MET   7   1.327  -4.358   4.728
   44    HG2  MET   7           2HG      MET   7   3.114  -6.718   4.162
   45    HG3  MET   7           1HG      MET   7   1.497  -6.820   4.851
   46    HE1  MET   7           3HE      MET   7  -0.776  -5.596   1.918
   47    HE2  MET   7           1HE      MET   7  -0.129  -4.610   3.229
   48    HE3  MET   7           2HE      MET   7  -0.721  -6.237   3.559
   49    H    GLU   8           H        GLU   8   4.280  -3.122   6.148
   50    HA   GLU   8           HA       GLU   8   2.973  -0.752   6.664
   51    HB2  GLU   8           2HB      GLU   8   5.883  -1.325   7.230
   52    HB3  GLU   8           1HB      GLU   8   4.868  -0.188   8.107
   53    HG2  GLU   8           2HG      GLU   8   4.553  -3.189   8.069
   54    HG3  GLU   8           1HG      GLU   8   5.324  -2.260   9.351
   55    H    ARG   9           H        ARG   9   5.884  -1.292   4.821
   56    HA   ARG   9           HA       ARG   9   6.353   1.460   4.150
   57    HB2  ARG   9           2HB      ARG   9   8.311   0.292   3.741
   58    HB3  ARG   9           1HB      ARG   9   7.461  -1.183   3.328
   59    HG2  ARG   9           2HG      ARG   9   8.608  -0.533   1.364
   60    HG3  ARG   9           1HG      ARG   9   6.928  -0.108   1.092
   61    HD2  ARG   9           2HD      ARG   9   8.133   1.720   0.274
   62    HD3  ARG   9           1HD      ARG   9   7.606   2.244   1.872
   63    HE   ARG   9           HE       ARG   9   9.998   1.254   2.433
   64   HH11  ARG   9          1HH1      ARG   9   9.018   3.481  -0.248
   65   HH12  ARG   9          2HH1      ARG   9  10.578   4.184  -0.271
   66   HH21  ARG   9          2HH2      ARG   9  12.238   3.555   1.016
   67   HH22  ARG   9          1HH2      ARG   9  12.121   2.282   2.198
   68    H    LYS  10           H        LYS  10   4.535  -1.058   2.513
   69    HA   LYS  10           HA       LYS  10   4.309   0.499   0.136
   70    HB2  LYS  10           2HB      LYS  10   2.693  -1.854   1.066
   71    HB3  LYS  10           1HB      LYS  10   2.448  -1.073  -0.493
   72    HG2  LYS  10           2HG      LYS  10   4.709  -1.595  -1.158
   73    HG3  LYS  10           1HG      LYS  10   5.044  -2.280   0.429
   74    HD2  LYS  10           2HD      LYS  10   3.049  -3.335  -1.580
   75    HD3  LYS  10           1HD      LYS  10   4.627  -4.037  -1.215
   76    HE2  LYS  10           2HE      LYS  10   3.819  -4.179   1.182
   77    HE3  LYS  10           1HE      LYS  10   2.194  -3.887   0.549
   78    HZ1  LYS  10           3HZ      LYS  10   2.582  -6.216   0.790
   79    HZ2  LYS  10           1HZ      LYS  10   4.032  -6.101  -0.068
   80    HZ3  LYS  10           2HZ      LYS  10   2.550  -5.890  -0.882
   81    H    ILE  11           H        ILE  11   2.428   0.466   3.062
   82    HA   ILE  11           HA       ILE  11   0.295   1.853   1.780
   83    HB   ILE  11           HB       ILE  11  -0.639   2.042   4.020
   84   HG12  ILE  11          2HG1      ILE  11   1.942   0.704   4.817
   85   HG13  ILE  11          1HG1      ILE  11   1.269   2.209   5.421
   86   HG21  ILE  11          1HG2      ILE  11  -0.989  -0.413   4.299
   87   HG22  ILE  11          2HG2      ILE  11   0.418  -0.640   3.244
   88   HG23  ILE  11          3HG2      ILE  11  -1.057   0.090   2.590
   89   HD11  ILE  11          3HD1      ILE  11   0.236  -0.534   5.853
   90   HD12  ILE  11          1HD1      ILE  11  -0.532   0.932   6.485
   91   HD13  ILE  11          2HD1      ILE  11   1.089   0.467   7.036
   92    H    ILE  12           H        ILE  12   3.029   2.685   3.879
   93    HA   ILE  12           HA       ILE  12   2.129   5.401   3.942
   94    HB   ILE  12           HB       ILE  12   3.910   5.917   5.295
   95   HG12  ILE  12          2HG1      ILE  12   5.964   4.115   5.180
   96   HG13  ILE  12          1HG1      ILE  12   5.435   4.207   3.523
   97   HG21  ILE  12          1HG2      ILE  12   3.665   2.996   5.768
   98   HG22  ILE  12          2HG2      ILE  12   2.682   4.287   6.456
   99   HG23  ILE  12          3HG2      ILE  12   4.393   4.165   6.869
  100   HD11  ILE  12          3HD1      ILE  12   7.133   5.966   3.790
  101   HD12  ILE  12          1HD1      ILE  12   6.206   6.682   5.114
  102   HD13  ILE  12          2HD1      ILE  12   5.555   6.689   3.505
  103    H    ASP  13           H        ASP  13   4.097   3.456   1.860
  104    HA   ASP  13           HA       ASP  13   5.540   5.490   0.569
  105    HB2  ASP  13           2HB      ASP  13   5.754   2.890   0.353
  106    HB3  ASP  13           1HB      ASP  13   4.521   3.061  -0.893
  107    H    PHE  14           H        PHE  14   2.477   3.953  -0.128
  108    HA   PHE  14           HA       PHE  14   1.777   5.534  -2.270
  109    HB2  PHE  14           2HB      PHE  14   0.407   3.651  -1.944
  110    HB3  PHE  14           1HB      PHE  14   0.213   3.981  -0.234
  111    HD1  PHE  14           HD1      PHE  14  -1.492   5.366   0.558
  112    HD2  PHE  14           HD2      PHE  14  -0.953   4.834  -3.609
  113    HE1  PHE  14           HE1      PHE  14  -3.717   6.332   0.177
  114    HE2  PHE  14           HE2      PHE  14  -3.180   5.813  -4.035
  115    HZ   PHE  14           HZ       PHE  14  -4.572   6.564  -2.140
  116    H    LEU  15           H        LEU  15   1.160   6.105   1.180
  117    HA   LEU  15           HA       LEU  15  -0.077   8.530   0.887
  118    HB2  LEU  15           2HB      LEU  15  -0.506   7.688   2.786
  119    HB3  LEU  15           1HB      LEU  15   0.945   6.730   2.916
  120    HG   LEU  15           HG       LEU  15   0.518   8.149   4.772
  121   HD11  LEU  15          1HD1      LEU  15   3.003   9.014   3.306
  122   HD12  LEU  15          2HD1      LEU  15   2.838   7.652   4.413
  123   HD13  LEU  15          3HD1      LEU  15   2.714   9.303   5.023
  124   HD21  LEU  15          3HD2      LEU  15   0.819  10.371   2.865
  125   HD22  LEU  15          1HD2      LEU  15   0.813  10.642   4.617
  126   HD23  LEU  15          2HD2      LEU  15  -0.633   9.980   3.823
  127    H    ARG  16           H        ARG  16   3.165   7.719   0.421
  128    HA   ARG  16           HA       ARG  16   4.193  10.271   1.292
  129    HB2  ARG  16           2HB      ARG  16   6.293   9.233   1.271
  130    HB3  ARG  16           1HB      ARG  16   5.215   7.832   1.167
  131    HG2  ARG  16           2HG      ARG  16   5.536   7.556  -1.125
  132    HG3  ARG  16           1HG      ARG  16   6.423   9.074  -1.261
  133    HD2  ARG  16           2HD      ARG  16   8.255   8.235  -0.088
  134    HD3  ARG  16           1HD      ARG  16   7.333   6.862   0.533
  135    HE   ARG  16           HE       ARG  16   7.238   6.166  -1.898
  136   HH11  ARG  16          1HH1      ARG  16  10.025   8.126  -0.862
  137   HH12  ARG  16          2HH1      ARG  16  11.150   7.077  -1.622
  138   HH21  ARG  16          2HH2      ARG  16  10.487   5.289  -2.836
  139   HH22  ARG  16          1HH2      ARG  16   8.805   4.857  -2.919
  140    H    GLN  17           H        GLN  17   3.031   8.673  -1.467
  141    HA   GLN  17           HA       GLN  17   4.023  10.756  -3.174
  142    HB2  GLN  17           2HB      GLN  17   2.624   8.183  -3.725
  143    HB3  GLN  17           1HB      GLN  17   2.576   9.457  -4.941
  144    HG2  GLN  17           2HG      GLN  17   4.574   8.597  -5.657
  145    HG3  GLN  17           1HG      GLN  17   5.126   9.489  -4.230
  146   HE21  GLN  17          2HE2      GLN  17   4.845   5.634  -3.322
  147   HE22  GLN  17          1HE2      GLN  17   3.423   6.443  -3.919
  148    H    ASN  18           H        ASN  18   1.240  10.067  -1.376
  149    HA   ASN  18           HA       ASN  18  -0.348  12.084  -2.712
  150    HB2  ASN  18           2HB      ASN  18  -0.654  10.945   0.079
  151    HB3  ASN  18           1HB      ASN  18  -1.882  11.813  -0.835
  152   HD21  ASN  18          2HD2      ASN  18  -2.129   8.061  -0.967
  153   HD22  ASN  18          1HD2      ASN  18  -1.765   9.152   0.336
  154    H    GLY  19           H        GLY  19   1.658  11.752   0.184
  155    HA2  GLY  19           2HA      GLY  19   3.003  13.946   0.313
  156    HA3  GLY  19           1HA      GLY  19   1.416  14.534   0.814
  157    H    LYS  20           H        LYS  20   4.051  12.208   1.632
  158    HA   LYS  20           HA       LYS  20   3.507  11.125   3.933
  159    HB2  LYS  20           2HB      LYS  20   5.810  11.463   4.515
  160    HB3  LYS  20           1HB      LYS  20   5.709  11.280   2.766
  161    HG2  LYS  20           2HG      LYS  20   5.520  13.987   3.849
  162    HG3  LYS  20           1HG      LYS  20   7.119  13.230   3.938
  163    HD2  LYS  20           2HD      LYS  20   7.094  13.059   1.499
  164    HD3  LYS  20           1HD      LYS  20   5.451  13.720   1.462
  165    HE2  LYS  20           2HE      LYS  20   7.329  15.396   1.021
  166    HE3  LYS  20           1HE      LYS  20   6.166  15.834   2.270
  167    HZ1  LYS  20           3HZ      LYS  20   8.841  14.599   2.855
  168    HZ2  LYS  20           1HZ      LYS  20   7.716  15.137   3.943
  169    HZ3  LYS  20           2HZ      LYS  20   8.467  16.272   3.077
  170    H    SER  21           H        SER  21   3.693  11.837   6.268
  171    HA   SER  21           HA       SER  21   3.538  14.510   7.030
  172    HB2  SER  21           2HB      SER  21   1.565  14.548   5.479
  173    HB3  SER  21           1HB      SER  21   0.796  13.314   6.465
  174    HG   SER  21           HG       SER  21   1.062  16.007   6.834
  175    H    ILE  22           H        ILE  22   1.440  14.291   8.858
  176    HA   ILE  22           HA       ILE  22   2.692  12.640  10.866
  177    HB   ILE  22           HB       ILE  22   1.060  13.658  12.427
  178   HG12  ILE  22          2HG1      ILE  22   0.128  15.232  10.000
  179   HG13  ILE  22          1HG1      ILE  22  -0.795  13.964  10.795
  180   HG21  ILE  22          1HG2      ILE  22   3.217  14.717  12.074
  181   HG22  ILE  22          2HG2      ILE  22   1.975  15.945  12.325
  182   HG23  ILE  22          3HG2      ILE  22   2.574  15.617  10.700
  183   HD11  ILE  22          3HD1      ILE  22  -0.905  15.324  12.823
  184   HD12  ILE  22          1HD1      ILE  22  -1.579  16.174  11.434
  185   HD13  ILE  22          2HD1      ILE  22   0.031  16.588  12.025
  186    H    ALA  23           H        ALA  23   1.019  11.645  12.440
  187    HA   ALA  23           HA       ALA  23   0.161   9.283  11.329
  188    HB1  ALA  23           1HB      ALA  23  -0.726  10.519  13.898
  189    HB2  ALA  23           2HB      ALA  23   0.764   9.597  13.666
  190    HB3  ALA  23           3HB      ALA  23  -0.809   8.802  13.497
  191    H    LEU  24           H        LEU  24  -1.587  12.251  11.631
  192    HA   LEU  24           HA       LEU  24  -4.209  11.090  11.639
  193    HB2  LEU  24           2HB      LEU  24  -3.639  13.309  12.664
  194    HB3  LEU  24           1HB      LEU  24  -3.352  13.944  11.068
  195    HG   LEU  24           HG       LEU  24  -5.509  14.654  12.130
  196   HD11  LEU  24          1HD1      LEU  24  -5.291  14.823   9.732
  197   HD12  LEU  24          2HD1      LEU  24  -6.936  14.365  10.171
  198   HD13  LEU  24          3HD1      LEU  24  -5.820  13.151   9.545
  199   HD21  LEU  24          3HD2      LEU  24  -6.300  11.776  11.711
  200   HD22  LEU  24          1HD2      LEU  24  -7.383  13.083  12.188
  201   HD23  LEU  24          2HD2      LEU  24  -6.079  12.581  13.265
  202    H    THR  25           H        THR  25  -2.085  12.597   9.254
  203    HA   THR  25           HA       THR  25  -3.885  12.610   7.131
  204    HB   THR  25           HB       THR  25  -0.914  12.376   7.030
  205    HG1  THR  25           HG1      THR  25  -0.827  14.475   7.568
  206   HG21  THR  25          3HG2      THR  25  -1.169  13.450   4.856
  207   HG22  THR  25          1HG2      THR  25  -2.917  13.667   5.159
  208   HG23  THR  25          2HG2      THR  25  -2.269  12.057   4.999
  209    H    ILE  26           H        ILE  26  -1.256  10.414   7.991
  210    HA   ILE  26           HA       ILE  26  -1.381   8.679   5.869
  211    HB   ILE  26           HB       ILE  26  -0.849   7.758   8.720
  212   HG12  ILE  26          2HG1      ILE  26   1.073   8.925   6.661
  213   HG13  ILE  26          1HG1      ILE  26   0.538   9.742   8.118
  214   HG21  ILE  26          1HG2      ILE  26  -1.186   5.976   7.195
  215   HG22  ILE  26          2HG2      ILE  26   0.548   6.059   7.564
  216   HG23  ILE  26          3HG2      ILE  26  -0.083   6.683   6.024
  217   HD11  ILE  26          3HD1      ILE  26   1.662   8.057   9.478
  218   HD12  ILE  26          1HD1      ILE  26   2.780   8.847   8.365
  219   HD13  ILE  26          2HD1      ILE  26   2.184   7.224   8.013
  220    H    ALA  27           H        ALA  27  -3.283   8.631   8.825
  221    HA   ALA  27           HA       ALA  27  -4.718   6.282   8.403
  222    HB1  ALA  27           1HB      ALA  27  -5.610   8.813   9.781
  223    HB2  ALA  27           2HB      ALA  27  -4.669   7.511  10.508
  224    HB3  ALA  27           3HB      ALA  27  -6.329   7.210   9.984
  225    H    LYS  28           H        LYS  28  -5.423   9.657   7.364
  226    HA   LYS  28           HA       LYS  28  -7.881   9.168   6.202
  227    HB2  LYS  28           2HB      LYS  28  -6.251  11.276   6.841
  228    HB3  LYS  28           1HB      LYS  28  -6.191  11.266   5.092
  229    HG2  LYS  28           2HG      LYS  28  -8.595  11.260   6.763
  230    HG3  LYS  28           1HG      LYS  28  -7.889  12.731   6.091
  231    HD2  LYS  28           2HD      LYS  28  -9.000  10.410   4.440
  232    HD3  LYS  28           1HD      LYS  28  -9.911  11.868   4.790
  233    HE2  LYS  28           2HE      LYS  28  -9.086  12.113   2.560
  234    HE3  LYS  28           1HE      LYS  28  -8.086  13.154   3.557
  235    HZ1  LYS  28           3HZ      LYS  28  -7.226  10.415   2.768
  236    HZ2  LYS  28           1HZ      LYS  28  -6.262  11.621   3.374
  237    HZ3  LYS  28           2HZ      LYS  28  -6.809  11.763   1.851
  238    H    GLU  29           H        GLU  29  -4.590   8.804   5.061
  239    HA   GLU  29           HA       GLU  29  -5.428   8.779   2.303
  240    HB2  GLU  29           2HB      GLU  29  -2.707   8.062   3.364
  241    HB3  GLU  29           1HB      GLU  29  -3.119   8.538   1.725
  242    HG2  GLU  29           2HG      GLU  29  -2.859  10.203   4.187
  243    HG3  GLU  29           1HG      GLU  29  -2.120  10.425   2.607
  244    H    ILE  30           H        ILE  30  -4.534   6.501   4.753
  245    HA   ILE  30           HA       ILE  30  -4.642   4.397   2.722
  246    HB   ILE  30           HB       ILE  30  -3.705   2.852   4.370
  247   HG12  ILE  30          2HG1      ILE  30  -3.533   5.272   6.180
  248   HG13  ILE  30          1HG1      ILE  30  -4.576   3.888   6.447
  249   HG21  ILE  30          1HG2      ILE  30  -1.448   3.898   4.487
  250   HG22  ILE  30          2HG2      ILE  30  -2.175   5.420   3.972
  251   HG23  ILE  30          3HG2      ILE  30  -2.204   4.023   2.899
  252   HD11  ILE  30          3HD1      ILE  30  -1.561   3.898   6.475
  253   HD12  ILE  30          1HD1      ILE  30  -2.574   2.472   6.693
  254   HD13  ILE  30          2HD1      ILE  30  -2.630   3.776   7.876
  255    H    GLY  31           H        GLY  31  -6.634   5.782   4.965
  256    HA2  GLY  31           2HA      GLY  31  -8.858   5.326   5.362
  257    HA3  GLY  31           1HA      GLY  31  -8.696   3.870   4.391
  258    H    LEU  32           H        LEU  32  -6.497   4.396   6.969
  259    HA   LEU  32           HA       LEU  32  -7.872   2.265   8.455
  260    HB2  LEU  32           2HB      LEU  32  -4.911   2.882   8.616
  261    HB3  LEU  32           1HB      LEU  32  -5.744   1.535   9.352
  262    HG   LEU  32           HG       LEU  32  -4.993   1.936   6.476
  263   HD11  LEU  32          1HD1      LEU  32  -3.962  -0.232   6.698
  264   HD12  LEU  32          2HD1      LEU  32  -4.506  -0.324   8.370
  265   HD13  LEU  32          3HD1      LEU  32  -3.345   0.912   7.893
  266   HD21  LEU  32          3HD2      LEU  32  -6.251  -0.075   5.888
  267   HD22  LEU  32          1HD2      LEU  32  -7.266   1.272   6.395
  268   HD23  LEU  32          2HD2      LEU  32  -6.986  -0.082   7.508
  269    H    ASP  33           H        ASP  33  -6.899   2.383  10.900
  270    HA   ASP  33           HA       ASP  33  -7.901   4.952  11.750
  271    HB2  ASP  33           2HB      ASP  33  -8.791   2.917  12.861
  272    HB3  ASP  33           1HB      ASP  33  -7.170   2.520  13.419
  273    H    LYS  34           H        LYS  34  -6.874   5.979  13.548
  274    HA   LYS  34           HA       LYS  34  -4.285   6.914  12.957
  275    HB2  LYS  34           2HB      LYS  34  -5.769   7.215  15.582
  276    HB3  LYS  34           1HB      LYS  34  -4.389   8.140  15.067
  277    HG2  LYS  34           2HG      LYS  34  -6.185   9.578  14.746
  278    HG3  LYS  34           1HG      LYS  34  -5.823   8.960  13.143
  279    HD2  LYS  34           2HD      LYS  34  -8.212   9.062  13.405
  280    HD3  LYS  34           1HD      LYS  34  -7.766   7.370  13.384
  281    HE2  LYS  34           2HE      LYS  34  -8.195   8.902  15.963
  282    HE3  LYS  34           1HE      LYS  34  -9.526   8.158  15.100
  283    HZ1  LYS  34           3HZ      LYS  34  -8.582   6.017  15.435
  284    HZ2  LYS  34           1HZ      LYS  34  -8.677   6.741  16.919
  285    HZ3  LYS  34           2HZ      LYS  34  -7.187   6.553  16.131
  286    H    SER  35           H        SER  35  -5.410   4.271  15.010
  287    HA   SER  35           HA       SER  35  -3.032   4.287  16.651
  288    HB2  SER  35           2HB      SER  35  -5.268   3.663  17.591
  289    HB3  SER  35           1HB      SER  35  -5.322   2.289  16.491
  290    HG   SER  35           HG       SER  35  -3.117   2.570  18.207
  291    H    THR  36           H        THR  36  -4.461   2.686  13.916
  292    HA   THR  36           HA       THR  36  -2.722   0.607  13.566
  293    HB   THR  36           HB       THR  36  -3.984   2.172  11.355
  294    HG1  THR  36           HG1      THR  36  -5.432   0.569  13.246
  295   HG21  THR  36          3HG2      THR  36  -2.891   0.009  11.056
  296   HG22  THR  36          1HG2      THR  36  -4.650  -0.025  10.718
  297   HG23  THR  36          2HG2      THR  36  -4.037  -0.615  12.282
  298    H    VAL  37           H        VAL  37  -2.840   3.972  12.253
  299    HA   VAL  37           HA       VAL  37  -0.440   3.956  10.894
  300    HB   VAL  37           HB       VAL  37  -1.890   6.238  12.240
  301   HG11  VAL  37          1HG1      VAL  37  -0.680   7.660  10.696
  302   HG12  VAL  37          2HG1      VAL  37   0.241   6.269  10.108
  303   HG13  VAL  37          3HG1      VAL  37   0.427   6.819  11.778
  304   HG21  VAL  37          3HG2      VAL  37  -3.234   5.071  10.604
  305   HG22  VAL  37          1HG2      VAL  37  -1.933   5.203   9.421
  306   HG23  VAL  37          2HG2      VAL  37  -2.751   6.655   9.992
  307    H    ASN  38           H        ASN  38  -1.099   4.699  14.298
  308    HA   ASN  38           HA       ASN  38   1.471   5.527  15.006
  309    HB2  ASN  38           2HB      ASN  38  -0.712   4.195  16.583
  310    HB3  ASN  38           1HB      ASN  38   0.868   4.424  17.307
  311   HD21  ASN  38          2HD2      ASN  38  -0.799   7.962  16.264
  312   HD22  ASN  38          1HD2      ASN  38  -0.545   6.732  15.066
  313    H    ARG  39           H        ARG  39   0.133   2.278  14.797
  314    HA   ARG  39           HA       ARG  39   2.365   0.859  15.682
  315    HB2  ARG  39           2HB      ARG  39   0.492  -0.490  15.440
  316    HB3  ARG  39           1HB      ARG  39   0.016   0.269  13.923
  317    HG2  ARG  39           2HG      ARG  39   2.003  -0.790  12.891
  318    HG3  ARG  39           1HG      ARG  39   2.198  -1.739  14.366
  319    HD2  ARG  39           2HD      ARG  39   0.358  -3.027  13.922
  320    HD3  ARG  39           1HD      ARG  39  -0.454  -1.744  13.016
  321    HE   ARG  39           HE       ARG  39   1.448  -2.183  11.339
  322   HH11  ARG  39          1HH1      ARG  39   0.095  -4.906  13.248
  323   HH12  ARG  39          2HH1      ARG  39   0.276  -5.944  11.879
  324   HH21  ARG  39          2HH2      ARG  39   0.951  -5.296   9.945
  325   HH22  ARG  39          1HH2      ARG  39   1.466  -3.677   9.598
  326    H    HIS  40           H        HIS  40   1.406   1.907  12.429
  327    HA   HIS  40           HA       HIS  40   3.412   0.617  10.983
  328    HB2  HIS  40           2HB      HIS  40   1.894   3.127  10.349
  329    HB3  HIS  40           1HB      HIS  40   2.851   2.211   9.179
  330    HD1  HIS  40           HD1      HIS  40   1.742  -0.650   9.834
  331    HD2  HIS  40           HD2      HIS  40  -0.629   2.736   9.476
  332    HE1  HIS  40           HE1      HIS  40  -0.605  -1.466   9.448
  333    H    LEU  41           H        LEU  41   3.291   3.794  12.415
  334    HA   LEU  41           HA       LEU  41   5.701   4.636  11.148
  335    HB2  LEU  41           2HB      LEU  41   5.544   6.594  12.592
  336    HB3  LEU  41           1HB      LEU  41   4.137   6.377  11.555
  337    HG   LEU  41           HG       LEU  41   3.174   5.297  13.778
  338   HD11  LEU  41          1HD1      LEU  41   5.176   5.400  15.067
  339   HD12  LEU  41          2HD1      LEU  41   3.920   6.404  15.796
  340   HD13  LEU  41          3HD1      LEU  41   5.246   7.156  14.897
  341   HD21  LEU  41          3HD2      LEU  41   3.426   8.254  13.318
  342   HD22  LEU  41          1HD2      LEU  41   2.259   7.469  14.400
  343   HD23  LEU  41          2HD2      LEU  41   2.209   7.143  12.666
  344    H    TYR  42           H        TYR  42   4.865   3.161  14.190
  345    HA   TYR  42           HA       TYR  42   7.189   3.787  15.502
  346    HB2  TYR  42           2HB      TYR  42   4.844   2.167  15.727
  347    HB3  TYR  42           1HB      TYR  42   6.183   1.496  16.567
  348    HD1  TYR  42           HD1      TYR  42   3.448   2.657  17.477
  349    HD2  TYR  42           HD2      TYR  42   7.340   4.285  17.379
  350    HE1  TYR  42           HE1      TYR  42   2.820   4.220  19.302
  351    HE2  TYR  42           HE2      TYR  42   6.757   5.860  19.186
  352    HH   TYR  42           HH       TYR  42   4.674   6.902  20.119
  353    H    ASN  43           H        ASN  43   6.010   1.161  13.578
  354    HA   ASN  43           HA       ASN  43   8.140  -0.658  13.992
  355    HB2  ASN  43           2HB      ASN  43   6.242  -0.408  11.652
  356    HB3  ASN  43           1HB      ASN  43   7.344  -1.757  11.899
  357   HD21  ASN  43          2HD2      ASN  43   3.919  -2.322  13.299
  358   HD22  ASN  43          1HD2      ASN  43   4.368  -1.648  11.781
  359    H    LEU  44           H        LEU  44   7.459   1.658  11.453
  360    HA   LEU  44           HA       LEU  44   9.828   0.994  10.043
  361    HB2  LEU  44           2HB      LEU  44   8.130   3.454   9.740
  362    HB3  LEU  44           1HB      LEU  44   9.317   2.868   8.615
  363    HG   LEU  44           HG       LEU  44   6.747   1.459   9.295
  364   HD11  LEU  44          1HD1      LEU  44   6.140   1.968   6.978
  365   HD12  LEU  44          2HD1      LEU  44   7.641   2.877   6.794
  366   HD13  LEU  44          3HD1      LEU  44   6.409   3.431   7.928
  367   HD21  LEU  44          3HD2      LEU  44   8.455  -0.186   8.822
  368   HD22  LEU  44          1HD2      LEU  44   8.966   0.714   7.390
  369   HD23  LEU  44          2HD2      LEU  44   7.387  -0.050   7.423
  370    H    GLN  45           H        GLN  45   9.043   3.363  12.509
  371    HA   GLN  45           HA       GLN  45  11.295   4.996  12.190
  372    HB2  GLN  45           2HB      GLN  45   9.407   5.583  13.602
  373    HB3  GLN  45           1HB      GLN  45   9.871   4.342  14.748
  374    HG2  GLN  45           2HG      GLN  45  11.798   5.433  15.420
  375    HG3  GLN  45           1HG      GLN  45  11.849   6.440  13.977
  376   HE21  GLN  45          2HE2      GLN  45   9.866   8.918  15.237
  377   HE22  GLN  45          1HE2      GLN  45  10.650   8.222  13.879
  378    H    ARG  46           H        ARG  46  10.768   1.970  13.772
  379    HA   ARG  46           HA       ARG  46  13.135   1.796  15.349
  380    HB2  ARG  46           2HB      ARG  46  11.752  -0.549  14.025
  381    HB3  ARG  46           1HB      ARG  46  12.896  -0.643  15.339
  382    HG2  ARG  46           2HG      ARG  46  10.061   0.360  15.409
  383    HG3  ARG  46           1HG      ARG  46  10.726  -1.065  16.200
  384    HD2  ARG  46           2HD      ARG  46  10.742   0.318  18.000
  385    HD3  ARG  46           1HD      ARG  46  12.274   0.829  17.278
  386    HE   ARG  46           HE       ARG  46  10.016   2.226  16.275
  387   HH11  ARG  46          1HH1      ARG  46  12.475   2.227  18.828
  388   HH12  ARG  46          2HH1      ARG  46  12.263   3.858  19.267
  389   HH21  ARG  46          2HH2      ARG  46  10.618   5.206  18.093
  390   HH22  ARG  46          1HH2      ARG  46   9.686   4.494  16.902
  391    H    SER  47           H        SER  47  12.491   1.124  12.037
  392    HA   SER  47           HA       SER  47  15.156   0.034  11.650
  393    HB2  SER  47           2HB      SER  47  12.827   0.176   9.746
  394    HB3  SER  47           1HB      SER  47  14.313  -0.754   9.536
  395    HG   SER  47           HG       SER  47  13.566  -1.609  11.752
  396    H    ASN  48           H        ASN  48  14.020   3.200  11.758
  397    HA   ASN  48           HA       ASN  48  14.473   5.077  10.780
  398    HB2  ASN  48           2HB      ASN  48  16.843   3.489   9.852
  399    HB3  ASN  48           1HB      ASN  48  16.701   5.205   9.459
  400   HD21  ASN  48          2HD2      ASN  48  17.812   3.955  13.134
  401   HD22  ASN  48          1HD2      ASN  48  17.301   2.845  11.904
  402    H    GLN  49           H        GLN  49  12.706   3.255   9.479
  403    HA   GLN  49           HA       GLN  49  13.180   3.730   6.647
  404    HB2  GLN  49           2HB      GLN  49  12.508   1.449   7.168
  405    HB3  GLN  49           1HB      GLN  49  11.169   2.005   8.149
  406    HG2  GLN  49           2HG      GLN  49  10.428   1.094   6.000
  407    HG3  GLN  49           1HG      GLN  49  10.011   2.799   6.156
  408   HE21  GLN  49          2HE2      GLN  49  12.011   3.865   3.514
  409   HE22  GLN  49          1HE2      GLN  49  11.155   4.270   4.961
  410    H    VAL  50           H        VAL  50  11.529   4.790   9.390
  411    HA   VAL  50           HA       VAL  50  10.679   7.045   7.925
  412    HB   VAL  50           HB       VAL  50   8.803   5.223   7.986
  413   HG11  VAL  50          1HG1      VAL  50   7.336   5.344   9.989
  414   HG12  VAL  50          2HG1      VAL  50   8.384   6.605  10.635
  415   HG13  VAL  50          3HG1      VAL  50   9.028   4.985  10.473
  416   HG21  VAL  50          3HG2      VAL  50   8.476   7.418   7.059
  417   HG22  VAL  50          1HG2      VAL  50   8.289   8.114   8.668
  418   HG23  VAL  50          2HG2      VAL  50   7.071   7.003   8.041
  419    H    PHE  51           H        PHE  51  10.418   8.567   9.245
  420    HA   PHE  51           HA       PHE  51  10.373   8.564  12.023
  421    HB2  PHE  51           2HB      PHE  51  12.692   9.754  12.372
  422    HB3  PHE  51           1HB      PHE  51  12.653   8.004  12.177
  423    HD1  PHE  51           HD1      PHE  51  13.269  11.125  10.207
  424    HD2  PHE  51           HD2      PHE  51  13.910   6.967  10.691
  425    HE1  PHE  51           HE1      PHE  51  14.941  11.172   8.387
  426    HE2  PHE  51           HE2      PHE  51  15.539   6.952   8.930
  427    HZ   PHE  51           HZ       PHE  51  16.092   9.084   7.727
  428    H    ASN  52           H        ASN  52  10.664  10.928  12.877
  429    HA   ASN  52           HA       ASN  52   9.368  12.522  10.843
  430    HB2  ASN  52           2HB      ASN  52   8.659  13.955  12.758
  431    HB3  ASN  52           1HB      ASN  52   7.878  12.405  12.513
  432   HD21  ASN  52          2HD2      ASN  52   8.930  13.182  16.105
  433   HD22  ASN  52          1HD2      ASN  52   8.211  14.166  14.860
  434    H    SER  53           H        SER  53  10.156  14.168  10.033
  435    HA   SER  53           HA       SER  53  12.278  15.709  11.307
  436    HB2  SER  53           2HB      SER  53  13.291  13.488  10.638
  437    HB3  SER  53           1HB      SER  53  12.997  14.003   8.972
  438    HG   SER  53           HG       SER  53  15.020  14.689  10.655
  439    H    ASN  54           H        ASN  54  13.602  16.382   8.955
  440    HA   ASN  54           HA       ASN  54  13.855  17.620   7.113
  441    HB2  ASN  54           2HB      ASN  54  13.098  15.639   6.052
  442    HB3  ASN  54           1HB      ASN  54  11.417  16.075   6.287
  443   HD21  ASN  54          2HD2      ASN  54  11.252  18.019   3.385
  444   HD22  ASN  54          1HD2      ASN  54  10.401  17.453   4.758
  445    H    GLU  55           H        GLU  55  10.869  18.378   8.690
  446    HA   GLU  55           HA       GLU  55  10.997  20.939   7.433
  447    HB2  GLU  55           2HB      GLU  55   8.498  20.697   6.722
  448    HB3  GLU  55           1HB      GLU  55   9.761  20.040   5.694
  449    HG2  GLU  55           2HG      GLU  55   9.376  17.842   6.852
  450    HG3  GLU  55           1HG      GLU  55   7.892  18.520   7.522
  451    H    LYS  56           H        LYS  56   8.932  22.229   8.124
  452    HA   LYS  56           HA       LYS  56   9.312  22.589  10.880
  453    HB2  LYS  56           2HB      LYS  56   7.231  23.825   9.068
  454    HB3  LYS  56           1HB      LYS  56   7.337  24.207  10.779
  455    HG2  LYS  56           2HG      LYS  56   9.640  25.002  10.440
  456    HG3  LYS  56           1HG      LYS  56   9.492  24.649   8.718
  457    HD2  LYS  56           2HD      LYS  56   7.711  26.270   8.492
  458    HD3  LYS  56           1HD      LYS  56   7.694  26.546  10.232
  459    HE2  LYS  56           2HE      LYS  56   8.865  28.353   9.089
  460    HE3  LYS  56           1HE      LYS  56   9.975  27.446  10.108
  461    HZ1  LYS  56           3HZ      LYS  56  10.772  26.283   8.140
  462    HZ2  LYS  56           1HZ      LYS  56  10.949  27.956   7.968
  463    HZ3  LYS  56           2HZ      LYS  56   9.700  27.161   7.161
  464    HA   PRO  57           HA       PRO  57   5.513  20.126  11.876
  465    HB2  PRO  57           2HB      PRO  57   4.421  18.776   9.561
  466    HB3  PRO  57           1HB      PRO  57   3.603  19.983  10.568
  467    HG2  PRO  57           2HG      PRO  57   4.286  20.405   7.963
  468    HG3  PRO  57           1HG      PRO  57   4.067  21.692   9.165
  469    HD2  PRO  57           2HD      PRO  57   6.597  20.475   8.163
  470    HD3  PRO  57           1HD      PRO  57   6.227  22.169   8.549
  471    HA   PRO  58           HA       PRO  58   8.885  17.031  11.612
  472    HB2  PRO  58           2HB      PRO  58   7.503  15.364  13.485
  473    HB3  PRO  58           1HB      PRO  58   8.860  16.458  13.840
  474    HG2  PRO  58           2HG      PRO  58   5.984  16.829  14.261
  475    HG3  PRO  58           1HG      PRO  58   7.358  17.587  15.084
  476    HD2  PRO  58           2HD      PRO  58   5.795  18.918  13.373
  477    HD3  PRO  58           1HD      PRO  58   7.524  19.281  13.549
  478    H    VAL  59           H        VAL  59   8.804  15.896   9.723
  479    HA   VAL  59           HA       VAL  59   6.253  14.726   9.006
  480    HB   VAL  59           HB       VAL  59   7.496  16.179   7.447
  481   HG11  VAL  59          1HG1      VAL  59   9.290  15.268   6.058
  482   HG12  VAL  59          2HG1      VAL  59   9.392  13.884   7.141
  483   HG13  VAL  59          3HG1      VAL  59   9.766  15.499   7.744
  484   HG21  VAL  59          3HG2      VAL  59   6.834  13.396   6.549
  485   HG22  VAL  59          1HG2      VAL  59   7.089  14.738   5.457
  486   HG23  VAL  59          2HG2      VAL  59   5.737  14.782   6.594
  487    H    TRP  60           H        TRP  60   5.767  12.736   9.148
  488    HA   TRP  60           HA       TRP  60   7.900  10.858   9.474
  489    HB2  TRP  60           2HB      TRP  60   4.900  10.418   9.248
  490    HB3  TRP  60           1HB      TRP  60   6.087   9.171   9.642
  491    HD1  TRP  60           HD1      TRP  60   4.727  12.404  11.002
  492    HE1  TRP  60           HE1      TRP  60   4.910  12.394  13.615
  493    HE3  TRP  60           HE3      TRP  60   7.248   8.073  11.542
  494    HZ2  TRP  60           HZ2      TRP  60   6.029  10.709  15.593
  495    HZ3  TRP  60           HZ3      TRP  60   7.871   7.309  13.794
  496    HH2  TRP  60           HH2      TRP  60   7.275   8.601  15.777
  497    H    ASP  61           H        ASP  61   8.955  10.755   7.876
  498    HA   ASP  61           HA       ASP  61   7.928  10.159   5.236
  499    HB2  ASP  61           2HB      ASP  61   8.206  12.720   5.520
  500    HB3  ASP  61           1HB      ASP  61   9.911  12.385   5.704
  501    H    LEU  62           H        LEU  62   9.855  10.059   3.998
  502    HA   LEU  62           HA       LEU  62  12.096   8.825   5.382
  503    HB2  LEU  62           2HB      LEU  62  11.923   6.756   4.010
  504    HB3  LEU  62           1HB      LEU  62  10.604   7.169   5.112
  505    HG   LEU  62           HG       LEU  62   9.157   7.811   3.274
  506   HD11  LEU  62          1HD1      LEU  62  10.750   8.592   1.667
  507   HD12  LEU  62          2HD1      LEU  62   9.748   7.318   0.960
  508   HD13  LEU  62          3HD1      LEU  62  11.394   6.965   1.475
  509   HD21  LEU  62          3HD2      LEU  62  10.352   5.092   2.854
  510   HD22  LEU  62          1HD2      LEU  62   8.759   5.619   2.321
  511   HD23  LEU  62          2HD2      LEU  62   9.129   5.505   4.049
  512    H    MET  63           H        MET  63  13.431   7.804   3.053
  513    HA   MET  63           HA       MET  63  13.768  10.242   1.454
  514    HB2  MET  63           2HB      MET  63  15.684   9.832   3.037
  515    HB3  MET  63           1HB      MET  63  15.890   8.266   2.259
  516    HG2  MET  63           2HG      MET  63  17.534   9.872   1.448
  517    HG3  MET  63           1HG      MET  63  16.466   9.325   0.161
  518    HE1  MET  63           3HE      MET  63  16.069  13.477   2.180
  519    HE2  MET  63           1HE      MET  63  17.246  12.264   2.679
  520    HE3  MET  63           2HE      MET  63  15.522  11.989   2.948
  521    H    GLU  64           H        GLU  64  14.867   6.873   1.454
  522    HA   GLU  64           HA       GLU  64  14.868   6.502  -1.310
  523    HB2  GLU  64           2HB      GLU  64  14.825   4.595   1.007
  524    HB3  GLU  64           1HB      GLU  64  15.141   4.079  -0.651
  525    HG2  GLU  64           2HG      GLU  64  17.213   4.189   0.560
  526    HG3  GLU  64           1HG      GLU  64  17.195   5.539  -0.568
  Start of MODEL    3
    1    HA   MET   1           HA       MET   1  16.050 -10.602   7.302
    2    HB2  MET   1           2HB      MET   1  17.542  -9.446   5.654
    3    HB3  MET   1           1HB      MET   1  16.463  -9.941   4.362
    4    HG2  MET   1           2HG      MET   1  14.685  -8.558   5.292
    5    HG3  MET   1           1HG      MET   1  15.726  -8.105   6.637
    6    HE1  MET   1           2HE      MET   1  16.444  -6.808   2.251
    7    HE2  MET   1           3HE      MET   1  15.050  -7.751   2.775
    8    HE3  MET   1           1HE      MET   1  16.659  -8.476   2.778
    9    H    SER   2           H        SER   2  13.799 -10.229   7.343
   10    HA   SER   2           HA       SER   2  12.278 -11.920   5.511
   11    HB2  SER   2           2HB      SER   2  11.564 -10.967   8.295
   12    HB3  SER   2           1HB      SER   2  10.723 -12.189   7.334
   13    HG   SER   2           HG       SER   2  11.987 -13.412   8.563
   14    H    ALA   3           H        ALA   3  10.262 -10.953   4.758
   15    HA   ALA   3           HA       ALA   3  10.496  -8.089   4.563
   16    HB1  ALA   3           1HB      ALA   3   8.754  -8.228   2.859
   17    HB2  ALA   3           2HB      ALA   3   8.518  -9.938   3.218
   18    HB3  ALA   3           3HB      ALA   3  10.039  -9.386   2.517
   19    H    GLU   4           H        GLU   4  10.088  -7.758   6.757
   20    HA   GLU   4           HA       GLU   4   7.347  -8.052   7.671
   21    HB2  GLU   4           2HB      GLU   4   9.064  -8.624   9.277
   22    HB3  GLU   4           1HB      GLU   4   9.935  -7.147   8.961
   23    HG2  GLU   4           2HG      GLU   4   7.207  -7.050  10.230
   24    HG3  GLU   4           1HG      GLU   4   8.626  -7.441  11.196
   25    H    THR   5           H        THR   5   9.743  -5.469   7.656
   26    HA   THR   5           HA       THR   5   8.291  -3.240   8.096
   27    HB   THR   5           HB       THR   5  10.723  -3.289   6.392
   28    HG1  THR   5           HG1      THR   5  10.499  -4.381   9.049
   29   HG21  THR   5          3HG2      THR   5   9.961  -1.915   8.982
   30   HG22  THR   5          1HG2      THR   5  10.022  -1.189   7.375
   31   HG23  THR   5          2HG2      THR   5  11.511  -1.725   8.159
   32    H    GLN   6           H        GLN   6   7.861  -5.054   5.406
   33    HA   GLN   6           HA       GLN   6   8.127  -3.128   3.273
   34    HB2  GLN   6           2HB      GLN   6   8.445  -5.594   2.942
   35    HB3  GLN   6           1HB      GLN   6   6.714  -5.792   3.183
   36    HG2  GLN   6           2HG      GLN   6   6.429  -4.132   1.264
   37    HG3  GLN   6           1HG      GLN   6   8.134  -4.405   0.934
   38   HE21  GLN   6          2HE2      GLN   6   7.652  -7.566  -0.466
   39   HE22  GLN   6          1HE2      GLN   6   8.783  -6.442   0.185
   40    H    MET   7           H        MET   7   5.543  -4.332   5.350
   41    HA   MET   7           HA       MET   7   3.437  -3.492   3.558
   42    HB2  MET   7           2HB      MET   7   3.304  -4.311   6.462
   43    HB3  MET   7           1HB      MET   7   1.917  -4.092   5.406
   44    HG2  MET   7           2HG      MET   7   2.687  -5.939   4.009
   45    HG3  MET   7           1HG      MET   7   4.085  -6.150   5.058
   46    HE1  MET   7           3HE      MET   7   2.820  -5.678   7.968
   47    HE2  MET   7           1HE      MET   7   3.960  -6.963   7.558
   48    HE3  MET   7           2HE      MET   7   2.460  -7.348   8.396
   49    H    GLU   8           H        GLU   8   4.719  -2.493   6.551
   50    HA   GLU   8           HA       GLU   8   3.257  -0.260   7.165
   51    HB2  GLU   8           2HB      GLU   8   6.179  -0.896   7.595
   52    HB3  GLU   8           1HB      GLU   8   5.308   0.378   8.426
   53    HG2  GLU   8           2HG      GLU   8   5.723  -1.642   9.794
   54    HG3  GLU   8           1HG      GLU   8   4.018  -1.258   9.644
   55    H    ARG   9           H        ARG   9   6.189  -0.655   5.251
   56    HA   ARG   9           HA       ARG   9   6.419   2.141   4.798
   57    HB2  ARG   9           2HB      ARG   9   8.404   0.643   4.770
   58    HB3  ARG   9           1HB      ARG   9   7.799  -0.121   3.315
   59    HG2  ARG   9           2HG      ARG   9   8.435   2.822   3.412
   60    HG3  ARG   9           1HG      ARG   9   9.669   1.611   3.075
   61    HD2  ARG   9           2HD      ARG   9   8.424   0.860   1.111
   62    HD3  ARG   9           1HD      ARG   9   7.109   1.939   1.606
   63    HE   ARG   9           HE       ARG   9   8.083   3.548   0.405
   64   HH11  ARG   9          1HH1      ARG   9  10.853   1.559   1.504
   65   HH12  ARG   9          2HH1      ARG   9  11.959   2.566   0.685
   66   HH21  ARG   9          2HH2      ARG   9  11.176   4.344  -0.762
   67   HH22  ARG   9          1HH2      ARG   9   9.500   4.628  -0.729
   68    H    LYS  10           H        LYS  10   4.877  -0.453   3.055
   69    HA   LYS  10           HA       LYS  10   4.573   0.991   0.631
   70    HB2  LYS  10           2HB      LYS  10   3.066  -1.398   1.671
   71    HB3  LYS  10           1HB      LYS  10   2.720  -0.674   0.107
   72    HG2  LYS  10           2HG      LYS  10   5.012  -1.128  -0.616
   73    HG3  LYS  10           1HG      LYS  10   5.371  -1.827   0.959
   74    HD2  LYS  10           2HD      LYS  10   3.346  -2.883  -1.031
   75    HD3  LYS  10           1HD      LYS  10   4.940  -3.566  -0.723
   76    HE2  LYS  10           2HE      LYS  10   4.236  -3.937   1.652
   77    HE3  LYS  10           1HE      LYS  10   2.610  -3.428   1.197
   78    HZ1  LYS  10           3HZ      LYS  10   2.750  -5.813   1.155
   79    HZ2  LYS  10           1HZ      LYS  10   4.116  -5.758   0.167
   80    HZ3  LYS  10           2HZ      LYS  10   2.617  -5.276  -0.451
   81    H    ILE  11           H        ILE  11   2.585   0.924   3.569
   82    HA   ILE  11           HA       ILE  11   0.433   2.190   2.208
   83    HB   ILE  11           HB       ILE  11  -0.522   2.497   4.441
   84   HG12  ILE  11          2HG1      ILE  11   2.108   1.330   5.353
   85   HG13  ILE  11          1HG1      ILE  11   1.384   2.858   5.823
   86   HG21  ILE  11          1HG2      ILE  11  -0.787   0.074   4.925
   87   HG22  ILE  11          2HG2      ILE  11   0.616  -0.214   3.884
   88   HG23  ILE  11          3HG2      ILE  11  -0.878   0.427   3.185
   89   HD11  ILE  11          3HD1      ILE  11   1.268   1.235   7.594
   90   HD12  ILE  11          1HD1      ILE  11   0.455   0.129   6.486
   91   HD13  ILE  11          2HD1      ILE  11  -0.371   1.615   7.007
   92    H    ILE  12           H        ILE  12   3.117   3.228   4.261
   93    HA   ILE  12           HA       ILE  12   2.145   5.869   4.272
   94    HB   ILE  12           HB       ILE  12   3.994   6.547   5.453
   95   HG12  ILE  12          2HG1      ILE  12   6.149   4.727   5.164
   96   HG13  ILE  12          1HG1      ILE  12   5.404   4.861   3.618
   97   HG21  ILE  12          1HG2      ILE  12   2.923   4.876   6.765
   98   HG22  ILE  12          2HG2      ILE  12   4.662   4.841   7.063
   99   HG23  ILE  12          3HG2      ILE  12   3.918   3.614   6.040
  100   HD11  ILE  12          3HD1      ILE  12   5.511   7.297   3.560
  101   HD12  ILE  12          1HD1      ILE  12   7.129   6.626   3.777
  102   HD13  ILE  12          2HD1      ILE  12   6.252   7.333   5.136
  103    H    ASP  13           H        ASP  13   4.157   4.001   2.084
  104    HA   ASP  13           HA       ASP  13   5.269   6.245   0.784
  105    HB2  ASP  13           2HB      ASP  13   6.057   3.765   0.654
  106    HB3  ASP  13           1HB      ASP  13   4.891   3.637  -0.663
  107    H    PHE  14           H        PHE  14   2.342   4.401   0.390
  108    HA   PHE  14           HA       PHE  14   1.360   5.417  -1.969
  109    HB2  PHE  14           2HB      PHE  14   0.178   3.650  -0.901
  110    HB3  PHE  14           1HB      PHE  14   0.063   4.534   0.609
  111    HD1  PHE  14           HD1      PHE  14  -1.771   5.809   1.085
  112    HD2  PHE  14           HD2      PHE  14  -1.165   4.471  -2.878
  113    HE1  PHE  14           HE1      PHE  14  -4.041   6.605   0.504
  114    HE2  PHE  14           HE2      PHE  14  -3.432   5.255  -3.505
  115    HZ   PHE  14           HZ       PHE  14  -4.870   6.325  -1.807
  116    H    LEU  15           H        LEU  15   0.718   6.668   1.355
  117    HA   LEU  15           HA       LEU  15  -0.195   9.021   0.017
  118    HB2  LEU  15           2HB      LEU  15  -0.999   9.993   2.031
  119    HB3  LEU  15           1HB      LEU  15  -1.397   8.299   2.040
  120    HG   LEU  15           HG       LEU  15  -0.923   8.917   4.232
  121   HD11  LEU  15          1HD1      LEU  15   1.440   7.491   3.170
  122   HD12  LEU  15          2HD1      LEU  15  -0.083   6.795   3.727
  123   HD13  LEU  15          3HD1      LEU  15   1.004   7.597   4.872
  124   HD21  LEU  15          3HD2      LEU  15   1.203   9.953   4.991
  125   HD22  LEU  15          1HD2      LEU  15   0.246  10.998   3.934
  126   HD23  LEU  15          2HD2      LEU  15   1.651  10.149   3.300
  127    H    ARG  16           H        ARG  16   2.796   8.070   0.922
  128    HA   ARG  16           HA       ARG  16   4.132  10.464   1.446
  129    HB2  ARG  16           2HB      ARG  16   5.324   8.408   1.623
  130    HB3  ARG  16           1HB      ARG  16   4.866   7.963  -0.019
  131    HG2  ARG  16           2HG      ARG  16   6.218   9.683  -0.898
  132    HG3  ARG  16           1HG      ARG  16   6.693  10.184   0.723
  133    HD2  ARG  16           2HD      ARG  16   7.663   7.894   1.054
  134    HD3  ARG  16           1HD      ARG  16   7.233   7.508  -0.605
  135    HE   ARG  16           HE       ARG  16   8.950   9.803  -0.174
  136   HH11  ARG  16          1HH1      ARG  16   8.740   6.384  -1.243
  137   HH12  ARG  16          2HH1      ARG  16  10.382   6.367  -1.777
  138   HH21  ARG  16          2HH2      ARG  16  11.750   8.174  -1.672
  139   HH22  ARG  16          1HH2      ARG  16  11.226   9.652  -1.017
  140    H    GLN  17           H        GLN  17   3.524   8.773  -1.533
  141    HA   GLN  17           HA       GLN  17   4.501  10.749  -3.296
  142    HB2  GLN  17           2HB      GLN  17   2.399   8.672  -3.940
  143    HB3  GLN  17           1HB      GLN  17   3.433   9.506  -5.082
  144    HG2  GLN  17           2HG      GLN  17   4.255   7.430  -3.056
  145    HG3  GLN  17           1HG      GLN  17   4.194   7.244  -4.802
  146   HE21  GLN  17          2HE2      GLN  17   7.670   7.839  -3.540
  147   HE22  GLN  17          1HE2      GLN  17   6.407   6.776  -3.032
  148    H    ASN  18           H        ASN  18   1.403  10.221  -1.796
  149    HA   ASN  18           HA       ASN  18   0.032  12.218  -3.369
  150    HB2  ASN  18           2HB      ASN  18  -0.787  11.174  -0.636
  151    HB3  ASN  18           1HB      ASN  18  -1.821  11.974  -1.809
  152   HD21  ASN  18          2HD2      ASN  18  -1.168   8.820  -3.849
  153   HD22  ASN  18          1HD2      ASN  18  -0.507  10.415  -4.009
  154    H    GLY  19           H        GLY  19   1.599  12.046  -0.308
  155    HA2  GLY  19           2HA      GLY  19   2.848  14.347  -0.053
  156    HA3  GLY  19           1HA      GLY  19   1.186  14.851   0.245
  157    H    LYS  20           H        LYS  20   3.793  12.636   1.456
  158    HA   LYS  20           HA       LYS  20   2.998  11.693   3.745
  159    HB2  LYS  20           2HB      LYS  20   5.329  12.437   4.630
  160    HB3  LYS  20           1HB      LYS  20   5.195  11.297   3.308
  161    HG2  LYS  20           2HG      LYS  20   6.977  12.942   2.922
  162    HG3  LYS  20           1HG      LYS  20   5.726  13.041   1.696
  163    HD2  LYS  20           2HD      LYS  20   4.896  15.071   2.586
  164    HD3  LYS  20           1HD      LYS  20   5.807  14.902   4.079
  165    HE2  LYS  20           2HE      LYS  20   7.058  15.231   1.348
  166    HE3  LYS  20           1HE      LYS  20   6.740  16.569   2.449
  167    HZ1  LYS  20           3HZ      LYS  20   8.247  15.765   3.982
  168    HZ2  LYS  20           1HZ      LYS  20   9.050  15.684   2.533
  169    HZ3  LYS  20           2HZ      LYS  20   8.487  14.246   3.214
  170    H    SER  21           H        SER  21   3.131  12.308   6.073
  171    HA   SER  21           HA       SER  21   2.776  14.996   6.837
  172    HB2  SER  21           2HB      SER  21   0.802  14.789   5.293
  173    HB3  SER  21           1HB      SER  21   0.200  13.467   6.283
  174    HG   SER  21           HG       SER  21   0.113  16.164   6.652
  175    H    ILE  22           H        ILE  22   0.695  14.441   8.671
  176    HA   ILE  22           HA       ILE  22   2.175  12.881  10.612
  177    HB   ILE  22           HB       ILE  22   0.432  13.570  12.239
  178   HG12  ILE  22          2HG1      ILE  22  -0.728  15.135   9.908
  179   HG13  ILE  22          1HG1      ILE  22  -1.466  13.721  10.646
  180   HG21  ILE  22          1HG2      ILE  22   1.024  15.960  12.278
  181   HG22  ILE  22          2HG2      ILE  22   1.649  15.817  10.635
  182   HG23  ILE  22          3HG2      ILE  22   2.420  14.931  11.950
  183   HD11  ILE  22          3HD1      ILE  22  -2.522  15.776  11.400
  184   HD12  ILE  22          1HD1      ILE  22  -0.972  16.367  11.997
  185   HD13  ILE  22          2HD1      ILE  22  -1.723  14.955  12.741
  186    H    ALA  23           H        ALA  23   0.964  11.372  12.035
  187    HA   ALA  23           HA       ALA  23   0.133   9.121  10.638
  188    HB1  ALA  23           1HB      ALA  23  -0.388   9.815  13.503
  189    HB2  ALA  23           2HB      ALA  23   1.111   9.115  12.882
  190    HB3  ALA  23           3HB      ALA  23  -0.395   8.191  12.814
  191    H    LEU  24           H        LEU  24  -1.723  11.807  11.744
  192    HA   LEU  24           HA       LEU  24  -4.250  10.465  11.922
  193    HB2  LEU  24           2HB      LEU  24  -3.620  12.589  13.151
  194    HB3  LEU  24           1HB      LEU  24  -3.662  13.431  11.627
  195    HG   LEU  24           HG       LEU  24  -5.631  13.842  13.106
  196   HD11  LEU  24          1HD1      LEU  24  -7.375  13.631  11.418
  197   HD12  LEU  24          2HD1      LEU  24  -6.324  12.584  10.466
  198   HD13  LEU  24          3HD1      LEU  24  -5.875  14.266  10.744
  199   HD21  LEU  24          3HD2      LEU  24  -6.306  10.963  12.519
  200   HD22  LEU  24          1HD2      LEU  24  -7.358  12.127  13.323
  201   HD23  LEU  24          2HD2      LEU  24  -5.846  11.630  14.086
  202    H    THR  25           H        THR  25  -2.424  12.212   9.521
  203    HA   THR  25           HA       THR  25  -4.466  12.365   7.577
  204    HB   THR  25           HB       THR  25  -1.475  12.378   7.254
  205    HG1  THR  25           HG1      THR  25  -1.523  14.424   7.848
  206   HG21  THR  25          3HG2      THR  25  -2.857  12.029   5.223
  207   HG22  THR  25          1HG2      THR  25  -1.936  13.546   5.154
  208   HG23  THR  25          2HG2      THR  25  -3.663  13.554   5.534
  209    H    ILE  26           H        ILE  26  -1.630  10.244   8.012
  210    HA   ILE  26           HA       ILE  26  -1.957   8.593   5.868
  211    HB   ILE  26           HB       ILE  26  -1.265   7.493   8.615
  212   HG12  ILE  26          2HG1      ILE  26   0.527   8.802   6.525
  213   HG13  ILE  26          1HG1      ILE  26   0.111   9.512   8.073
  214   HG21  ILE  26          1HG2      ILE  26  -0.613   6.633   5.820
  215   HG22  ILE  26          2HG2      ILE  26  -1.760   5.885   6.912
  216   HG23  ILE  26          3HG2      ILE  26  -0.022   5.838   7.296
  217   HD11  ILE  26          3HD1      ILE  26   2.354   8.590   8.094
  218   HD12  ILE  26          1HD1      ILE  26   1.723   7.004   7.649
  219   HD13  ILE  26          2HD1      ILE  26   1.312   7.708   9.212
  220    H    ALA  27           H        ALA  27  -3.617   8.361   8.949
  221    HA   ALA  27           HA       ALA  27  -5.023   6.024   8.558
  222    HB1  ALA  27           1HB      ALA  27  -6.525   6.810  10.287
  223    HB2  ALA  27           2HB      ALA  27  -5.934   8.460  10.070
  224    HB3  ALA  27           3HB      ALA  27  -4.852   7.211  10.688
  225    H    LYS  28           H        LYS  28  -5.881   9.323   7.480
  226    HA   LYS  28           HA       LYS  28  -8.464   8.376   6.676
  227    HB2  LYS  28           2HB      LYS  28  -8.752  10.527   5.636
  228    HB3  LYS  28           1HB      LYS  28  -8.344  10.662   7.384
  229    HG2  LYS  28           2HG      LYS  28  -6.102  11.362   6.631
  230    HG3  LYS  28           1HG      LYS  28  -6.652  11.249   4.960
  231    HD2  LYS  28           2HD      LYS  28  -8.416  12.935   5.485
  232    HD3  LYS  28           1HD      LYS  28  -7.714  13.110   7.092
  233    HE2  LYS  28           2HE      LYS  28  -6.896  14.888   5.696
  234    HE3  LYS  28           1HE      LYS  28  -5.572  13.778   6.028
  235    HZ1  LYS  28           3HZ      LYS  28  -6.075  12.746   3.790
  236    HZ2  LYS  28           1HZ      LYS  28  -5.482  14.291   3.684
  237    HZ3  LYS  28           2HZ      LYS  28  -7.122  13.966   3.474
  238    H    GLU  29           H        GLU  29  -5.561   9.139   5.198
  239    HA   GLU  29           HA       GLU  29  -6.320   9.025   2.454
  240    HB2  GLU  29           2HB      GLU  29  -3.567   8.197   3.358
  241    HB3  GLU  29           1HB      GLU  29  -4.025   8.923   1.831
  242    HG2  GLU  29           2HG      GLU  29  -3.931  10.241   4.527
  243    HG3  GLU  29           1HG      GLU  29  -2.832  10.501   3.196
  244    H    ILE  30           H        ILE  30  -5.053   6.508   4.571
  245    HA   ILE  30           HA       ILE  30  -5.409   4.593   2.404
  246    HB   ILE  30           HB       ILE  30  -4.426   2.897   3.906
  247   HG12  ILE  30          2HG1      ILE  30  -4.041   5.216   5.810
  248   HG13  ILE  30          1HG1      ILE  30  -5.087   3.834   6.083
  249   HG21  ILE  30          1HG2      ILE  30  -2.990   4.100   2.368
  250   HG22  ILE  30          2HG2      ILE  30  -2.120   3.812   3.877
  251   HG23  ILE  30          3HG2      ILE  30  -2.788   5.407   3.535
  252   HD11  ILE  30          3HD1      ILE  30  -3.061   3.592   7.361
  253   HD12  ILE  30          1HD1      ILE  30  -2.078   3.823   5.912
  254   HD13  ILE  30          2HD1      ILE  30  -3.076   2.386   6.072
  255    H    GLY  31           H        GLY  31  -7.292   5.904   4.698
  256    HA2  GLY  31           2HA      GLY  31  -9.404   5.435   5.424
  257    HA3  GLY  31           1HA      GLY  31  -9.424   4.106   4.275
  258    H    LEU  32           H        LEU  32  -7.028   4.338   6.767
  259    HA   LEU  32           HA       LEU  32  -8.294   1.990   8.003
  260    HB2  LEU  32           2HB      LEU  32  -5.329   2.580   8.039
  261    HB3  LEU  32           1HB      LEU  32  -6.116   1.165   8.689
  262    HG   LEU  32           HG       LEU  32  -5.589   1.873   5.825
  263   HD11  LEU  32          1HD1      LEU  32  -4.972  -0.576   7.434
  264   HD12  LEU  32          2HD1      LEU  32  -3.846   0.705   7.009
  265   HD13  LEU  32          3HD1      LEU  32  -4.549  -0.306   5.744
  266   HD21  LEU  32          3HD2      LEU  32  -7.872   1.209   5.859
  267   HD22  LEU  32          1HD2      LEU  32  -7.505  -0.253   6.793
  268   HD23  LEU  32          2HD2      LEU  32  -6.894  -0.066   5.135
  269    H    ASP  33           H        ASP  33  -7.116   1.699  10.284
  270    HA   ASP  33           HA       ASP  33  -8.139   3.900  11.772
  271    HB2  ASP  33           2HB      ASP  33  -8.718   1.843  12.716
  272    HB3  ASP  33           1HB      ASP  33  -7.086   1.202  12.550
  273    H    LYS  34           H        LYS  34  -7.114   4.919  13.433
  274    HA   LYS  34           HA       LYS  34  -4.741   6.276  12.646
  275    HB2  LYS  34           2HB      LYS  34  -5.204   7.698  14.520
  276    HB3  LYS  34           1HB      LYS  34  -6.738   7.287  13.770
  277    HG2  LYS  34           2HG      LYS  34  -6.766   5.378  15.582
  278    HG3  LYS  34           1HG      LYS  34  -5.624   6.427  16.410
  279    HD2  LYS  34           2HD      LYS  34  -7.700   7.036  17.287
  280    HD3  LYS  34           1HD      LYS  34  -7.391   8.268  16.060
  281    HE2  LYS  34           2HE      LYS  34  -9.688   7.498  15.889
  282    HE3  LYS  34           1HE      LYS  34  -8.787   6.989  14.464
  283    HZ1  LYS  34           3HZ      LYS  34  -9.396   5.238  16.808
  284    HZ2  LYS  34           1HZ      LYS  34  -8.605   4.730  15.419
  285    HZ3  LYS  34           2HZ      LYS  34 -10.195   5.179  15.325
  286    H    SER  35           H        SER  35  -5.402   3.702  15.045
  287    HA   SER  35           HA       SER  35  -2.872   4.152  16.362
  288    HB2  SER  35           2HB      SER  35  -5.011   2.037  16.782
  289    HB3  SER  35           1HB      SER  35  -3.660   2.382  17.868
  290    HG   SER  35           HG       SER  35  -5.217   3.548  18.738
  291    H    THR  36           H        THR  36  -4.488   2.177  14.053
  292    HA   THR  36           HA       THR  36  -2.730   0.180  13.684
  293    HB   THR  36           HB       THR  36  -4.717   1.706  12.060
  294    HG1  THR  36           HG1      THR  36  -5.641   0.600  13.743
  295   HG21  THR  36          3HG2      THR  36  -3.365  -0.873  11.444
  296   HG22  THR  36          1HG2      THR  36  -3.171   0.693  10.626
  297   HG23  THR  36          2HG2      THR  36  -4.751  -0.145  10.560
  298    H    VAL  37           H        VAL  37  -2.958   3.476  12.082
  299    HA   VAL  37           HA       VAL  37  -0.710   3.261  10.485
  300    HB   VAL  37           HB       VAL  37  -1.940   5.566  11.929
  301   HG11  VAL  37          1HG1      VAL  37  -0.010   5.659   9.599
  302   HG12  VAL  37          2HG1      VAL  37   0.367   6.021  11.282
  303   HG13  VAL  37          3HG1      VAL  37  -0.757   7.049  10.412
  304   HG21  VAL  37          3HG2      VAL  37  -2.970   6.079   9.745
  305   HG22  VAL  37          1HG2      VAL  37  -3.459   4.509  10.385
  306   HG23  VAL  37          2HG2      VAL  37  -2.254   4.603   9.100
  307    H    ASN  38           H        ASN  38  -1.068   4.525  13.760
  308    HA   ASN  38           HA       ASN  38   1.543   5.309  14.158
  309    HB2  ASN  38           2HB      ASN  38  -0.608   4.523  16.077
  310    HB3  ASN  38           1HB      ASN  38   1.022   4.792  16.675
  311   HD21  ASN  38          2HD2      ASN  38  -1.277   7.915  15.582
  312   HD22  ASN  38          1HD2      ASN  38  -1.801   6.300  15.246
  313    H    ARG  39           H        ARG  39   0.134   2.159  14.823
  314    HA   ARG  39           HA       ARG  39   2.480   1.125  16.065
  315    HB2  ARG  39           2HB      ARG  39   1.522  -1.084  15.882
  316    HB3  ARG  39           1HB      ARG  39   0.218   0.047  16.257
  317    HG2  ARG  39           2HG      ARG  39  -0.397   0.049  13.881
  318    HG3  ARG  39           1HG      ARG  39   0.867  -1.129  13.575
  319    HD2  ARG  39           2HD      ARG  39  -0.284  -2.697  15.090
  320    HD3  ARG  39           1HD      ARG  39  -1.578  -1.506  15.292
  321    HE   ARG  39           HE       ARG  39  -0.873  -2.323  12.592
  322   HH11  ARG  39          1HH1      ARG  39  -3.250  -2.486  15.210
  323   HH12  ARG  39          2HH1      ARG  39  -4.497  -3.095  14.233
  324   HH21  ARG  39          2HH2      ARG  39  -4.071  -3.533  11.895
  325   HH22  ARG  39          1HH2      ARG  39  -2.528  -3.169  11.265
  326    H    HIS  40           H        HIS  40   1.421   1.231  12.750
  327    HA   HIS  40           HA       HIS  40   3.473  -0.525  11.816
  328    HB2  HIS  40           2HB      HIS  40   1.523   1.257  10.405
  329    HB3  HIS  40           1HB      HIS  40   2.768   0.428   9.499
  330    HD1  HIS  40           HD1      HIS  40   2.498  -2.463   9.627
  331    HD2  HIS  40           HD2      HIS  40  -0.711  -0.156  10.995
  332    HE1  HIS  40           HE1      HIS  40   0.594  -3.984   9.814
  333    H    LEU  41           H        LEU  41   3.181   2.943  12.108
  334    HA   LEU  41           HA       LEU  41   5.582   3.381  10.635
  335    HB2  LEU  41           2HB      LEU  41   5.449   5.711  11.371
  336    HB3  LEU  41           1HB      LEU  41   3.971   5.164  10.611
  337    HG   LEU  41           HG       LEU  41   3.172   4.823  13.062
  338   HD11  LEU  41          1HD1      LEU  41   5.371   6.821  13.487
  339   HD12  LEU  41          2HD1      LEU  41   5.240   5.217  14.210
  340   HD13  LEU  41          3HD1      LEU  41   4.078   6.474  14.637
  341   HD21  LEU  41          3HD2      LEU  41   2.275   7.051  13.081
  342   HD22  LEU  41          1HD2      LEU  41   2.253   6.319  11.480
  343   HD23  LEU  41          2HD2      LEU  41   3.466   7.556  11.862
  344    H    TYR  42           H        TYR  42   4.782   2.823  14.028
  345    HA   TYR  42           HA       TYR  42   7.123   3.607  15.103
  346    HB2  TYR  42           2HB      TYR  42   4.838   2.014  15.659
  347    HB3  TYR  42           1HB      TYR  42   6.216   1.488  16.542
  348    HD1  TYR  42           HD1      TYR  42   3.454   3.438  16.602
  349    HD2  TYR  42           HD2      TYR  42   7.519   3.676  17.510
  350    HE1  TYR  42           HE1      TYR  42   2.951   5.344  18.149
  351    HE2  TYR  42           HE2      TYR  42   7.111   5.580  19.071
  352    HH   TYR  42           HH       TYR  42   3.952   6.459  20.053
  353    H    ASN  43           H        ASN  43   6.171   0.691  13.533
  354    HA   ASN  43           HA       ASN  43   8.476  -0.853  14.162
  355    HB2  ASN  43           2HB      ASN  43   6.818  -1.044  11.633
  356    HB3  ASN  43           1HB      ASN  43   7.906  -2.280  12.250
  357   HD21  ASN  43          2HD2      ASN  43   4.334  -2.890  13.128
  358   HD22  ASN  43          1HD2      ASN  43   5.135  -2.421  11.660
  359    H    LEU  44           H        LEU  44   7.679   1.036  11.278
  360    HA   LEU  44           HA       LEU  44  10.138   0.827   9.927
  361    HB2  LEU  44           2HB      LEU  44   8.421   3.304   9.958
  362    HB3  LEU  44           1HB      LEU  44   9.557   2.800   8.762
  363    HG   LEU  44           HG       LEU  44   7.045   1.245   9.292
  364   HD11  LEU  44          1HD1      LEU  44   7.623   3.315   7.167
  365   HD12  LEU  44          2HD1      LEU  44   6.499   3.511   8.511
  366   HD13  LEU  44          3HD1      LEU  44   6.179   2.309   7.263
  367   HD21  LEU  44          3HD2      LEU  44   8.749  -0.052   8.288
  368   HD22  LEU  44          1HD2      LEU  44   9.124   1.224   7.122
  369   HD23  LEU  44          2HD2      LEU  44   7.586   0.386   7.027
  370    H    GLN  45           H        GLN  45   9.044   3.010  12.421
  371    HA   GLN  45           HA       GLN  45  11.079   4.898  12.378
  372    HB2  GLN  45           2HB      GLN  45   8.925   5.123  13.470
  373    HB3  GLN  45           1HB      GLN  45   9.454   4.000  14.714
  374    HG2  GLN  45           2HG      GLN  45  11.076   5.466  15.517
  375    HG3  GLN  45           1HG      GLN  45  10.962   6.504  14.092
  376   HE21  GLN  45          2HE2      GLN  45   8.186   8.188  15.139
  377   HE22  GLN  45          1HE2      GLN  45   9.223   7.785  13.830
  378    H    ARG  46           H        ARG  46  10.745   1.775  13.942
  379    HA   ARG  46           HA       ARG  46  12.886   1.943  15.828
  380    HB2  ARG  46           2HB      ARG  46  11.871  -0.549  14.442
  381    HB3  ARG  46           1HB      ARG  46  12.884  -0.516  15.864
  382    HG2  ARG  46           2HG      ARG  46   9.998   0.312  15.645
  383    HG3  ARG  46           1HG      ARG  46  10.649  -1.091  16.486
  384    HD2  ARG  46           2HD      ARG  46  10.372   0.318  18.266
  385    HD3  ARG  46           1HD      ARG  46  12.004   0.763  17.750
  386    HE   ARG  46           HE       ARG  46   9.942   2.288  16.505
  387   HH11  ARG  46          1HH1      ARG  46  12.150   2.112  19.265
  388   HH12  ARG  46          2HH1      ARG  46  11.952   3.727  19.765
  389   HH21  ARG  46          2HH2      ARG  46  10.461   5.175  18.542
  390   HH22  ARG  46          1HH2      ARG  46   9.621   4.604  17.218
  391    H    SER  47           H        SER  47  12.647   1.125  12.521
  392    HA   SER  47           HA       SER  47  15.377   0.192  12.354
  393    HB2  SER  47           2HB      SER  47  13.617  -1.078  11.208
  394    HB3  SER  47           1HB      SER  47  13.201   0.343  10.256
  395    HG   SER  47           HG       SER  47  15.601   0.194   9.712
  396    H    ASN  48           H        ASN  48  13.999   3.287  12.375
  397    HA   ASN  48           HA       ASN  48  14.524   5.235  11.612
  398    HB2  ASN  48           2HB      ASN  48  17.141   3.837  11.165
  399    HB3  ASN  48           1HB      ASN  48  16.965   5.561  10.817
  400   HD21  ASN  48          2HD2      ASN  48  17.336   4.192  14.600
  401   HD22  ASN  48          1HD2      ASN  48  17.176   3.112  13.255
  402    H    GLN  49           H        GLN  49  13.034   3.694   9.972
  403    HA   GLN  49           HA       GLN  49  14.103   4.327   7.338
  404    HB2  GLN  49           2HB      GLN  49  13.428   1.940   7.703
  405    HB3  GLN  49           1HB      GLN  49  11.813   2.474   8.132
  406    HG2  GLN  49           2HG      GLN  49  13.009   3.049   5.434
  407    HG3  GLN  49           1HG      GLN  49  12.180   1.536   5.785
  408   HE21  GLN  49          2HE2      GLN  49   9.952   4.285   4.477
  409   HE22  GLN  49          1HE2      GLN  49  11.554   3.843   3.981
  410    H    VAL  50           H        VAL  50  11.362   4.525   9.495
  411    HA   VAL  50           HA       VAL  50  10.633   7.000   8.145
  412    HB   VAL  50           HB       VAL  50   8.951   4.875   8.288
  413   HG11  VAL  50          1HG1      VAL  50   8.278   6.491  10.739
  414   HG12  VAL  50          2HG1      VAL  50   9.093   4.955  10.749
  415   HG13  VAL  50          3HG1      VAL  50   7.396   5.059  10.162
  416   HG21  VAL  50          3HG2      VAL  50   8.438   6.900   7.085
  417   HG22  VAL  50          1HG2      VAL  50   8.089   7.740   8.595
  418   HG23  VAL  50          2HG2      VAL  50   7.050   6.417   8.062
  419    H    PHE  51           H        PHE  51  10.451   8.514   9.396
  420    HA   PHE  51           HA       PHE  51  10.097   8.634  12.163
  421    HB2  PHE  51           2HB      PHE  51  12.362   9.738  12.788
  422    HB3  PHE  51           1HB      PHE  51  12.347   7.996  12.562
  423    HD1  PHE  51           HD1      PHE  51  13.635   6.970  11.023
  424    HD2  PHE  51           HD2      PHE  51  13.341  11.183  10.959
  425    HE1  PHE  51           HE1      PHE  51  15.493   7.017   9.505
  426    HE2  PHE  51           HE2      PHE  51  15.239  11.296   9.378
  427    HZ   PHE  51           HZ       PHE  51  16.335   9.211   8.633
  428    H    ASN  52           H        ASN  52  10.960  11.131  12.852
  429    HA   ASN  52           HA       ASN  52   9.463  12.725  10.926
  430    HB2  ASN  52           2HB      ASN  52  10.624  13.612  13.513
  431    HB3  ASN  52           1HB      ASN  52   9.462  14.442  12.530
  432   HD21  ASN  52          2HD2      ASN  52   6.638  12.813  13.648
  433   HD22  ASN  52          1HD2      ASN  52   7.311  13.943  12.539
  434    H    SER  53           H        SER  53  10.393  14.226   9.753
  435    HA   SER  53           HA       SER  53  13.219  14.881  10.105
  436    HB2  SER  53           2HB      SER  53  13.069  12.516   9.244
  437    HB3  SER  53           1HB      SER  53  12.343  13.213   7.797
  438    HG   SER  53           HG       SER  53  14.580  12.866   7.524
  439    H    ASN  54           H        ASN  54  13.905  15.451   7.680
  440    HA   ASN  54           HA       ASN  54  14.081  16.775   5.879
  441    HB2  ASN  54           2HB      ASN  54  12.777  15.063   4.926
  442    HB3  ASN  54           1HB      ASN  54  11.287  15.750   5.544
  443   HD21  ASN  54          2HD2      ASN  54  10.844  17.929   2.853
  444   HD22  ASN  54          1HD2      ASN  54  10.237  17.365   4.350
  445    H    GLU  55           H        GLU  55  11.669  18.044   8.040
  446    HA   GLU  55           HA       GLU  55  11.975  20.578   6.732
  447    HB2  GLU  55           2HB      GLU  55   9.427  20.747   6.411
  448    HB3  GLU  55           1HB      GLU  55  10.349  19.791   5.258
  449    HG2  GLU  55           2HG      GLU  55   9.795  17.798   6.672
  450    HG3  GLU  55           1HG      GLU  55   8.560  18.792   7.474
  451    H    LYS  56           H        LYS  56  10.286  22.144   7.730
  452    HA   LYS  56           HA       LYS  56  11.046  22.347  10.437
  453    HB2  LYS  56           2HB      LYS  56   9.071  24.019   8.869
  454    HB3  LYS  56           1HB      LYS  56   9.458  24.330  10.553
  455    HG2  LYS  56           2HG      LYS  56  11.816  24.658   9.932
  456    HG3  LYS  56           1HG      LYS  56  11.393  24.381   8.242
  457    HD2  LYS  56           2HD      LYS  56   9.958  26.330   8.238
  458    HD3  LYS  56           1HD      LYS  56  10.218  26.567   9.965
  459    HE2  LYS  56           2HE      LYS  56  11.577  28.127   8.677
  460    HE3  LYS  56           1HE      LYS  56  12.602  26.986   9.539
  461    HZ1  LYS  56           3HZ      LYS  56  12.881  25.739   7.481
  462    HZ2  LYS  56           1HZ      LYS  56  13.369  27.347   7.285
  463    HZ3  LYS  56           2HZ      LYS  56  11.890  26.838   6.655
  464    HA   PRO  57           HA       PRO  57   6.868  20.650  11.718
  465    HB2  PRO  57           2HB      PRO  57   5.501  19.521   9.409
  466    HB3  PRO  57           1HB      PRO  57   4.893  20.776  10.506
  467    HG2  PRO  57           2HG      PRO  57   5.472  21.256   7.911
  468    HG3  PRO  57           1HG      PRO  57   5.583  22.485   9.189
  469    HD2  PRO  57           2HD      PRO  57   7.767  20.884   7.937
  470    HD3  PRO  57           1HD      PRO  57   7.735  22.604   8.382
  471    HA   PRO  58           HA       PRO  58   9.627  17.069  11.251
  472    HB2  PRO  58           2HB      PRO  58   7.942  16.085  13.516
  473    HB3  PRO  58           1HB      PRO  58   9.712  16.207  13.407
  474    HG2  PRO  58           2HG      PRO  58   8.375  17.903  14.894
  475    HG3  PRO  58           1HG      PRO  58   9.764  18.427  13.922
  476    HD2  PRO  58           2HD      PRO  58   6.863  18.849  13.416
  477    HD3  PRO  58           1HD      PRO  58   8.244  19.926  13.114
  478    H    VAL  59           H        VAL  59   9.056  15.983   9.411
  479    HA   VAL  59           HA       VAL  59   6.310  15.185   8.978
  480    HB   VAL  59           HB       VAL  59   7.724  16.222   7.224
  481   HG11  VAL  59          1HG1      VAL  59   9.305  14.818   5.975
  482   HG12  VAL  59          2HG1      VAL  59   9.228  13.644   7.298
  483   HG13  VAL  59          3HG1      VAL  59   9.839  15.266   7.593
  484   HG21  VAL  59          3HG2      VAL  59   5.776  15.075   6.433
  485   HG22  VAL  59          1HG2      VAL  59   6.575  13.508   6.696
  486   HG23  VAL  59          2HG2      VAL  59   7.160  14.540   5.437
  487    H    TRP  60           H        TRP  60   5.412  13.253   9.005
  488    HA   TRP  60           HA       TRP  60   7.191  11.084   9.659
  489    HB2  TRP  60           2HB      TRP  60   4.172  10.994   9.258
  490    HB3  TRP  60           1HB      TRP  60   5.176   9.762  10.018
  491    HD1  TRP  60           HD1      TRP  60   4.171  13.377  10.610
  492    HE1  TRP  60           HE1      TRP  60   3.893  13.799  13.169
  493    HE3  TRP  60           HE3      TRP  60   5.654   8.832  12.304
  494    HZ2  TRP  60           HZ2      TRP  60   4.280  12.356  15.554
  495    HZ3  TRP  60           HZ3      TRP  60   5.693   8.427  14.741
  496    HH2  TRP  60           HH2      TRP  60   5.024  10.148  16.318
  497    H    ASP  61           H        ASP  61   8.242  10.713   8.050
  498    HA   ASP  61           HA       ASP  61   7.237   9.913   5.501
  499    HB2  ASP  61           2HB      ASP  61   7.485  12.452   5.358
  500    HB3  ASP  61           1HB      ASP  61   9.174  12.252   5.789
  501    H    LEU  62           H        LEU  62   9.617   9.871   4.418
  502    HA   LEU  62           HA       LEU  62  11.096   8.226   6.348
  503    HB2  LEU  62           2HB      LEU  62  11.171   6.401   4.654
  504    HB3  LEU  62           1HB      LEU  62   9.637   6.908   5.368
  505    HG   LEU  62           HG       LEU  62   8.840   7.882   3.338
  506   HD11  LEU  62          1HD1      LEU  62  10.833   8.934   2.526
  507   HD12  LEU  62          2HD1      LEU  62  10.123   7.929   1.259
  508   HD13  LEU  62          3HD1      LEU  62  11.540   7.368   2.154
  509   HD21  LEU  62          3HD2      LEU  62  10.177   5.305   2.582
  510   HD22  LEU  62          1HD2      LEU  62   8.767   6.015   1.813
  511   HD23  LEU  62          2HD2      LEU  62   8.672   5.418   3.477
  512    H    MET  63           H        MET  63  12.921   7.084   4.472
  513    HA   MET  63           HA       MET  63  14.529   9.413   3.790
  514    HB2  MET  63           2HB      MET  63  15.481   7.882   5.557
  515    HB3  MET  63           1HB      MET  63  15.329   6.551   4.426
  516    HG2  MET  63           2HG      MET  63  17.614   7.300   4.491
  517    HG3  MET  63           1HG      MET  63  16.914   7.659   2.916
  518    HE1  MET  63           3HE      MET  63  16.323   9.681   6.283
  519    HE2  MET  63           1HE      MET  63  17.640  10.846   6.190
  520    HE3  MET  63           2HE      MET  63  17.996   9.131   6.399
  521    H    GLU  64           H        GLU  64  13.584   6.015   3.126
  522    HA   GLU  64           HA       GLU  64  12.500   6.264   0.741
  523    HB2  GLU  64           2HB      GLU  64  14.887   6.912   0.200
  524    HB3  GLU  64           1HB      GLU  64  15.323   5.258   0.603
  525    HG2  GLU  64           2HG      GLU  64  15.036   5.628  -1.897
  526    HG3  GLU  64           1HG      GLU  64  13.992   4.373  -1.233
  Start of MODEL    4
    1    HA   MET   1           HA       MET   1  11.044 -11.856   1.851
    2    HB2  MET   1           2HB      MET   1   9.936  -9.039   2.092
    3    HB3  MET   1           1HB      MET   1  11.357  -9.482   1.161
    4    HG2  MET   1           2HG      MET   1   8.526 -10.362   0.652
    5    HG3  MET   1           1HG      MET   1   9.460  -9.208  -0.297
    6    HE1  MET   1           2HE      MET   1  11.471  -9.851  -1.882
    7    HE2  MET   1           3HE      MET   1  12.161 -11.470  -1.987
    8    HE3  MET   1           1HE      MET   1  12.334 -10.531  -0.504
    9    H    SER   2           H        SER   2  12.936  -9.972   2.332
   10    HA   SER   2           HA       SER   2  13.661 -10.471   5.017
   11    HB2  SER   2           2HB      SER   2  14.900  -8.593   2.990
   12    HB3  SER   2           1HB      SER   2  15.690  -9.327   4.390
   13    HG   SER   2           HG       SER   2  16.254 -10.738   2.905
   14    H    ALA   3           H        ALA   3  12.237  -9.504   6.346
   15    HA   ALA   3           HA       ALA   3  11.335  -7.961   7.684
   16    HB1  ALA   3           1HB      ALA   3  12.092  -5.634   7.733
   17    HB2  ALA   3           2HB      ALA   3  12.922  -5.851   6.192
   18    HB3  ALA   3           3HB      ALA   3  13.482  -6.716   7.623
   19    H    GLU   4           H        GLU   4   9.297  -7.653   7.555
   20    HA   GLU   4           HA       GLU   4   8.049  -7.243   5.057
   21    HB2  GLU   4           2HB      GLU   4   7.014  -7.642   7.794
   22    HB3  GLU   4           1HB      GLU   4   5.928  -7.267   6.453
   23    HG2  GLU   4           2HG      GLU   4   7.735  -9.660   6.750
   24    HG3  GLU   4           1HG      GLU   4   5.970  -9.646   6.668
   25    H    THR   5           H        THR   5   9.527  -5.046   6.473
   26    HA   THR   5           HA       THR   5   7.813  -2.883   6.999
   27    HB   THR   5           HB       THR   5  10.200  -2.778   7.598
   28    HG1  THR   5           HG1      THR   5   8.835  -0.860   6.409
   29   HG21  THR   5          3HG2      THR   5  10.713  -2.568   4.622
   30   HG22  THR   5          1HG2      THR   5  11.156  -3.929   5.653
   31   HG23  THR   5          2HG2      THR   5  11.927  -2.358   5.882
   32    H    GLN   6           H        GLN   6   8.503  -4.435   4.126
   33    HA   GLN   6           HA       GLN   6   7.984  -2.511   2.170
   34    HB2  GLN   6           2HB      GLN   6   7.226  -4.501   0.801
   35    HB3  GLN   6           1HB      GLN   6   8.863  -4.558   1.452
   36    HG2  GLN   6           2HG      GLN   6   8.296  -6.185   3.045
   37    HG3  GLN   6           1HG      GLN   6   6.569  -5.895   2.853
   38   HE21  GLN   6          2HE2      GLN   6   6.715  -8.856   0.986
   39   HE22  GLN   6          1HE2      GLN   6   6.363  -8.213   2.541
   40    H    MET   7           H        MET   7   5.869  -4.053   4.456
   41    HA   MET   7           HA       MET   7   3.458  -3.670   2.973
   42    HB2  MET   7           2HB      MET   7   3.864  -4.059   5.950
   43    HB3  MET   7           1HB      MET   7   2.305  -4.072   5.143
   44    HG2  MET   7           2HG      MET   7   4.546  -6.043   4.762
   45    HG3  MET   7           1HG      MET   7   3.021  -6.328   5.598
   46    HE1  MET   7           3HE      MET   7   4.055  -8.306   3.408
   47    HE2  MET   7           1HE      MET   7   2.597  -8.577   2.454
   48    HE3  MET   7           2HE      MET   7   2.495  -8.483   4.211
   49    H    GLU   8           H        GLU   8   4.941  -2.078   5.671
   50    HA   GLU   8           HA       GLU   8   3.244   0.101   5.856
   51    HB2  GLU   8           2HB      GLU   8   6.181  -0.057   6.538
   52    HB3  GLU   8           1HB      GLU   8   5.084   1.240   6.987
   53    HG2  GLU   8           2HG      GLU   8   5.390  -0.163   8.902
   54    HG3  GLU   8           1HG      GLU   8   3.761  -0.392   8.273
   55    H    ARG   9           H        ARG   9   6.112  -0.455   3.944
   56    HA   ARG   9           HA       ARG   9   6.314   2.187   2.963
   57    HB2  ARG   9           2HB      ARG   9   7.260  -0.380   1.706
   58    HB3  ARG   9           1HB      ARG   9   7.547   1.198   0.992
   59    HG2  ARG   9           2HG      ARG   9   8.512   0.256   3.678
   60    HG3  ARG   9           1HG      ARG   9   9.485   0.451   2.219
   61    HD2  ARG   9           2HD      ARG   9   8.072   2.646   3.747
   62    HD3  ARG   9           1HD      ARG   9   9.796   2.341   3.697
   63    HE   ARG   9           HE       ARG   9   8.224   3.243   1.359
   64   HH11  ARG   9          1HH1      ARG   9  11.330   3.179   3.174
   65   HH12  ARG   9          2HH1      ARG   9  12.017   4.315   2.086
   66   HH21  ARG   9          2HH2      ARG   9  10.875   5.214   0.348
   67   HH22  ARG   9          1HH2      ARG   9   9.237   4.752   0.033
   68    H    LYS  10           H        LYS  10   4.401  -0.492   1.847
   69    HA   LYS  10           HA       LYS  10   3.569   0.815  -0.519
   70    HB2  LYS  10           2HB      LYS  10   2.223  -1.329   1.110
   71    HB3  LYS  10           1HB      LYS  10   1.573  -0.728  -0.402
   72    HG2  LYS  10           2HG      LYS  10   3.570  -1.512  -1.582
   73    HG3  LYS  10           1HG      LYS  10   4.234  -2.104  -0.057
   74    HD2  LYS  10           2HD      LYS  10   1.571  -3.012  -1.143
   75    HD3  LYS  10           1HD      LYS  10   3.082  -3.831  -1.523
   76    HE2  LYS  10           2HE      LYS  10   2.207  -3.354   1.329
   77    HE3  LYS  10           1HE      LYS  10   1.705  -4.794   0.426
   78    HZ1  LYS  10           3HZ      LYS  10   4.451  -3.916   1.101
   79    HZ2  LYS  10           1HZ      LYS  10   4.098  -5.275   0.137
   80    HZ3  LYS  10           2HZ      LYS  10   3.601  -5.233   1.748
   81    H    ILE  11           H        ILE  11   2.229   0.854   2.800
   82    HA   ILE  11           HA       ILE  11  -0.032   2.302   1.855
   83    HB   ILE  11           HB       ILE  11  -0.629   2.524   4.189
   84   HG12  ILE  11          2HG1      ILE  11   2.027   1.183   4.646
   85   HG13  ILE  11          1HG1      ILE  11   1.452   2.697   5.318
   86   HG21  ILE  11          1HG2      ILE  11   0.270  -0.193   3.310
   87   HG22  ILE  11          2HG2      ILE  11  -1.286   0.551   2.899
   88   HG23  ILE  11          3HG2      ILE  11  -0.939   0.057   4.574
   89   HD11  ILE  11          3HD1      ILE  11   0.488  -0.035   5.938
   90   HD12  ILE  11          1HD1      ILE  11  -0.178   1.437   6.668
   91   HD13  ILE  11          2HD1      ILE  11   1.511   0.971   6.979
   92    H    ILE  12           H        ILE  12   2.962   3.120   3.511
   93    HA   ILE  12           HA       ILE  12   2.051   5.791   3.756
   94    HB   ILE  12           HB       ILE  12   3.978   6.384   4.823
   95   HG12  ILE  12          2HG1      ILE  12   5.988   4.463   4.600
   96   HG13  ILE  12          1HG1      ILE  12   5.297   4.579   2.998
   97   HG21  ILE  12          1HG2      ILE  12   2.833   4.840   6.203
   98   HG22  ILE  12          2HG2      ILE  12   4.571   4.673   6.458
   99   HG23  ILE  12          3HG2      ILE  12   3.706   3.485   5.486
  100   HD11  ILE  12          3HD1      ILE  12   7.124   6.210   3.119
  101   HD12  ILE  12          1HD1      ILE  12   6.355   6.983   4.510
  102   HD13  ILE  12          2HD1      ILE  12   5.573   7.041   2.961
  103    H    ASP  13           H        ASP  13   3.805   3.988   1.237
  104    HA   ASP  13           HA       ASP  13   4.863   6.430   0.233
  105    HB2  ASP  13           2HB      ASP  13   5.329   3.716  -0.383
  106    HB3  ASP  13           1HB      ASP  13   4.771   4.478  -1.871
  107    H    PHE  14           H        PHE  14   2.000   4.568  -0.289
  108    HA   PHE  14           HA       PHE  14   0.891   5.926  -2.434
  109    HB2  PHE  14           2HB      PHE  14  -0.190   3.977  -1.542
  110    HB3  PHE  14           1HB      PHE  14  -0.270   4.679   0.064
  111    HD1  PHE  14           HD1      PHE  14  -1.644   4.892  -3.346
  112    HD2  PHE  14           HD2      PHE  14  -2.062   5.951   0.721
  113    HE1  PHE  14           HE1      PHE  14  -3.947   5.679  -3.807
  114    HE2  PHE  14           HE2      PHE  14  -4.369   6.750   0.307
  115    HZ   PHE  14           HZ       PHE  14  -5.311   6.610  -1.973
  116    H    LEU  15           H        LEU  15   0.544   6.570   1.088
  117    HA   LEU  15           HA       LEU  15  -0.714   9.002   0.813
  118    HB2  LEU  15           2HB      LEU  15  -1.130   8.292   2.767
  119    HB3  LEU  15           1HB      LEU  15   0.217   7.187   2.842
  120    HG   LEU  15           HG       LEU  15   0.083   8.554   4.727
  121   HD11  LEU  15          1HD1      LEU  15   2.314   9.621   4.877
  122   HD12  LEU  15          2HD1      LEU  15   2.489   9.357   3.141
  123   HD13  LEU  15          3HD1      LEU  15   2.312   7.981   4.227
  124   HD21  LEU  15          3HD2      LEU  15   0.252  10.948   2.949
  125   HD22  LEU  15          1HD2      LEU  15   0.452  11.036   4.703
  126   HD23  LEU  15          2HD2      LEU  15  -1.081  10.488   4.024
  127    H    ARG  16           H        ARG  16   2.587   8.125   0.783
  128    HA   ARG  16           HA       ARG  16   3.749  10.590   1.330
  129    HB2  ARG  16           2HB      ARG  16   4.896   8.452   1.345
  130    HB3  ARG  16           1HB      ARG  16   4.731   8.367  -0.406
  131    HG2  ARG  16           2HG      ARG  16   6.204   9.966  -0.798
  132    HG3  ARG  16           1HG      ARG  16   5.895  10.740   0.762
  133    HD2  ARG  16           2HD      ARG  16   7.973   9.780   1.170
  134    HD3  ARG  16           1HD      ARG  16   6.826   8.515   1.646
  135    HE   ARG  16           HE       ARG  16   7.251   7.661  -0.742
  136   HH11  ARG  16          1HH1      ARG  16   9.652   8.999   1.542
  137   HH12  ARG  16          2HH1      ARG  16  10.945   8.173   0.775
  138   HH21  ARG  16          2HH2      ARG  16  10.582   6.799  -1.032
  139   HH22  ARG  16          1HH2      ARG  16   8.972   6.602  -1.682
  140    H    GLN  17           H        GLN  17   2.907   9.027  -1.537
  141    HA   GLN  17           HA       GLN  17   3.604  11.085  -3.379
  142    HB2  GLN  17           2HB      GLN  17   1.415   9.026  -3.774
  143    HB3  GLN  17           1HB      GLN  17   2.111  10.024  -5.031
  144    HG2  GLN  17           2HG      GLN  17   3.392   7.745  -3.542
  145    HG3  GLN  17           1HG      GLN  17   3.018   7.845  -5.257
  146   HE21  GLN  17          2HE2      GLN  17   6.500   9.189  -3.810
  147   HE22  GLN  17          1HE2      GLN  17   5.276   8.489  -2.808
  148    H    ASN  18           H        ASN  18   0.771  10.558  -1.387
  149    HA   ASN  18           HA       ASN  18  -0.756  12.665  -2.639
  150    HB2  ASN  18           2HB      ASN  18  -1.166  11.478   0.131
  151    HB3  ASN  18           1HB      ASN  18  -2.356  12.333  -0.839
  152   HD21  ASN  18          2HD2      ASN  18  -2.097   9.253  -3.086
  153   HD22  ASN  18          1HD2      ASN  18  -1.456  10.853  -3.284
  154    H    GLY  19           H        GLY  19   1.258  12.204   0.127
  155    HA2  GLY  19           2HA      GLY  19   2.666  14.396   0.339
  156    HA3  GLY  19           1HA      GLY  19   1.116  14.969   0.948
  157    H    LYS  20           H        LYS  20   3.736  12.544   1.524
  158    HA   LYS  20           HA       LYS  20   3.176  11.450   3.846
  159    HB2  LYS  20           2HB      LYS  20   5.657  12.017   4.444
  160    HB3  LYS  20           1HB      LYS  20   5.255  10.894   3.160
  161    HG2  LYS  20           2HG      LYS  20   7.085  12.388   2.524
  162    HG3  LYS  20           1HG      LYS  20   5.681  12.610   1.489
  163    HD2  LYS  20           2HD      LYS  20   5.181  14.696   2.457
  164    HD3  LYS  20           1HD      LYS  20   6.254  14.443   3.824
  165    HE2  LYS  20           2HE      LYS  20   7.140  14.694   0.946
  166    HE3  LYS  20           1HE      LYS  20   7.155  16.010   2.118
  167    HZ1  LYS  20           3HZ      LYS  20   8.781  15.012   3.358
  168    HZ2  LYS  20           1HZ      LYS  20   9.333  14.830   1.814
  169    HZ3  LYS  20           2HZ      LYS  20   8.699  13.480   2.622
  170    H    SER  21           H        SER  21   3.607  11.891   6.150
  171    HA   SER  21           HA       SER  21   3.468  14.439   7.239
  172    HB2  SER  21           2HB      SER  21   0.888  13.383   6.125
  173    HB3  SER  21           1HB      SER  21   0.834  14.385   7.553
  174    HG   SER  21           HG       SER  21   2.170  15.135   5.180
  175    H    ILE  22           H        ILE  22   1.448  14.025   9.187
  176    HA   ILE  22           HA       ILE  22   2.787  12.123  10.844
  177    HB   ILE  22           HB       ILE  22   1.212  12.859  12.595
  178   HG12  ILE  22          2HG1      ILE  22   0.082  14.686  10.448
  179   HG13  ILE  22          1HG1      ILE  22  -0.743  13.287  11.122
  180   HG21  ILE  22          1HG2      ILE  22   2.542  15.100  11.075
  181   HG22  ILE  22          2HG2      ILE  22   3.298  14.063  12.286
  182   HG23  ILE  22          3HG2      ILE  22   2.016  15.181  12.757
  183   HD11  ILE  22          3HD1      ILE  22   0.048  15.774  12.628
  184   HD12  ILE  22          1HD1      ILE  22  -0.783  14.378  13.313
  185   HD13  ILE  22          2HD1      ILE  22  -1.576  15.360  12.080
  186    H    ALA  23           H        ALA  23   1.344  10.805  12.321
  187    HA   ALA  23           HA       ALA  23   0.386   8.593  10.988
  188    HB1  ALA  23           1HB      ALA  23   1.175   8.671  13.316
  189    HB2  ALA  23           2HB      ALA  23  -0.348   7.802  13.126
  190    HB3  ALA  23           3HB      ALA  23  -0.342   9.442  13.776
  191    H    LEU  24           H        LEU  24  -1.382  11.423  12.062
  192    HA   LEU  24           HA       LEU  24  -3.965  10.237  11.946
  193    HB2  LEU  24           2HB      LEU  24  -3.343  12.226  13.350
  194    HB3  LEU  24           1HB      LEU  24  -3.166  13.165  11.894
  195    HG   LEU  24           HG       LEU  24  -5.254  13.607  13.219
  196   HD11  LEU  24          1HD1      LEU  24  -5.725  12.658  10.405
  197   HD12  LEU  24          2HD1      LEU  24  -5.192  14.265  10.896
  198   HD13  LEU  24          3HD1      LEU  24  -6.802  13.698  11.339
  199   HD21  LEU  24          3HD2      LEU  24  -6.059  10.863  12.267
  200   HD22  LEU  24          1HD2      LEU  24  -7.110  12.023  13.075
  201   HD23  LEU  24          2HD2      LEU  24  -5.734  11.331  13.935
  202    H    THR  25           H        THR  25  -1.866  11.960   9.707
  203    HA   THR  25           HA       THR  25  -3.834  12.437   7.769
  204    HB   THR  25           HB       THR  25  -0.882  12.130   7.364
  205    HG1  THR  25           HG1      THR  25  -2.479  14.195   8.455
  206   HG21  THR  25          3HG2      THR  25  -3.020  13.753   5.966
  207   HG22  THR  25          1HG2      THR  25  -2.409  12.190   5.450
  208   HG23  THR  25          2HG2      THR  25  -1.320  13.594   5.454
  209    H    ILE  26           H        ILE  26  -1.222  10.060   8.068
  210    HA   ILE  26           HA       ILE  26  -1.617   8.601   5.789
  211    HB   ILE  26           HB       ILE  26  -0.992   7.188   8.415
  212   HG12  ILE  26          2HG1      ILE  26   0.904   8.716   6.560
  213   HG13  ILE  26          1HG1      ILE  26   0.451   9.226   8.175
  214   HG21  ILE  26          1HG2      ILE  26  -0.300   6.695   5.538
  215   HG22  ILE  26          2HG2      ILE  26  -1.448   5.802   6.531
  216   HG23  ILE  26          3HG2      ILE  26   0.287   5.723   6.903
  217   HD11  ILE  26          3HD1      ILE  26   1.572   7.269   9.105
  218   HD12  ILE  26          1HD1      ILE  26   2.666   8.251   8.132
  219   HD13  ILE  26          2HD1      ILE  26   2.010   6.751   7.477
  220    H    ALA  27           H        ALA  27  -3.222   8.138   8.877
  221    HA   ALA  27           HA       ALA  27  -4.833   5.976   8.220
  222    HB1  ALA  27           1HB      ALA  27  -4.473   6.819  10.466
  223    HB2  ALA  27           2HB      ALA  27  -6.195   6.648  10.107
  224    HB3  ALA  27           3HB      ALA  27  -5.438   8.248  10.098
  225    H    LYS  28           H        LYS  28  -5.434   9.514   7.761
  226    HA   LYS  28           HA       LYS  28  -8.048   9.280   6.896
  227    HB2  LYS  28           2HB      LYS  28  -6.272  11.205   7.666
  228    HB3  LYS  28           1HB      LYS  28  -6.382  11.476   5.941
  229    HG2  LYS  28           2HG      LYS  28  -8.599  11.277   7.832
  230    HG3  LYS  28           1HG      LYS  28  -7.892  12.814   7.329
  231    HD2  LYS  28           2HD      LYS  28  -9.294  10.832   5.466
  232    HD3  LYS  28           1HD      LYS  28 -10.075  12.257   6.131
  233    HE2  LYS  28           2HE      LYS  28  -9.461  12.801   3.881
  234    HE3  LYS  28           1HE      LYS  28  -8.323  13.644   4.915
  235    HZ1  LYS  28           3HZ      LYS  28  -7.276  12.508   2.919
  236    HZ2  LYS  28           1HZ      LYS  28  -7.686  11.040   3.590
  237    HZ3  LYS  28           2HZ      LYS  28  -6.594  12.105   4.313
  238    H    GLU  29           H        GLU  29  -4.921   9.113   5.285
  239    HA   GLU  29           HA       GLU  29  -6.094   9.532   2.698
  240    HB2  GLU  29           2HB      GLU  29  -3.302   8.537   3.234
  241    HB3  GLU  29           1HB      GLU  29  -3.894   9.351   1.796
  242    HG2  GLU  29           2HG      GLU  29  -3.215  10.462   4.478
  243    HG3  GLU  29           1HG      GLU  29  -2.658  10.972   2.892
  244    H    ILE  30           H        ILE  30  -5.006   6.852   4.601
  245    HA   ILE  30           HA       ILE  30  -5.492   5.090   2.320
  246    HB   ILE  30           HB       ILE  30  -4.582   3.240   3.673
  247   HG12  ILE  30          2HG1      ILE  30  -4.053   5.383   5.745
  248   HG13  ILE  30          1HG1      ILE  30  -5.162   4.038   5.930
  249   HG21  ILE  30          1HG2      ILE  30  -2.236   4.011   3.665
  250   HG22  ILE  30          2HG2      ILE  30  -2.805   5.669   3.470
  251   HG23  ILE  30          3HG2      ILE  30  -3.111   4.477   2.207
  252   HD11  ILE  30          3HD1      ILE  30  -2.161   3.874   5.688
  253   HD12  ILE  30          1HD1      ILE  30  -3.246   2.490   5.816
  254   HD13  ILE  30          2HD1      ILE  30  -3.115   3.633   7.152
  255    H    GLY  31           H        GLY  31  -7.146   6.267   4.934
  256    HA2  GLY  31           2HA      GLY  31  -9.324   5.933   5.570
  257    HA3  GLY  31           1HA      GLY  31  -9.457   4.708   4.315
  258    H    LEU  32           H        LEU  32  -6.991   4.563   6.736
  259    HA   LEU  32           HA       LEU  32  -8.378   2.203   7.805
  260    HB2  LEU  32           2HB      LEU  32  -5.378   2.573   7.770
  261    HB3  LEU  32           1HB      LEU  32  -6.249   1.158   8.301
  262    HG   LEU  32           HG       LEU  32  -5.759   2.125   5.506
  263   HD11  LEU  32          1HD1      LEU  32  -4.898  -0.106   5.159
  264   HD12  LEU  32          2HD1      LEU  32  -5.285  -0.516   6.827
  265   HD13  LEU  32          3HD1      LEU  32  -4.070   0.713   6.486
  266   HD21  LEU  32          3HD2      LEU  32  -7.237   0.369   4.668
  267   HD22  LEU  32          1HD2      LEU  32  -8.079   1.633   5.559
  268   HD23  LEU  32          2HD2      LEU  32  -7.798   0.057   6.326
  269    H    ASP  33           H        ASP  33  -7.327   1.596   9.990
  270    HA   ASP  33           HA       ASP  33  -8.117   3.611  11.777
  271    HB2  ASP  33           2HB      ASP  33  -8.558   1.427  12.490
  272    HB3  ASP  33           1HB      ASP  33  -6.907   0.898  12.185
  273    H    LYS  34           H        LYS  34  -7.137   4.971  12.909
  274    HA   LYS  34           HA       LYS  34  -4.592   5.994  12.369
  275    HB2  LYS  34           2HB      LYS  34  -4.911   7.528  14.229
  276    HB3  LYS  34           1HB      LYS  34  -6.397   7.383  13.309
  277    HG2  LYS  34           2HG      LYS  34  -5.955   5.786  15.831
  278    HG3  LYS  34           1HG      LYS  34  -6.547   7.441  15.888
  279    HD2  LYS  34           2HD      LYS  34  -8.531   6.830  14.655
  280    HD3  LYS  34           1HD      LYS  34  -7.891   5.224  14.324
  281    HE2  LYS  34           2HE      LYS  34  -8.454   6.231  17.106
  282    HE3  LYS  34           1HE      LYS  34  -9.627   5.341  16.139
  283    HZ1  LYS  34           3HZ      LYS  34  -8.491   3.775  17.551
  284    HZ2  LYS  34           1HZ      LYS  34  -6.956   4.281  17.028
  285    HZ3  LYS  34           2HZ      LYS  34  -7.998   3.538  15.967
  286    H    SER  35           H        SER  35  -5.460   3.511  14.703
  287    HA   SER  35           HA       SER  35  -3.079   4.063  16.260
  288    HB2  SER  35           2HB      SER  35  -5.260   1.981  16.604
  289    HB3  SER  35           1HB      SER  35  -3.961   2.300  17.757
  290    HG   SER  35           HG       SER  35  -4.865   4.091  18.359
  291    H    THR  36           H        THR  36  -4.362   1.990  13.845
  292    HA   THR  36           HA       THR  36  -2.498   0.038  13.786
  293    HB   THR  36           HB       THR  36  -4.448   1.354  11.969
  294    HG1  THR  36           HG1      THR  36  -5.406   0.205  13.502
  295   HG21  THR  36          3HG2      THR  36  -4.186  -0.466  10.432
  296   HG22  THR  36          1HG2      THR  36  -2.806  -1.076  11.399
  297   HG23  THR  36          2HG2      THR  36  -2.724   0.537  10.634
  298    H    VAL  37           H        VAL  37  -2.729   3.221  11.939
  299    HA   VAL  37           HA       VAL  37  -0.327   3.047  10.610
  300    HB   VAL  37           HB       VAL  37  -1.721   5.381  11.843
  301   HG11  VAL  37          1HG1      VAL  37   0.252   5.345   9.551
  302   HG12  VAL  37          2HG1      VAL  37   0.580   5.851  11.208
  303   HG13  VAL  37          3HG1      VAL  37  -0.549   6.776  10.232
  304   HG21  VAL  37          3HG2      VAL  37  -3.208   4.205  10.352
  305   HG22  VAL  37          1HG2      VAL  37  -1.981   4.201   9.084
  306   HG23  VAL  37          2HG2      VAL  37  -2.716   5.719   9.593
  307    H    ASN  38           H        ASN  38  -1.065   4.454  13.800
  308    HA   ASN  38           HA       ASN  38   1.461   5.333  14.499
  309    HB2  ASN  38           2HB      ASN  38  -0.869   4.446  16.141
  310    HB3  ASN  38           1HB      ASN  38   0.675   4.700  16.939
  311   HD21  ASN  38          2HD2      ASN  38  -1.521   7.843  15.694
  312   HD22  ASN  38          1HD2      ASN  38  -1.962   6.231  15.232
  313    H    ARG  39           H        ARG  39   0.076   2.117  15.038
  314    HA   ARG  39           HA       ARG  39   2.050   0.884  16.471
  315    HB2  ARG  39           2HB      ARG  39  -0.081  -0.067  16.057
  316    HB3  ARG  39           1HB      ARG  39   0.154   0.018  14.321
  317    HG2  ARG  39           2HG      ARG  39   2.071  -1.442  14.659
  318    HG3  ARG  39           1HG      ARG  39   1.459  -1.786  16.282
  319    HD2  ARG  39           2HD      ARG  39   0.172  -2.286  13.601
  320    HD3  ARG  39           1HD      ARG  39   0.563  -3.513  14.814
  321    HE   ARG  39           HE       ARG  39  -1.195  -2.264  16.177
  322   HH11  ARG  39          1HH1      ARG  39  -1.318  -2.727  12.635
  323   HH12  ARG  39          2HH1      ARG  39  -2.999  -2.529  12.529
  324   HH21  ARG  39          2HH2      ARG  39  -4.292  -2.049  14.430
  325   HH22  ARG  39          1HH2      ARG  39  -3.594  -1.980  15.977
  326    H    HIS  40           H        HIS  40   1.557   1.071  13.057
  327    HA   HIS  40           HA       HIS  40   3.805  -0.519  12.408
  328    HB2  HIS  40           2HB      HIS  40   1.955   1.138  10.760
  329    HB3  HIS  40           1HB      HIS  40   3.342   0.348  10.031
  330    HD1  HIS  40           HD1      HIS  40   3.086  -2.311   9.653
  331    HD2  HIS  40           HD2      HIS  40  -0.048  -0.565  11.789
  332    HE1  HIS  40           HE1      HIS  40   1.331  -4.066   9.893
  333    H    LEU  41           H        LEU  41   3.384   2.902  12.635
  334    HA   LEU  41           HA       LEU  41   5.964   3.413  11.458
  335    HB2  LEU  41           2HB      LEU  41   5.605   5.777  12.057
  336    HB3  LEU  41           1HB      LEU  41   4.315   5.097  11.095
  337    HG   LEU  41           HG       LEU  41   3.136   4.784  13.385
  338   HD11  LEU  41          1HD1      LEU  41   4.968   5.384  14.830
  339   HD12  LEU  41          2HD1      LEU  41   3.614   6.494  15.026
  340   HD13  LEU  41          3HD1      LEU  41   5.035   6.993  14.107
  341   HD21  LEU  41          3HD2      LEU  41   3.468   7.478  12.150
  342   HD22  LEU  41          1HD2      LEU  41   2.126   6.903  13.160
  343   HD23  LEU  41          2HD2      LEU  41   2.440   6.145  11.585
  344    H    TYR  42           H        TYR  42   4.706   2.855  14.699
  345    HA   TYR  42           HA       TYR  42   6.741   3.847  16.121
  346    HB2  TYR  42           2HB      TYR  42   4.706   1.789  16.230
  347    HB3  TYR  42           1HB      TYR  42   5.922   1.672  17.428
  348    HD1  TYR  42           HD1      TYR  42   3.173   1.880  18.137
  349    HD2  TYR  42           HD2      TYR  42   5.816   5.061  17.205
  350    HE1  TYR  42           HE1      TYR  42   1.732   3.441  19.406
  351    HE2  TYR  42           HE2      TYR  42   4.405   6.626  18.460
  352    HH   TYR  42           HH       TYR  42   2.006   6.773  19.160
  353    H    ASN  43           H        ASN  43   6.234   0.876  14.421
  354    HA   ASN  43           HA       ASN  43   8.520  -0.577  15.285
  355    HB2  ASN  43           2HB      ASN  43   7.045  -0.807  12.649
  356    HB3  ASN  43           1HB      ASN  43   8.146  -1.999  13.319
  357   HD21  ASN  43          2HD2      ASN  43   4.525  -2.753  13.941
  358   HD22  ASN  43          1HD2      ASN  43   5.353  -2.203  12.524
  359    H    LEU  44           H        LEU  44   7.826   1.469  12.519
  360    HA   LEU  44           HA       LEU  44  10.304   0.998  11.230
  361    HB2  LEU  44           2HB      LEU  44   8.514   3.358  10.770
  362    HB3  LEU  44           1HB      LEU  44   9.705   2.690   9.709
  363    HG   LEU  44           HG       LEU  44   7.124   1.349  10.446
  364   HD11  LEU  44          1HD1      LEU  44   6.553   1.768   8.119
  365   HD12  LEU  44          2HD1      LEU  44   8.053   2.674   7.912
  366   HD13  LEU  44          3HD1      LEU  44   6.808   3.262   9.017
  367   HD21  LEU  44          3HD2      LEU  44   9.299   0.504   8.529
  368   HD22  LEU  44          1HD2      LEU  44   7.734  -0.285   8.723
  369   HD23  LEU  44          2HD2      LEU  44   8.890  -0.287  10.051
  370    H    GLN  45           H        GLN  45   9.161   3.440  13.487
  371    HA   GLN  45           HA       GLN  45  11.266   5.251  13.075
  372    HB2  GLN  45           2HB      GLN  45   9.227   5.840  14.235
  373    HB3  GLN  45           1HB      GLN  45   9.660   4.779  15.560
  374    HG2  GLN  45           2HG      GLN  45  11.422   6.101  16.271
  375    HG3  GLN  45           1HG      GLN  45  11.533   6.950  14.731
  376   HE21  GLN  45          2HE2      GLN  45   9.204   9.324  15.479
  377   HE22  GLN  45          1HE2      GLN  45  10.179   8.560  14.296
  378    H    ARG  46           H        ARG  46  10.820   2.631  15.453
  379    HA   ARG  46           HA       ARG  46  13.242   2.723  16.726
  380    HB2  ARG  46           2HB      ARG  46  10.964   0.986  16.307
  381    HB3  ARG  46           1HB      ARG  46  12.459   0.114  16.595
  382    HG2  ARG  46           2HG      ARG  46  11.055   0.624  18.560
  383    HG3  ARG  46           1HG      ARG  46  12.787   1.076  18.584
  384    HD2  ARG  46           2HD      ARG  46  11.372   2.786  19.677
  385    HD3  ARG  46           1HD      ARG  46  12.185   3.421  18.265
  386    HE   ARG  46           HE       ARG  46   9.587   2.499  17.610
  387   HH11  ARG  46          1HH1      ARG  46  11.308   5.192  19.160
  388   HH12  ARG  46          2HH1      ARG  46  10.080   6.334  18.844
  389   HH21  ARG  46          2HH2      ARG  46   8.103   5.694  17.785
  390   HH22  ARG  46          1HH2      ARG  46   7.887   4.069  17.287
  391    H    SER  47           H        SER  47  12.275   1.275  13.729
  392    HA   SER  47           HA       SER  47  14.788  -0.073  13.361
  393    HB2  SER  47           2HB      SER  47  12.688  -1.152  12.676
  394    HB3  SER  47           1HB      SER  47  12.384   0.155  11.537
  395    HG   SER  47           HG       SER  47  14.652  -0.566  10.791
  396    H    ASN  48           H        ASN  48  13.877   3.214  12.903
  397    HA   ASN  48           HA       ASN  48  14.765   4.895  11.834
  398    HB2  ASN  48           2HB      ASN  48  16.909   2.873  11.383
  399    HB3  ASN  48           1HB      ASN  48  17.081   4.485  10.675
  400   HD21  ASN  48          2HD2      ASN  48  16.965   4.457  14.759
  401   HD22  ASN  48          1HD2      ASN  48  15.705   3.694  13.850
  402    H    GLN  49           H        GLN  49  12.875   3.157  10.561
  403    HA   GLN  49           HA       GLN  49  13.658   3.439   7.744
  404    HB2  GLN  49           2HB      GLN  49  12.880   1.149   8.865
  405    HB3  GLN  49           1HB      GLN  49  11.275   1.820   8.662
  406    HG2  GLN  49           2HG      GLN  49  13.229   1.466   6.387
  407    HG3  GLN  49           1HG      GLN  49  12.059   0.246   6.858
  408   HE21  GLN  49          2HE2      GLN  49   9.415   2.733   5.889
  409   HE22  GLN  49          1HE2      GLN  49   9.929   2.047   7.391
  410    H    VAL  50           H        VAL  50  11.722   4.559  10.292
  411    HA   VAL  50           HA       VAL  50  10.786   6.632   8.562
  412    HB   VAL  50           HB       VAL  50   8.873   4.788   9.069
  413   HG11  VAL  50          1HG1      VAL  50   9.241   4.974  11.517
  414   HG12  VAL  50          2HG1      VAL  50   7.555   5.249  11.033
  415   HG13  VAL  50          3HG1      VAL  50   8.597   6.610  11.456
  416   HG21  VAL  50          3HG2      VAL  50   7.183   6.570   8.875
  417   HG22  VAL  50          1HG2      VAL  50   8.523   6.787   7.748
  418   HG23  VAL  50          2HG2      VAL  50   8.437   7.766   9.211
  419    H    PHE  51           H        PHE  51  10.742   8.368   9.603
  420    HA   PHE  51           HA       PHE  51  10.590   8.743  12.343
  421    HB2  PHE  51           2HB      PHE  51  12.948   9.850  12.648
  422    HB3  PHE  51           1HB      PHE  51  12.821   8.098  12.697
  423    HD1  PHE  51           HD1      PHE  51  14.161   6.820  11.483
  424    HD2  PHE  51           HD2      PHE  51  13.659  10.863  10.324
  425    HE1  PHE  51           HE1      PHE  51  15.902   6.511   9.851
  426    HE2  PHE  51           HE2      PHE  51  15.440  10.601   8.632
  427    HZ   PHE  51           HZ       PHE  51  16.580   8.422   8.381
  428    H    ASN  52           H        ASN  52  11.534  11.274  12.692
  429    HA   ASN  52           HA       ASN  52   9.881  12.593  10.715
  430    HB2  ASN  52           2HB      ASN  52  11.160  13.805  13.144
  431    HB3  ASN  52           1HB      ASN  52   9.961  14.545  12.119
  432   HD21  ASN  52          2HD2      ASN  52   7.203  12.899  13.465
  433   HD22  ASN  52          1HD2      ASN  52   7.784  13.879  12.178
  434    H    SER  53           H        SER  53  10.641  14.255   9.424
  435    HA   SER  53           HA       SER  53  13.509  14.412   9.357
  436    HB2  SER  53           2HB      SER  53  12.939  12.504   7.965
  437    HB3  SER  53           1HB      SER  53  11.821  13.491   7.032
  438    HG   SER  53           HG       SER  53  14.009  13.118   6.180
  439    H    ASN  54           H        ASN  54  14.093  16.189   9.128
  440    HA   ASN  54           HA       ASN  54  14.716  18.314   8.543
  441    HB2  ASN  54           2HB      ASN  54  15.641  18.153   6.477
  442    HB3  ASN  54           1HB      ASN  54  15.149  16.494   6.884
  443   HD21  ASN  54          2HD2      ASN  54  12.818  16.161   4.310
  444   HD22  ASN  54          1HD2      ASN  54  13.473  15.482   5.759
  445    H    GLU  55           H        GLU  55  11.431  17.821   7.394
  446    HA   GLU  55           HA       GLU  55  11.565  20.425   6.216
  447    HB2  GLU  55           2HB      GLU  55   9.204  19.889   5.369
  448    HB3  GLU  55           1HB      GLU  55  10.548  18.990   4.699
  449    HG2  GLU  55           2HG      GLU  55   9.982  17.201   6.392
  450    HG3  GLU  55           1HG      GLU  55   8.454  18.067   6.628
  451    H    LYS  56           H        LYS  56   9.031  21.428   6.515
  452    HA   LYS  56           HA       LYS  56   9.633  22.366   9.116
  453    HB2  LYS  56           2HB      LYS  56   7.650  23.515   7.170
  454    HB3  LYS  56           1HB      LYS  56   7.932  24.182   8.775
  455    HG2  LYS  56           2HG      LYS  56  10.172  23.794   6.800
  456    HG3  LYS  56           1HG      LYS  56   9.183  25.243   6.803
  457    HD2  LYS  56           2HD      LYS  56  11.297  25.619   8.007
  458    HD3  LYS  56           1HD      LYS  56   9.933  25.765   9.093
  459    HE2  LYS  56           2HE      LYS  56  11.915  24.641  10.069
  460    HE3  LYS  56           1HE      LYS  56  10.494  23.637  10.159
  461    HZ1  LYS  56           3HZ      LYS  56  12.454  22.374   9.499
  462    HZ2  LYS  56           1HZ      LYS  56  12.733  23.357   8.160
  463    HZ3  LYS  56           2HZ      LYS  56  11.369  22.349   8.259
  464    HA   PRO  57           HA       PRO  57   5.824  20.281  10.606
  465    HB2  PRO  57           2HB      PRO  57   4.863  18.498   8.501
  466    HB3  PRO  57           1HB      PRO  57   3.930  19.735   9.362
  467    HG2  PRO  57           2HG      PRO  57   4.509  19.925   6.734
  468    HG3  PRO  57           1HG      PRO  57   4.295  21.333   7.794
  469    HD2  PRO  57           2HD      PRO  57   6.829  20.087   6.830
  470    HD3  PRO  57           1HD      PRO  57   6.404  21.804   7.006
  471    HA   PRO  58           HA       PRO  58   9.166  17.190  10.832
  472    HB2  PRO  58           2HB      PRO  58   7.455  16.087  13.013
  473    HB3  PRO  58           1HB      PRO  58   9.170  16.550  13.071
  474    HG2  PRO  58           2HG      PRO  58   7.355  18.060  14.244
  475    HG3  PRO  58           1HG      PRO  58   8.727  18.780  13.377
  476    HD2  PRO  58           2HD      PRO  58   5.878  18.566  12.522
  477    HD3  PRO  58           1HD      PRO  58   7.049  19.879  12.270
  478    H    VAL  59           H        VAL  59   8.899  15.945   9.025
  479    HA   VAL  59           HA       VAL  59   6.373  14.670   8.482
  480    HB   VAL  59           HB       VAL  59   7.829  15.712   6.741
  481   HG11  VAL  59          1HG1      VAL  59   9.989  14.916   7.417
  482   HG12  VAL  59          2HG1      VAL  59   9.635  14.386   5.772
  483   HG13  VAL  59          3HG1      VAL  59   9.497  13.251   7.117
  484   HG21  VAL  59          3HG2      VAL  59   6.049  14.319   5.984
  485   HG22  VAL  59          1HG2      VAL  59   6.969  12.867   6.428
  486   HG23  VAL  59          2HG2      VAL  59   7.534  13.837   5.113
  487    H    TRP  60           H        TRP  60   5.721  12.668   8.662
  488    HA   TRP  60           HA       TRP  60   7.750  10.791   9.439
  489    HB2  TRP  60           2HB      TRP  60   4.734  10.455   9.233
  490    HB3  TRP  60           1HB      TRP  60   5.854   9.197   9.751
  491    HD1  TRP  60           HD1      TRP  60   4.724  12.654  10.800
  492    HE1  TRP  60           HE1      TRP  60   4.796  12.815  13.414
  493    HE3  TRP  60           HE3      TRP  60   6.804   8.149  11.766
  494    HZ2  TRP  60           HZ2      TRP  60   5.680  11.192  15.553
  495    HZ3  TRP  60           HZ3      TRP  60   7.263   7.511  14.093
  496    HH2  TRP  60           HH2      TRP  60   6.714   9.000  15.945
  497    H    ASP  61           H        ASP  61   8.816  10.395   7.900
  498    HA   ASP  61           HA       ASP  61   8.032   9.071   5.524
  499    HB2  ASP  61           2HB      ASP  61   7.507  11.482   4.949
  500    HB3  ASP  61           1HB      ASP  61   9.158  11.906   5.336
  501    H    LEU  62           H        LEU  62  10.230   9.365   4.226
  502    HA   LEU  62           HA       LEU  62  12.535   9.136   5.998
  503    HB2  LEU  62           2HB      LEU  62  11.424   6.998   5.554
  504    HB3  LEU  62           1HB      LEU  62  11.744   7.159   3.838
  505    HG   LEU  62           HG       LEU  62  14.216   7.091   4.368
  506   HD11  LEU  62          1HD1      LEU  62  14.918   6.291   6.556
  507   HD12  LEU  62          2HD1      LEU  62  13.257   6.410   7.134
  508   HD13  LEU  62          3HD1      LEU  62  14.133   7.865   6.657
  509   HD21  LEU  62          3HD2      LEU  62  13.061   5.076   3.639
  510   HD22  LEU  62          1HD2      LEU  62  12.625   4.711   5.308
  511   HD23  LEU  62          2HD2      LEU  62  14.319   4.698   4.815
  512    H    MET  63           H        MET  63  14.406   8.578   3.639
  513    HA   MET  63           HA       MET  63  13.851  11.045   2.161
  514    HB2  MET  63           2HB      MET  63  15.997  11.006   3.387
  515    HB3  MET  63           1HB      MET  63  16.415   9.483   2.620
  516    HG2  MET  63           2HG      MET  63  17.631  11.256   1.566
  517    HG3  MET  63           1HG      MET  63  16.434  10.631   0.436
  518    HE1  MET  63           3HE      MET  63  16.616  14.410  -0.534
  519    HE2  MET  63           1HE      MET  63  16.714  12.747  -1.112
  520    HE3  MET  63           2HE      MET  63  17.944  13.372  -0.014
  521    H    GLU  64           H        GLU  64  14.638   7.705   2.111
  522    HA   GLU  64           HA       GLU  64  14.261   7.511  -0.726
  523    HB2  GLU  64           2HB      GLU  64  15.600   5.385  -0.434
  524    HB3  GLU  64           1HB      GLU  64  16.380   6.915  -0.008
  525    HG2  GLU  64           2HG      GLU  64  15.218   5.186   2.140
  526    HG3  GLU  64           1HG      GLU  64  16.829   4.880   1.500
  Start of MODEL    5
    1    HA   MET   1           HA       MET   1  13.856 -10.501   8.509
    2    HB2  MET   1           2HB      MET   1  13.606 -11.807  10.563
    3    HB3  MET   1           1HB      MET   1  12.089 -12.470   9.978
    4    HG2  MET   1           2HG      MET   1  13.289 -13.586   8.151
    5    HG3  MET   1           1HG      MET   1  14.807 -12.929   8.755
    6    HE1  MET   1           2HE      MET   1  15.164 -14.789  12.209
    7    HE2  MET   1           3HE      MET   1  14.420 -13.212  11.955
    8    HE3  MET   1           1HE      MET   1  15.902 -13.638  11.099
    9    H    SER   2           H        SER   2  10.346 -11.306   8.401
   10    HA   SER   2           HA       SER   2  10.685 -12.575   5.817
   11    HB2  SER   2           2HB      SER   2   8.273 -12.268   7.606
   12    HB3  SER   2           1HB      SER   2   8.446 -13.377   6.240
   13    HG   SER   2           HG       SER   2   8.850 -14.433   8.214
   14    H    ALA   3           H        ALA   3  10.989  -9.694   6.136
   15    HA   ALA   3           HA       ALA   3  10.417  -7.689   5.267
   16    HB1  ALA   3           1HB      ALA   3   9.581  -7.635   2.980
   17    HB2  ALA   3           2HB      ALA   3   9.019  -9.300   3.116
   18    HB3  ALA   3           3HB      ALA   3  10.746  -8.951   3.138
   19    H    GLU   4           H        GLU   4   9.133  -8.038   7.292
   20    HA   GLU   4           HA       GLU   4   6.349  -7.907   7.300
   21    HB2  GLU   4           2HB      GLU   4   8.437  -6.673   9.036
   22    HB3  GLU   4           1HB      GLU   4   6.738  -6.786   9.518
   23    HG2  GLU   4           2HG      GLU   4   7.817  -8.510  10.700
   24    HG3  GLU   4           1HG      GLU   4   7.136  -9.344   9.311
   25    H    THR   5           H        THR   5   8.896  -5.481   7.361
   26    HA   THR   5           HA       THR   5   7.616  -3.084   7.460
   27    HB   THR   5           HB       THR   5  10.115  -3.730   5.903
   28    HG1  THR   5           HG1      THR   5   9.627  -3.516   8.696
   29   HG21  THR   5          3HG2      THR   5   9.342  -1.346   7.608
   30   HG22  THR   5          1HG2      THR   5   9.384  -1.360   5.844
   31   HG23  THR   5          2HG2      THR   5  10.876  -1.557   6.764
   32    H    GLN   6           H        GLN   6   7.737  -5.260   4.817
   33    HA   GLN   6           HA       GLN   6   7.410  -3.477   2.673
   34    HB2  GLN   6           2HB      GLN   6   8.159  -5.515   1.934
   35    HB3  GLN   6           1HB      GLN   6   7.222  -6.415   3.096
   36    HG2  GLN   6           2HG      GLN   6   5.931  -5.112   0.714
   37    HG3  GLN   6           1HG      GLN   6   6.729  -6.676   0.581
   38   HE21  GLN   6          2HE2      GLN   6   4.240  -7.879   3.165
   39   HE22  GLN   6          1HE2      GLN   6   5.916  -7.517   3.312
   40    H    MET   7           H        MET   7   5.230  -4.633   5.071
   41    HA   MET   7           HA       MET   7   2.819  -4.167   3.631
   42    HB2  MET   7           2HB      MET   7   3.366  -4.394   6.589
   43    HB3  MET   7           1HB      MET   7   1.759  -4.163   5.922
   44    HG2  MET   7           2HG      MET   7   3.559  -6.494   5.326
   45    HG3  MET   7           1HG      MET   7   2.237  -6.500   6.494
   46    HE1  MET   7           3HE      MET   7   1.202  -8.640   5.301
   47    HE2  MET   7           1HE      MET   7   2.523  -8.627   4.133
   48    HE3  MET   7           2HE      MET   7   0.854  -8.727   3.574
   49    H    GLU   8           H        GLU   8   4.528  -2.395   6.053
   50    HA   GLU   8           HA       GLU   8   2.861  -0.148   6.040
   51    HB2  GLU   8           2HB      GLU   8   5.758  -0.362   6.824
   52    HB3  GLU   8           1HB      GLU   8   4.689   0.987   7.169
   53    HG2  GLU   8           2HG      GLU   8   4.796  -0.172   9.172
   54    HG3  GLU   8           1HG      GLU   8   3.276  -0.692   8.449
   55    H    ARG   9           H        ARG   9   5.725  -1.070   4.340
   56    HA   ARG   9           HA       ARG   9   6.238   1.514   3.363
   57    HB2  ARG   9           2HB      ARG   9   7.314  -1.161   2.575
   58    HB3  ARG   9           1HB      ARG   9   7.669   0.252   1.586
   59    HG2  ARG   9           2HG      ARG   9   8.188   0.141   4.538
   60    HG3  ARG   9           1HG      ARG   9   9.387  -0.309   3.319
   61    HD2  ARG   9           2HD      ARG   9   7.990   2.370   3.323
   62    HD3  ARG   9           1HD      ARG   9   9.505   2.069   4.166
   63    HE   ARG   9           HE       ARG   9  10.549   1.606   2.094
   64   HH11  ARG   9          1HH1      ARG   9   7.270   2.963   1.575
   65   HH12  ARG   9          2HH1      ARG   9   7.715   3.660   0.081
   66   HH21  ARG   9          2HH2      ARG   9   9.930   3.414  -0.763
   67   HH22  ARG   9          1HH2      ARG   9  11.042   2.515   0.181
   68    H    LYS  10           H        LYS  10   4.327  -1.012   2.030
   69    HA   LYS  10           HA       LYS  10   3.992   0.521  -0.375
   70    HB2  LYS  10           2HB      LYS  10   2.102  -1.084  -0.892
   71    HB3  LYS  10           1HB      LYS  10   3.693  -1.806  -0.699
   72    HG2  LYS  10           2HG      LYS  10   3.107  -2.469   1.570
   73    HG3  LYS  10           1HG      LYS  10   1.516  -1.744   1.364
   74    HD2  LYS  10           2HD      LYS  10   0.892  -3.342  -0.250
   75    HD3  LYS  10           1HD      LYS  10   2.556  -3.907  -0.442
   76    HE2  LYS  10           2HE      LYS  10   1.211  -5.466   0.917
   77    HE3  LYS  10           1HE      LYS  10   2.563  -4.767   1.803
   78    HZ1  LYS  10           3HZ      LYS  10   1.071  -3.237   2.863
   79    HZ2  LYS  10           1HZ      LYS  10   0.606  -4.845   3.120
   80    HZ3  LYS  10           2HZ      LYS  10  -0.262  -3.887   2.015
   81    H    ILE  11           H        ILE  11   2.265   0.356   2.727
   82    HA   ILE  11           HA       ILE  11   0.097   1.801   1.574
   83    HB   ILE  11           HB       ILE  11  -0.799   1.927   3.853
   84   HG12  ILE  11          2HG1      ILE  11   0.451   0.046   5.380
   85   HG13  ILE  11          1HG1      ILE  11   1.795   0.747   4.463
   86   HG21  ILE  11          1HG2      ILE  11  -1.342   0.095   2.350
   87   HG22  ILE  11          2HG2      ILE  11  -1.165  -0.559   4.010
   88   HG23  ILE  11          3HG2      ILE  11   0.175  -0.664   2.840
   89   HD11  ILE  11          3HD1      ILE  11   1.522   1.768   6.639
   90   HD12  ILE  11          1HD1      ILE  11  -0.084   2.354   6.146
   91   HD13  ILE  11          2HD1      ILE  11   1.373   2.862   5.260
   92    H    ILE  12           H        ILE  12   2.862   2.599   3.557
   93    HA   ILE  12           HA       ILE  12   1.959   5.281   3.787
   94    HB   ILE  12           HB       ILE  12   3.904   5.872   4.838
   95   HG12  ILE  12          2HG1      ILE  12   5.922   3.985   4.599
   96   HG13  ILE  12          1HG1      ILE  12   5.245   4.102   2.992
   97   HG21  ILE  12          1HG2      ILE  12   2.826   4.359   6.261
   98   HG22  ILE  12          2HG2      ILE  12   4.572   4.194   6.456
   99   HG23  ILE  12          3HG2      ILE  12   3.671   2.993   5.532
  100   HD11  ILE  12          3HD1      ILE  12   6.256   6.497   4.539
  101   HD12  ILE  12          1HD1      ILE  12   5.458   6.555   2.977
  102   HD13  ILE  12          2HD1      ILE  12   7.014   5.760   3.122
  103    H    ASP  13           H        ASP  13   3.595   3.433   1.370
  104    HA   ASP  13           HA       ASP  13   4.870   5.754   0.258
  105    HB2  ASP  13           2HB      ASP  13   5.516   3.231  -0.151
  106    HB3  ASP  13           1HB      ASP  13   4.402   3.393  -1.513
  107    H    PHE  14           H        PHE  14   1.878   4.076  -0.268
  108    HA   PHE  14           HA       PHE  14   0.881   5.529  -2.408
  109    HB2  PHE  14           2HB      PHE  14  -0.337   3.641  -1.542
  110    HB3  PHE  14           1HB      PHE  14  -0.407   4.349   0.063
  111    HD1  PHE  14           HD1      PHE  14  -1.751   4.509  -3.339
  112    HD2  PHE  14           HD2      PHE  14  -2.029   5.899   0.636
  113    HE1  PHE  14           HE1      PHE  14  -3.968   5.482  -3.856
  114    HE2  PHE  14           HE2      PHE  14  -4.233   6.884   0.176
  115    HZ   PHE  14           HZ       PHE  14  -5.218   6.676  -2.092
  116    H    LEU  15           H        LEU  15   0.611   6.178   1.134
  117    HA   LEU  15           HA       LEU  15  -0.508   8.664   0.937
  118    HB2  LEU  15           2HB      LEU  15  -0.841   7.790   2.833
  119    HB3  LEU  15           1HB      LEU  15   0.614   6.824   2.897
  120    HG   LEU  15           HG       LEU  15   0.298   8.241   4.758
  121   HD11  LEU  15          1HD1      LEU  15   2.694   9.119   3.174
  122   HD12  LEU  15          2HD1      LEU  15   2.580   7.757   4.288
  123   HD13  LEU  15          3HD1      LEU  15   2.487   9.407   4.904
  124   HD21  LEU  15          3HD2      LEU  15   0.374  10.540   2.859
  125   HD22  LEU  15          1HD2      LEU  15   0.564  10.742   4.609
  126   HD23  LEU  15          2HD2      LEU  15  -0.932  10.067   3.965
  127    H    ARG  16           H        ARG  16   2.771   7.635   0.874
  128    HA   ARG  16           HA       ARG  16   4.165   9.938   1.308
  129    HB2  ARG  16           2HB      ARG  16   5.219   7.828   1.150
  130    HB3  ARG  16           1HB      ARG  16   4.626   7.607  -0.489
  131    HG2  ARG  16           2HG      ARG  16   6.021   9.312  -1.281
  132    HG3  ARG  16           1HG      ARG  16   6.555   9.670   0.363
  133    HD2  ARG  16           2HD      ARG  16   7.320   7.238   0.468
  134    HD3  ARG  16           1HD      ARG  16   6.994   7.155  -1.251
  135    HE   ARG  16           HE       ARG  16   8.676   9.317  -0.828
  136   HH11  ARG  16          1HH1      ARG  16   8.740   5.767  -0.880
  137   HH12  ARG  16          2HH1      ARG  16  10.473   5.718  -0.796
  138   HH21  ARG  16          2HH2      ARG  16  11.764   7.589  -0.918
  139   HH22  ARG  16          1HH2      ARG  16  11.083   9.146  -0.903
  140    H    GLN  17           H        GLN  17   3.059   8.550  -1.588
  141    HA   GLN  17           HA       GLN  17   3.774  10.675  -3.326
  142    HB2  GLN  17           2HB      GLN  17   2.156   8.185  -3.682
  143    HB3  GLN  17           1HB      GLN  17   2.281   9.374  -4.972
  144    HG2  GLN  17           2HG      GLN  17   4.669   9.108  -5.075
  145    HG3  GLN  17           1HG      GLN  17   4.654   8.079  -3.646
  146   HE21  GLN  17          2HE2      GLN  17   3.984   5.183  -5.400
  147   HE22  GLN  17          1HE2      GLN  17   4.282   5.926  -3.880
  148    H    ASN  18           H        ASN  18   0.984  10.138  -1.325
  149    HA   ASN  18           HA       ASN  18  -0.511  12.169  -2.798
  150    HB2  ASN  18           2HB      ASN  18  -1.140  10.710  -0.198
  151    HB3  ASN  18           1HB      ASN  18  -2.174  11.955  -0.878
  152   HD21  ASN  18          2HD2      ASN  18  -1.874   8.727  -3.328
  153   HD22  ASN  18          1HD2      ASN  18  -0.490   9.634  -2.845
  154    H    GLY  19           H        GLY  19   1.292  11.724   0.076
  155    HA2  GLY  19           2HA      GLY  19   2.682  13.969   0.246
  156    HA3  GLY  19           1HA      GLY  19   1.123  14.488   0.872
  157    H    LYS  20           H        LYS  20   3.842  12.122   1.447
  158    HA   LYS  20           HA       LYS  20   3.286  11.165   3.866
  159    HB2  LYS  20           2HB      LYS  20   5.806  11.421   4.298
  160    HB3  LYS  20           1HB      LYS  20   5.336  10.532   2.867
  161    HG2  LYS  20           2HG      LYS  20   7.074  11.862   2.097
  162    HG3  LYS  20           1HG      LYS  20   5.654  12.802   1.644
  163    HD2  LYS  20           2HD      LYS  20   5.955  14.175   3.665
  164    HD3  LYS  20           1HD      LYS  20   7.388  13.230   4.069
  165    HE2  LYS  20           2HE      LYS  20   8.216  13.921   1.727
  166    HE3  LYS  20           1HE      LYS  20   6.967  15.161   1.824
  167    HZ1  LYS  20           3HZ      LYS  20   9.128  15.993   2.640
  168    HZ2  LYS  20           1HZ      LYS  20   9.188  14.722   3.717
  169    HZ3  LYS  20           2HZ      LYS  20   8.060  15.988   3.925
  170    H    SER  21           H        SER  21   3.734  11.873   6.120
  171    HA   SER  21           HA       SER  21   3.632  14.640   6.703
  172    HB2  SER  21           2HB      SER  21   1.625  14.504   5.208
  173    HB3  SER  21           1HB      SER  21   0.925  13.317   6.296
  174    HG   SER  21           HG       SER  21   1.184  16.049   6.513
  175    H    ILE  22           H        ILE  22   1.496  14.393   8.550
  176    HA   ILE  22           HA       ILE  22   2.969  13.137  10.656
  177    HB   ILE  22           HB       ILE  22   1.228  14.006  12.190
  178   HG12  ILE  22          2HG1      ILE  22   0.047  15.238   9.681
  179   HG13  ILE  22          1HG1      ILE  22  -0.678  13.929  10.603
  180   HG21  ILE  22          1HG2      ILE  22   2.431  16.016  10.289
  181   HG22  ILE  22          2HG2      ILE  22   3.204  15.323  11.715
  182   HG23  ILE  22          3HG2      ILE  22   1.806  16.382  11.897
  183   HD11  ILE  22          3HD1      ILE  22  -0.198  16.737  11.584
  184   HD12  ILE  22          1HD1      ILE  22  -0.934  15.432  12.517
  185   HD13  ILE  22          2HD1      ILE  22  -1.746  16.057  11.081
  186    H    ALA  23           H        ALA  23   1.719  11.949  12.329
  187    HA   ALA  23           HA       ALA  23   1.032   9.405  11.412
  188    HB1  ALA  23           1HB      ALA  23   2.031   9.919  13.580
  189    HB2  ALA  23           2HB      ALA  23   0.536   8.966  13.749
  190    HB3  ALA  23           3HB      ALA  23   0.515  10.721  14.006
  191    H    LEU  24           H        LEU  24  -0.870  12.098  11.687
  192    HA   LEU  24           HA       LEU  24  -3.381  10.704  12.111
  193    HB2  LEU  24           2HB      LEU  24  -3.289  12.865  13.043
  194    HB3  LEU  24           1HB      LEU  24  -2.655  13.561  11.566
  195    HG   LEU  24           HG       LEU  24  -4.809  13.169  10.467
  196   HD11  LEU  24          1HD1      LEU  24  -6.778  12.589  11.805
  197   HD12  LEU  24          2HD1      LEU  24  -5.699  12.195  13.164
  198   HD13  LEU  24          3HD1      LEU  24  -5.579  11.309  11.633
  199   HD21  LEU  24          3HD2      LEU  24  -4.290  15.271  11.466
  200   HD22  LEU  24          1HD2      LEU  24  -4.952  14.754  13.018
  201   HD23  LEU  24          2HD2      LEU  24  -6.024  14.937  11.616
  202    H    THR  25           H        THR  25  -1.792  12.503   9.589
  203    HA   THR  25           HA       THR  25  -3.702  12.542   7.626
  204    HB   THR  25           HB       THR  25  -0.746  12.284   7.219
  205    HG1  THR  25           HG1      THR  25  -0.662  14.462   7.640
  206   HG21  THR  25          3HG2      THR  25  -1.175  13.580   5.192
  207   HG22  THR  25          1HG2      THR  25  -2.891  13.709   5.629
  208   HG23  THR  25          2HG2      THR  25  -2.216  12.144   5.239
  209    H    ILE  26           H        ILE  26  -1.162  10.181   8.047
  210    HA   ILE  26           HA       ILE  26  -1.520   8.618   5.809
  211    HB   ILE  26           HB       ILE  26  -1.005   7.287   8.499
  212   HG12  ILE  26          2HG1      ILE  26   0.994   8.710   6.670
  213   HG13  ILE  26          1HG1      ILE  26   0.462   9.316   8.227
  214   HG21  ILE  26          1HG2      ILE  26   0.333   5.766   7.088
  215   HG22  ILE  26          2HG2      ILE  26  -0.278   6.637   5.660
  216   HG23  ILE  26          3HG2      ILE  26  -1.394   5.798   6.720
  217   HD11  ILE  26          3HD1      ILE  26   2.000   6.771   7.776
  218   HD12  ILE  26          1HD1      ILE  26   1.494   7.423   9.335
  219   HD13  ILE  26          2HD1      ILE  26   2.661   8.305   8.353
  220    H    ALA  27           H        ALA  27  -3.292   8.373   8.839
  221    HA   ALA  27           HA       ALA  27  -4.818   6.097   8.223
  222    HB1  ALA  27           1HB      ALA  27  -6.206   6.746  10.099
  223    HB2  ALA  27           2HB      ALA  27  -5.498   8.362  10.085
  224    HB3  ALA  27           3HB      ALA  27  -4.499   6.968  10.494
  225    H    LYS  28           H        LYS  28  -5.353   9.612   7.468
  226    HA   LYS  28           HA       LYS  28  -7.995   9.254   6.820
  227    HB2  LYS  28           2HB      LYS  28  -7.244  11.277   7.760
  228    HB3  LYS  28           1HB      LYS  28  -5.861  11.354   6.680
  229    HG2  LYS  28           2HG      LYS  28  -7.165  11.628   4.924
  230    HG3  LYS  28           1HG      LYS  28  -8.693  11.541   5.847
  231    HD2  LYS  28           2HD      LYS  28  -8.301  13.938   5.532
  232    HD3  LYS  28           1HD      LYS  28  -7.754  13.581   7.167
  233    HE2  LYS  28           2HE      LYS  28  -6.115  15.000   6.127
  234    HE3  LYS  28           1HE      LYS  28  -5.418  13.388   6.255
  235    HZ1  LYS  28           3HZ      LYS  28  -6.517  14.612   3.734
  236    HZ2  LYS  28           1HZ      LYS  28  -6.039  13.016   3.913
  237    HZ3  LYS  28           2HZ      LYS  28  -4.914  14.112   4.060
  238    H    GLU  29           H        GLU  29  -4.871   9.142   5.182
  239    HA   GLU  29           HA       GLU  29  -6.027   9.509   2.571
  240    HB2  GLU  29           2HB      GLU  29  -3.248   8.473   3.072
  241    HB3  GLU  29           1HB      GLU  29  -3.838   9.383   1.694
  242    HG2  GLU  29           2HG      GLU  29  -3.261  10.390   4.472
  243    HG3  GLU  29           1HG      GLU  29  -2.434  10.773   2.987
  244    H    ILE  30           H        ILE  30  -4.962   6.855   4.519
  245    HA   ILE  30           HA       ILE  30  -5.481   5.063   2.276
  246    HB   ILE  30           HB       ILE  30  -4.617   3.219   3.680
  247   HG12  ILE  30          2HG1      ILE  30  -4.038   5.410   5.690
  248   HG13  ILE  30          1HG1      ILE  30  -5.166   4.083   5.911
  249   HG21  ILE  30          1HG2      ILE  30  -3.121   4.369   2.172
  250   HG22  ILE  30          2HG2      ILE  30  -2.249   3.928   3.641
  251   HG23  ILE  30          3HG2      ILE  30  -2.778   5.592   3.395
  252   HD11  ILE  30          3HD1      ILE  30  -2.170   3.871   5.668
  253   HD12  ILE  30          1HD1      ILE  30  -3.273   2.507   5.832
  254   HD13  ILE  30          2HD1      ILE  30  -3.125   3.680   7.140
  255    H    GLY  31           H        GLY  31  -7.125   6.384   4.798
  256    HA2  GLY  31           2HA      GLY  31  -9.253   6.098   5.566
  257    HA3  GLY  31           1HA      GLY  31  -9.492   4.940   4.267
  258    H    LEU  32           H        LEU  32  -7.035   4.619   6.705
  259    HA   LEU  32           HA       LEU  32  -8.494   2.250   7.664
  260    HB2  LEU  32           2HB      LEU  32  -5.488   2.534   7.642
  261    HB3  LEU  32           1HB      LEU  32  -6.397   1.122   8.112
  262    HG   LEU  32           HG       LEU  32  -5.908   2.208   5.359
  263   HD11  LEU  32          1HD1      LEU  32  -5.420  -0.492   6.569
  264   HD12  LEU  32          2HD1      LEU  32  -4.213   0.753   6.282
  265   HD13  LEU  32          3HD1      LEU  32  -5.035  -0.009   4.917
  266   HD21  LEU  32          3HD2      LEU  32  -7.957   0.127   6.133
  267   HD22  LEU  32          1HD2      LEU  32  -7.383   0.452   4.481
  268   HD23  LEU  32          2HD2      LEU  32  -8.209   1.717   5.377
  269    H    ASP  33           H        ASP  33  -7.587   1.527   9.819
  270    HA   ASP  33           HA       ASP  33  -8.202   3.406  11.774
  271    HB2  ASP  33           2HB      ASP  33  -8.543   1.218  12.453
  272    HB3  ASP  33           1HB      ASP  33  -6.999   0.670  11.814
  273    H    LYS  34           H        LYS  34  -7.075   4.672  13.085
  274    HA   LYS  34           HA       LYS  34  -4.490   5.492  12.133
  275    HB2  LYS  34           2HB      LYS  34  -4.624   7.364  13.639
  276    HB3  LYS  34           1HB      LYS  34  -6.158   7.178  12.825
  277    HG2  LYS  34           2HG      LYS  34  -7.285   6.877  14.740
  278    HG3  LYS  34           1HG      LYS  34  -6.081   5.747  15.363
  279    HD2  LYS  34           2HD      LYS  34  -5.766   8.762  15.362
  280    HD3  LYS  34           1HD      LYS  34  -6.296   7.812  16.752
  281    HE2  LYS  34           2HE      LYS  34  -4.184   6.588  16.744
  282    HE3  LYS  34           1HE      LYS  34  -3.639   7.466  15.329
  283    HZ1  LYS  34           3HZ      LYS  34  -2.629   8.363  17.225
  284    HZ2  LYS  34           1HZ      LYS  34  -4.101   8.580  18.046
  285    HZ3  LYS  34           2HZ      LYS  34  -3.737   9.513  16.679
  286    H    SER  35           H        SER  35  -5.576   3.277  14.501
  287    HA   SER  35           HA       SER  35  -3.430   3.703  16.366
  288    HB2  SER  35           2HB      SER  35  -5.580   2.667  17.114
  289    HB3  SER  35           1HB      SER  35  -5.329   1.340  15.986
  290    HG   SER  35           HG       SER  35  -4.524   1.535  18.470
  291    H    THR  36           H        THR  36  -4.346   1.522  13.779
  292    HA   THR  36           HA       THR  36  -2.205  -0.022  13.561
  293    HB   THR  36           HB       THR  36  -4.301   1.116  11.797
  294    HG1  THR  36           HG1      THR  36  -5.147  -0.277  13.116
  295   HG21  THR  36          3HG2      THR  36  -2.290  -0.965  11.073
  296   HG22  THR  36          1HG2      THR  36  -2.473   0.696  10.457
  297   HG23  THR  36          2HG2      THR  36  -3.770  -0.497  10.149
  298    H    VAL  37           H        VAL  37  -2.799   3.122  11.769
  299    HA   VAL  37           HA       VAL  37  -0.422   3.339  10.492
  300    HB   VAL  37           HB       VAL  37  -2.229   5.329  11.774
  301   HG11  VAL  37          1HG1      VAL  37  -0.030   6.335  11.466
  302   HG12  VAL  37          2HG1      VAL  37  -1.219   7.066  10.416
  303   HG13  VAL  37          3HG1      VAL  37  -0.048   5.894   9.755
  304   HG21  VAL  37          3HG2      VAL  37  -1.967   4.391   8.929
  305   HG22  VAL  37          1HG2      VAL  37  -3.030   5.691   9.462
  306   HG23  VAL  37          2HG2      VAL  37  -3.288   4.048  10.045
  307    H    ASN  38           H        ASN  38  -1.231   4.580  13.712
  308    HA   ASN  38           HA       ASN  38   1.258   5.814  14.193
  309    HB2  ASN  38           2HB      ASN  38  -0.929   4.885  16.046
  310    HB3  ASN  38           1HB      ASN  38   0.530   5.645  16.656
  311   HD21  ASN  38          2HD2      ASN  38  -1.401   8.159  14.067
  312   HD22  ASN  38          1HD2      ASN  38  -0.783   6.626  13.621
  313    H    ARG  39           H        ARG  39   0.066   2.636  14.972
  314    HA   ARG  39           HA       ARG  39   2.163   1.666  16.526
  315    HB2  ARG  39           2HB      ARG  39   0.008   0.655  16.357
  316    HB3  ARG  39           1HB      ARG  39   0.172   0.496  14.623
  317    HG2  ARG  39           2HG      ARG  39   2.038  -0.950  15.020
  318    HG3  ARG  39           1HG      ARG  39   1.627  -0.986  16.743
  319    HD2  ARG  39           2HD      ARG  39   0.054  -1.964  14.358
  320    HD3  ARG  39           1HD      ARG  39   0.479  -2.895  15.802
  321    HE   ARG  39           HE       ARG  39  -1.107  -1.238  16.943
  322   HH11  ARG  39          1HH1      ARG  39  -1.580  -2.553  13.654
  323   HH12  ARG  39          2HH1      ARG  39  -3.231  -2.144  13.581
  324   HH21  ARG  39          2HH2      ARG  39  -4.315  -1.111  15.406
  325   HH22  ARG  39          1HH2      ARG  39  -3.472  -0.693  16.807
  326    H    HIS  40           H        HIS  40   1.436   1.411  13.165
  327    HA   HIS  40           HA       HIS  40   3.720  -0.149  12.613
  328    HB2  HIS  40           2HB      HIS  40   1.647   1.097  10.894
  329    HB3  HIS  40           1HB      HIS  40   3.062   0.366  10.171
  330    HD1  HIS  40           HD1      HIS  40   3.188  -2.354  10.342
  331    HD2  HIS  40           HD2      HIS  40  -0.154  -0.638  12.161
  332    HE1  HIS  40           HE1      HIS  40   1.657  -4.237  10.931
  333    H    LEU  41           H        LEU  41   3.187   3.232  12.449
  334    HA   LEU  41           HA       LEU  41   5.591   3.697  10.957
  335    HB2  LEU  41           2HB      LEU  41   5.273   6.106  11.491
  336    HB3  LEU  41           1HB      LEU  41   3.902   5.362  10.705
  337    HG   LEU  41           HG       LEU  41   2.986   5.157  13.134
  338   HD11  LEU  41          1HD1      LEU  41   4.911   7.402  13.533
  339   HD12  LEU  41          2HD1      LEU  41   4.915   5.836  14.346
  340   HD13  LEU  41          3HD1      LEU  41   3.583   6.962  14.606
  341   HD21  LEU  41          3HD2      LEU  41   2.001   6.393  11.395
  342   HD22  LEU  41          1HD2      LEU  41   3.107   7.750  11.646
  343   HD23  LEU  41          2HD2      LEU  41   1.935   7.315  12.906
  344    H    TYR  42           H        TYR  42   4.749   3.410  14.385
  345    HA   TYR  42           HA       TYR  42   7.038   4.471  15.298
  346    HB2  TYR  42           2HB      TYR  42   4.823   2.896  16.123
  347    HB3  TYR  42           1HB      TYR  42   6.221   2.567  17.072
  348    HD1  TYR  42           HD1      TYR  42   7.435   5.200  17.229
  349    HD2  TYR  42           HD2      TYR  42   3.390   4.131  17.289
  350    HE1  TYR  42           HE1      TYR  42   6.946   7.297  18.484
  351    HE2  TYR  42           HE2      TYR  42   2.817   6.215  18.540
  352    HH   TYR  42           HH       TYR  42   3.942   7.840  19.989
  353    H    ASN  43           H        ASN  43   6.125   1.386  14.150
  354    HA   ASN  43           HA       ASN  43   8.365  -0.186  14.934
  355    HB2  ASN  43           2HB      ASN  43   6.654  -0.537  12.461
  356    HB3  ASN  43           1HB      ASN  43   7.731  -1.745  13.144
  357   HD21  ASN  43          2HD2      ASN  43   4.147  -2.145  14.150
  358   HD22  ASN  43          1HD2      ASN  43   4.896  -1.805  12.622
  359    H    LEU  44           H        LEU  44   7.636   1.640  12.029
  360    HA   LEU  44           HA       LEU  44   9.992   0.976  10.614
  361    HB2  LEU  44           2HB      LEU  44   8.420   3.522  10.315
  362    HB3  LEU  44           1HB      LEU  44   9.429   2.752   9.137
  363    HG   LEU  44           HG       LEU  44   6.825   1.619  10.121
  364   HD11  LEU  44          1HD1      LEU  44   6.534   3.654   8.809
  365   HD12  LEU  44          2HD1      LEU  44   5.982   2.236   7.925
  366   HD13  LEU  44          3HD1      LEU  44   7.534   2.974   7.525
  367   HD21  LEU  44          3HD2      LEU  44   8.660   0.751   7.896
  368   HD22  LEU  44          1HD2      LEU  44   7.100   0.034   8.295
  369   HD23  LEU  44          2HD2      LEU  44   8.439  -0.087   9.434
  370    H    GLN  45           H        GLN  45   9.118   3.586  12.795
  371    HA   GLN  45           HA       GLN  45  11.387   5.176  12.533
  372    HB2  GLN  45           2HB      GLN  45   9.417   5.885  13.674
  373    HB3  GLN  45           1HB      GLN  45   9.696   4.727  14.958
  374    HG2  GLN  45           2HG      GLN  45  11.585   5.823  15.762
  375    HG3  GLN  45           1HG      GLN  45  11.786   6.752  14.281
  376   HE21  GLN  45          2HE2      GLN  45   9.691   9.278  15.173
  377   HE22  GLN  45          1HE2      GLN  45  10.629   8.501  13.962
  378    H    ARG  46           H        ARG  46  10.741   2.347  14.435
  379    HA   ARG  46           HA       ARG  46  12.959   2.366  16.210
  380    HB2  ARG  46           2HB      ARG  46  11.676  -0.102  15.017
  381    HB3  ARG  46           1HB      ARG  46  12.697  -0.063  16.432
  382    HG2  ARG  46           2HG      ARG  46   9.911   1.038  16.155
  383    HG3  ARG  46           1HG      ARG  46  10.408  -0.378  17.074
  384    HD2  ARG  46           2HD      ARG  46  10.316   1.129  18.782
  385    HD3  ARG  46           1HD      ARG  46  11.965   1.417  18.208
  386    HE   ARG  46           HE       ARG  46  10.027   3.028  16.899
  387   HH11  ARG  46          1HH1      ARG  46  12.140   2.818  19.731
  388   HH12  ARG  46          2HH1      ARG  46  12.086   4.472  20.122
  389   HH21  ARG  46          2HH2      ARG  46  10.770   5.974  18.759
  390   HH22  ARG  46          1HH2      ARG  46   9.919   5.392  17.450
  391    H    SER  47           H        SER  47  12.597   1.357  12.967
  392    HA   SER  47           HA       SER  47  15.257   0.189  12.901
  393    HB2  SER  47           2HB      SER  47  13.388  -1.143  12.025
  394    HB3  SER  47           1HB      SER  47  13.027   0.124  10.858
  395    HG   SER  47           HG       SER  47  15.340  -0.244  10.227
  396    H    ASN  48           H        ASN  48  14.171   3.349  12.581
  397    HA   ASN  48           HA       ASN  48  14.781   5.127  11.499
  398    HB2  ASN  48           2HB      ASN  48  17.211   3.431  11.031
  399    HB3  ASN  48           1HB      ASN  48  17.150   5.099  10.452
  400   HD21  ASN  48          2HD2      ASN  48  17.741   4.240  14.356
  401   HD22  ASN  48          1HD2      ASN  48  17.354   3.006  13.202
  402    H    GLN  49           H        GLN  49  13.088   3.373  10.183
  403    HA   GLN  49           HA       GLN  49  13.883   3.383   7.373
  404    HB2  GLN  49           2HB      GLN  49  12.793   1.380   8.490
  405    HB3  GLN  49           1HB      GLN  49  11.394   2.364   8.815
  406    HG2  GLN  49           2HG      GLN  49  12.379   1.458   6.100
  407    HG3  GLN  49           1HG      GLN  49  10.998   0.818   6.979
  408   HE21  GLN  49          2HE2      GLN  49  10.668   4.081   4.713
  409   HE22  GLN  49          1HE2      GLN  49  12.127   3.160   4.841
  410    H    VAL  50           H        VAL  50  11.476   4.482   9.669
  411    HA   VAL  50           HA       VAL  50  11.056   6.866   8.051
  412    HB   VAL  50           HB       VAL  50   9.107   5.058   8.288
  413   HG11  VAL  50          1HG1      VAL  50   8.705   6.743  10.755
  414   HG12  VAL  50          2HG1      VAL  50   9.350   5.141  10.767
  415   HG13  VAL  50          3HG1      VAL  50   7.651   5.414  10.227
  416   HG21  VAL  50          3HG2      VAL  50   8.644   8.019   8.617
  417   HG22  VAL  50          1HG2      VAL  50   7.420   6.852   8.114
  418   HG23  VAL  50          2HG2      VAL  50   8.835   7.141   7.098
  419    H    PHE  51           H        PHE  51  10.699   8.552   9.332
  420    HA   PHE  51           HA       PHE  51  10.638   8.674  12.095
  421    HB2  PHE  51           2HB      PHE  51  12.955   9.932  12.404
  422    HB3  PHE  51           1HB      PHE  51  12.889   8.176  12.410
  423    HD1  PHE  51           HD1      PHE  51  14.249   6.990  11.160
  424    HD2  PHE  51           HD2      PHE  51  13.552  11.019  10.059
  425    HE1  PHE  51           HE1      PHE  51  15.936   6.755   9.475
  426    HE2  PHE  51           HE2      PHE  51  15.284  10.837   8.303
  427    HZ   PHE  51           HZ       PHE  51  16.495   8.698   7.995
  428    H    ASN  52           H        ASN  52  11.564  11.241  12.645
  429    HA   ASN  52           HA       ASN  52   9.739  12.736  10.903
  430    HB2  ASN  52           2HB      ASN  52  10.913  13.619  13.490
  431    HB3  ASN  52           1HB      ASN  52   9.641  14.380  12.594
  432   HD21  ASN  52          2HD2      ASN  52   7.041  12.390  13.718
  433   HD22  ASN  52          1HD2      ASN  52   7.535  13.652  12.653
  434    H    SER  53           H        SER  53  10.455  14.462   9.801
  435    HA   SER  53           HA       SER  53  13.209  15.355  10.134
  436    HB2  SER  53           2HB      SER  53  13.279  13.078   9.063
  437    HB3  SER  53           1HB      SER  53  12.420  13.810   7.706
  438    HG   SER  53           HG       SER  53  14.619  13.786   7.261
  439    H    ASN  54           H        ASN  54  13.728  16.192   7.761
  440    HA   ASN  54           HA       ASN  54  13.742  17.717   6.112
  441    HB2  ASN  54           2HB      ASN  54  12.768  15.897   5.013
  442    HB3  ASN  54           1HB      ASN  54  11.170  16.275   5.625
  443   HD21  ASN  54          2HD2      ASN  54  10.410  18.519   3.057
  444   HD22  ASN  54          1HD2      ASN  54   9.874  17.776   4.502
  445    H    GLU  55           H        GLU  55  11.105  18.487   8.268
  446    HA   GLU  55           HA       GLU  55  11.050  21.083   7.038
  447    HB2  GLU  55           2HB      GLU  55   8.507  20.889   6.683
  448    HB3  GLU  55           1HB      GLU  55   9.581  20.137   5.513
  449    HG2  GLU  55           2HG      GLU  55   9.301  18.012   6.820
  450    HG3  GLU  55           1HG      GLU  55   7.933  18.780   7.645
  451    H    LYS  56           H        LYS  56   9.155  22.378   7.999
  452    HA   LYS  56           HA       LYS  56   9.820  22.798  10.677
  453    HB2  LYS  56           2HB      LYS  56   7.393  23.877   9.197
  454    HB3  LYS  56           1HB      LYS  56   7.924  24.406  10.784
  455    HG2  LYS  56           2HG      LYS  56  10.018  25.206   9.833
  456    HG3  LYS  56           1HG      LYS  56   9.527  24.627   8.243
  457    HD2  LYS  56           2HD      LYS  56   9.151  27.027   8.412
  458    HD3  LYS  56           1HD      LYS  56   7.609  26.185   8.291
  459    HE2  LYS  56           2HE      LYS  56   7.304  26.393  10.719
  460    HE3  LYS  56           1HE      LYS  56   8.863  27.208  10.848
  461    HZ1  LYS  56           3HZ      LYS  56   6.491  28.203   9.357
  462    HZ2  LYS  56           1HZ      LYS  56   7.986  28.993   9.462
  463    HZ3  LYS  56           2HZ      LYS  56   7.041  28.781  10.847
  464    HA   PRO  57           HA       PRO  57   6.169  20.293  12.141
  465    HB2  PRO  57           2HB      PRO  57   4.816  18.895  10.010
  466    HB3  PRO  57           1HB      PRO  57   4.129  20.154  11.052
  467    HG2  PRO  57           2HG      PRO  57   4.537  20.451   8.367
  468    HG3  PRO  57           1HG      PRO  57   4.439  21.789   9.530
  469    HD2  PRO  57           2HD      PRO  57   6.851  20.521   8.329
  470    HD3  PRO  57           1HD      PRO  57   6.526  22.230   8.678
  471    HA   PRO  58           HA       PRO  58   9.348  17.081  11.572
  472    HB2  PRO  58           2HB      PRO  58   8.283  15.472  13.640
  473    HB3  PRO  58           1HB      PRO  58   9.562  16.692  13.837
  474    HG2  PRO  58           2HG      PRO  58   6.675  16.883  14.417
  475    HG3  PRO  58           1HG      PRO  58   8.049  17.661  15.223
  476    HD2  PRO  58           2HD      PRO  58   6.427  19.015  13.609
  477    HD3  PRO  58           1HD      PRO  58   8.166  19.372  13.688
  478    H    VAL  59           H        VAL  59   8.909  16.021   9.671
  479    HA   VAL  59           HA       VAL  59   6.286  14.884   9.257
  480    HB   VAL  59           HB       VAL  59   7.376  16.233   7.536
  481   HG11  VAL  59          1HG1      VAL  59   9.403  14.060   7.376
  482   HG12  VAL  59          2HG1      VAL  59   9.661  15.749   7.810
  483   HG13  VAL  59          3HG1      VAL  59   9.181  15.316   6.165
  484   HG21  VAL  59          3HG2      VAL  59   5.692  14.641   6.777
  485   HG22  VAL  59          1HG2      VAL  59   6.915  13.365   6.720
  486   HG23  VAL  59          2HG2      VAL  59   7.029  14.694   5.610
  487    H    TRP  60           H        TRP  60   5.706  12.830   9.284
  488    HA   TRP  60           HA       TRP  60   7.806  10.927   9.656
  489    HB2  TRP  60           2HB      TRP  60   4.813  10.525   9.319
  490    HB3  TRP  60           1HB      TRP  60   5.969   9.228   9.632
  491    HD1  TRP  60           HD1      TRP  60   4.533  12.293  11.209
  492    HE1  TRP  60           HE1      TRP  60   4.667  12.074  13.842
  493    HE3  TRP  60           HE3      TRP  60   7.242   8.063  11.452
  494    HZ2  TRP  60           HZ2      TRP  60   5.846  10.303  15.684
  495    HZ3  TRP  60           HZ3      TRP  60   7.875   7.153  13.645
  496    HH2  TRP  60           HH2      TRP  60   7.194   8.251  15.717
  497    H    ASP  61           H        ASP  61   8.897  10.828   8.172
  498    HA   ASP  61           HA       ASP  61   8.056  10.438   5.411
  499    HB2  ASP  61           2HB      ASP  61   8.547  12.900   5.890
  500    HB3  ASP  61           1HB      ASP  61  10.176  12.397   6.291
  501    H    LEU  62           H        LEU  62  10.117  10.136   4.353
  502    HA   LEU  62           HA       LEU  62  11.835   8.451   6.009
  503    HB2  LEU  62           2HB      LEU  62  11.554   6.453   4.763
  504    HB3  LEU  62           1HB      LEU  62  10.011   7.151   5.234
  505    HG   LEU  62           HG       LEU  62  11.115   7.353   2.410
  506   HD11  LEU  62          1HD1      LEU  62   9.568   5.578   1.824
  507   HD12  LEU  62          2HD1      LEU  62   9.092   5.426   3.514
  508   HD13  LEU  62          3HD1      LEU  62  10.729   5.016   3.029
  509   HD21  LEU  62          3HD2      LEU  62   8.823   7.917   1.805
  510   HD22  LEU  62          1HD2      LEU  62   9.429   9.054   3.007
  511   HD23  LEU  62          2HD2      LEU  62   8.318   7.770   3.489
  512    H    MET  63           H        MET  63  13.555   7.324   4.475
  513    HA   MET  63           HA       MET  63  14.702   9.468   2.793
  514    HB2  MET  63           2HB      MET  63  15.721   9.178   5.118
  515    HB3  MET  63           1HB      MET  63  16.171   7.559   4.593
  516    HG2  MET  63           2HG      MET  63  17.636   8.463   2.887
  517    HG3  MET  63           1HG      MET  63  17.127  10.104   3.274
  518    HE1  MET  63           3HE      MET  63  17.788  11.367   5.538
  519    HE2  MET  63           1HE      MET  63  18.686  10.607   6.850
  520    HE3  MET  63           2HE      MET  63  17.055  10.063   6.470
  521    H    GLU  64           H        GLU  64  13.078   7.132   2.196
  522    HA   GLU  64           HA       GLU  64  14.965   5.445   0.717
  523    HB2  GLU  64           2HB      GLU  64  14.080   4.538   2.885
  524    HB3  GLU  64           1HB      GLU  64  12.475   4.606   2.195
  525    HG2  GLU  64           2HG      GLU  64  13.365   3.064   0.370
  526    HG3  GLU  64           1HG      GLU  64  14.757   2.814   1.432
  Start of MODEL    6
    1    HA   MET   1           HA       MET   1   5.525 -10.393   3.179
    2    HB2  MET   1           2HB      MET   1   4.298 -13.051   2.377
    3    HB3  MET   1           1HB      MET   1   4.720 -12.623   4.026
    4    HG2  MET   1           2HG      MET   1   3.099 -10.809   3.986
    5    HG3  MET   1           1HG      MET   1   2.701 -11.191   2.311
    6    HE1  MET   1           2HE      MET   1   0.544 -10.964   4.699
    7    HE2  MET   1           3HE      MET   1  -0.487 -12.341   4.311
    8    HE3  MET   1           1HE      MET   1   0.120 -11.303   3.021
    9    H    SER   2           H        SER   2   7.454 -10.757   4.033
   10    HA   SER   2           HA       SER   2   9.005 -13.015   3.854
   11    HB2  SER   2           2HB      SER   2   9.338 -12.367   1.442
   12    HB3  SER   2           1HB      SER   2   9.872 -10.773   1.957
   13    HG   SER   2           HG       SER   2  11.163 -13.168   2.747
   14    H    ALA   3           H        ALA   3   9.488  -9.530   3.528
   15    HA   ALA   3           HA       ALA   3  10.572  -9.398   6.276
   16    HB1  ALA   3           1HB      ALA   3  11.002  -7.546   3.917
   17    HB2  ALA   3           2HB      ALA   3  12.180  -8.728   4.488
   18    HB3  ALA   3           3HB      ALA   3  11.714  -7.378   5.522
   19    H    GLU   4           H        GLU   4  10.252  -7.150   7.082
   20    HA   GLU   4           HA       GLU   4   7.401  -6.915   7.150
   21    HB2  GLU   4           2HB      GLU   4   8.121  -5.485   9.286
   22    HB3  GLU   4           1HB      GLU   4   8.055  -7.252   9.226
   23    HG2  GLU   4           2HG      GLU   4  10.054  -6.359  10.433
   24    HG3  GLU   4           1HG      GLU   4  10.400  -7.478   9.128
   25    H    THR   5           H        THR   5  10.235  -4.903   6.737
   26    HA   THR   5           HA       THR   5   9.069  -2.425   6.517
   27    HB   THR   5           HB       THR   5  11.192  -2.067   5.013
   28    HG1  THR   5           HG1      THR   5  11.962  -4.434   6.366
   29   HG21  THR   5          3HG2      THR   5  12.562  -1.916   7.066
   30   HG22  THR   5          1HG2      THR   5  11.349  -2.854   7.937
   31   HG23  THR   5          2HG2      THR   5  10.951  -1.249   7.322
   32    H    GLN   6           H        GLN   6   9.198  -4.965   4.209
   33    HA   GLN   6           HA       GLN   6   8.761  -3.374   1.889
   34    HB2  GLN   6           2HB      GLN   6   8.275  -5.425   0.687
   35    HB3  GLN   6           1HB      GLN   6   9.619  -5.684   1.796
   36    HG2  GLN   6           2HG      GLN   6   8.194  -6.874   3.333
   37    HG3  GLN   6           1HG      GLN   6   6.782  -6.522   2.346
   38   HE21  GLN   6          2HE2      GLN   6   9.410  -8.952   0.404
   39   HE22  GLN   6          1HE2      GLN   6   9.887  -7.419   1.005
   40    H    MET   7           H        MET   7   6.601  -4.667   4.317
   41    HA   MET   7           HA       MET   7   4.348  -4.095   2.612
   42    HB2  MET   7           2HB      MET   7   2.899  -5.081   4.277
   43    HB3  MET   7           1HB      MET   7   4.269  -6.140   4.016
   44    HG2  MET   7           2HG      MET   7   5.259  -5.246   6.127
   45    HG3  MET   7           1HG      MET   7   3.769  -4.337   6.379
   46    HE1  MET   7           3HE      MET   7   4.391  -8.019   4.980
   47    HE2  MET   7           1HE      MET   7   4.118  -8.942   6.455
   48    HE3  MET   7           2HE      MET   7   5.486  -7.837   6.350
   49    H    GLU   8           H        GLU   8   6.075  -2.786   5.203
   50    HA   GLU   8           HA       GLU   8   4.236  -0.786   5.926
   51    HB2  GLU   8           2HB      GLU   8   7.217  -0.899   6.263
   52    HB3  GLU   8           1HB      GLU   8   6.078   0.102   7.168
   53    HG2  GLU   8           2HG      GLU   8   6.207  -2.902   7.224
   54    HG3  GLU   8           1HG      GLU   8   6.795  -1.815   8.483
   55    H    ARG   9           H        ARG   9   7.032  -0.996   3.792
   56    HA   ARG   9           HA       ARG   9   6.978   1.669   2.984
   57    HB2  ARG   9           2HB      ARG   9   8.955   0.481   2.439
   58    HB3  ARG   9           1HB      ARG   9   8.066  -0.810   1.654
   59    HG2  ARG   9           2HG      ARG   9   9.268   0.568   0.031
   60    HG3  ARG   9           1HG      ARG   9   7.530   0.658  -0.210
   61    HD2  ARG   9           2HD      ARG   9   8.414   2.849  -0.489
   62    HD3  ARG   9           1HD      ARG   9   7.548   2.826   1.038
   63    HE   ARG   9           HE       ARG   9   9.899   2.471   2.005
   64   HH11  ARG   9          1HH1      ARG   9   9.136   4.456  -0.883
   65   HH12  ARG   9          2HH1      ARG   9  10.476   5.510  -0.627
   66   HH21  ARG   9          2HH2      ARG   9  11.857   5.333   1.161
   67   HH22  ARG   9          1HH2      ARG   9  11.722   4.041   2.267
   68    H    LYS  10           H        LYS  10   5.199  -1.118   1.621
   69    HA   LYS  10           HA       LYS  10   4.241   0.435  -0.542
   70    HB2  LYS  10           2HB      LYS  10   2.422  -1.240  -0.815
   71    HB3  LYS  10           1HB      LYS  10   4.018  -1.972  -0.706
   72    HG2  LYS  10           2HG      LYS  10   3.651  -2.660   1.494
   73    HG3  LYS  10           1HG      LYS  10   2.212  -1.668   1.643
   74    HD2  LYS  10           2HD      LYS  10   1.023  -3.091   0.097
   75    HD3  LYS  10           1HD      LYS  10   2.486  -4.047  -0.182
   76    HE2  LYS  10           2HE      LYS  10   0.895  -5.084   1.453
   77    HE3  LYS  10           1HE      LYS  10   2.527  -4.795   2.064
   78    HZ1  LYS  10           3HZ      LYS  10   0.821  -4.152   3.695
   79    HZ2  LYS  10           1HZ      LYS  10   0.188  -3.020   2.608
   80    HZ3  LYS  10           2HZ      LYS  10   1.754  -2.844   3.231
   81    H    ILE  11           H        ILE  11   3.013   0.166   2.835
   82    HA   ILE  11           HA       ILE  11   0.578   1.433   2.055
   83    HB   ILE  11           HB       ILE  11   0.120   1.656   4.449
   84   HG12  ILE  11          2HG1      ILE  11   2.912   0.553   4.705
   85   HG13  ILE  11          1HG1      ILE  11   2.256   2.017   5.414
   86   HG21  ILE  11          1HG2      ILE  11   1.164  -0.983   3.544
   87   HG22  ILE  11          2HG2      ILE  11  -0.468  -0.366   3.228
   88   HG23  ILE  11          3HG2      ILE  11   0.028  -0.795   4.884
   89   HD11  ILE  11          3HD1      ILE  11   0.827   0.592   6.857
   90   HD12  ILE  11          1HD1      ILE  11   2.580   0.342   7.080
   91   HD13  ILE  11          2HD1      ILE  11   1.652  -0.790   6.099
   92    H    ILE  12           H        ILE  12   3.591   2.542   3.495
   93    HA   ILE  12           HA       ILE  12   2.526   5.167   3.723
   94    HB   ILE  12           HB       ILE  12   4.523   5.901   4.594
   95   HG12  ILE  12          2HG1      ILE  12   6.616   4.124   4.198
   96   HG13  ILE  12          1HG1      ILE  12   5.768   4.101   2.680
   97   HG21  ILE  12          1HG2      ILE  12   3.617   4.304   6.083
   98   HG22  ILE  12          2HG2      ILE  12   5.377   4.250   6.166
   99   HG23  ILE  12          3HG2      ILE  12   4.496   2.998   5.290
  100   HD11  ILE  12          3HD1      ILE  12   6.773   6.668   3.947
  101   HD12  ILE  12          1HD1      ILE  12   5.860   6.571   2.461
  102   HD13  ILE  12          2HD1      ILE  12   7.469   5.880   2.536
  103    H    ASP  13           H        ASP  13   4.194   3.373   1.237
  104    HA   ASP  13           HA       ASP  13   5.161   5.565  -0.262
  105    HB2  ASP  13           2HB      ASP  13   5.567   2.942  -0.531
  106    HB3  ASP  13           1HB      ASP  13   4.229   3.083  -1.666
  107    H    PHE  14           H        PHE  14   2.135   3.856  -0.184
  108    HA   PHE  14           HA       PHE  14   0.911   5.245  -2.269
  109    HB2  PHE  14           2HB      PHE  14  -0.141   3.243  -1.532
  110    HB3  PHE  14           1HB      PHE  14  -0.125   3.767   0.142
  111    HD1  PHE  14           HD1      PHE  14  -1.790   5.154   1.003
  112    HD2  PHE  14           HD2      PHE  14  -1.823   4.083  -3.089
  113    HE1  PHE  14           HE1      PHE  14  -4.111   5.934   0.848
  114    HE2  PHE  14           HE2      PHE  14  -4.156   4.868  -3.292
  115    HZ   PHE  14           HZ       PHE  14  -5.310   5.796  -1.319
  116    H    LEU  15           H        LEU  15   0.865   5.792   1.205
  117    HA   LEU  15           HA       LEU  15  -0.570   8.164   1.354
  118    HB2  LEU  15           2HB      LEU  15  -0.193   7.398   3.316
  119    HB3  LEU  15           1HB      LEU  15   1.394   6.703   2.965
  120    HG   LEU  15           HG       LEU  15   1.993   9.280   2.881
  121   HD11  LEU  15          1HD1      LEU  15  -0.062  10.134   3.216
  122   HD12  LEU  15          2HD1      LEU  15   0.932  10.540   4.629
  123   HD13  LEU  15          3HD1      LEU  15  -0.309   9.266   4.735
  124   HD21  LEU  15          3HD2      LEU  15   3.120   7.717   4.121
  125   HD22  LEU  15          1HD2      LEU  15   1.866   7.618   5.369
  126   HD23  LEU  15          2HD2      LEU  15   2.808   9.121   5.157
  127    H    ARG  16           H        ARG  16   2.747   7.541   0.875
  128    HA   ARG  16           HA       ARG  16   3.721  10.117   0.942
  129    HB2  ARG  16           2HB      ARG  16   5.763   9.054   0.697
  130    HB3  ARG  16           1HB      ARG  16   4.730   7.640   0.591
  131    HG2  ARG  16           2HG      ARG  16   4.902   7.449  -1.686
  132    HG3  ARG  16           1HG      ARG  16   5.494   9.101  -1.887
  133    HD2  ARG  16           2HD      ARG  16   7.604   8.581  -1.096
  134    HD3  ARG  16           1HD      ARG  16   7.026   7.158  -0.230
  135    HE   ARG  16           HE       ARG  16   6.609   6.281  -2.590
  136   HH11  ARG  16          1HH1      ARG  16   9.251   8.596  -2.146
  137   HH12  ARG  16          2HH1      ARG  16  10.442   7.570  -2.743
  138   HH21  ARG  16          2HH2      ARG  16   9.813   5.413  -3.674
  139   HH22  ARG  16          1HH2      ARG  16   8.169   4.916  -3.466
  140    H    GLN  17           H        GLN  17   2.244   8.358  -1.511
  141    HA   GLN  17           HA       GLN  17   2.777  10.307  -3.587
  142    HB2  GLN  17           2HB      GLN  17   1.226   7.734  -3.546
  143    HB3  GLN  17           1HB      GLN  17   1.152   8.827  -4.924
  144    HG2  GLN  17           2HG      GLN  17   3.487   8.592  -5.340
  145    HG3  GLN  17           1HG      GLN  17   3.727   7.722  -3.827
  146   HE21  GLN  17          2HE2      GLN  17   2.878   4.640  -5.118
  147   HE22  GLN  17          1HE2      GLN  17   3.280   5.598  -3.734
  148    H    ASN  18           H        ASN  18   0.445   9.807  -1.145
  149    HA   ASN  18           HA       ASN  18  -1.468  11.640  -2.372
  150    HB2  ASN  18           2HB      ASN  18  -1.314  10.633   0.495
  151    HB3  ASN  18           1HB      ASN  18  -2.691  11.429  -0.256
  152   HD21  ASN  18          2HD2      ASN  18  -2.903   8.315  -2.372
  153   HD22  ASN  18          1HD2      ASN  18  -2.371   9.923  -2.759
  154    H    GLY  19           H        GLY  19   0.869  11.469   0.151
  155    HA2  GLY  19           2HA      GLY  19   2.334  13.606  -0.006
  156    HA3  GLY  19           1HA      GLY  19   0.854  14.324   0.624
  157    H    LYS  20           H        LYS  20   3.588  12.077   1.402
  158    HA   LYS  20           HA       LYS  20   3.299  11.298   3.868
  159    HB2  LYS  20           2HB      LYS  20   5.589  12.209   4.353
  160    HB3  LYS  20           1HB      LYS  20   5.443  11.094   3.005
  161    HG2  LYS  20           2HG      LYS  20   5.373  14.048   2.515
  162    HG3  LYS  20           1HG      LYS  20   6.930  13.308   2.898
  163    HD2  LYS  20           2HD      LYS  20   5.098  12.579   0.584
  164    HD3  LYS  20           1HD      LYS  20   6.583  13.517   0.470
  165    HE2  LYS  20           2HE      LYS  20   6.420  10.657   1.433
  166    HE3  LYS  20           1HE      LYS  20   6.882  11.142  -0.196
  167    HZ1  LYS  20           3HZ      LYS  20   8.575  10.599   1.647
  168    HZ2  LYS  20           1HZ      LYS  20   8.392  12.180   2.120
  169    HZ3  LYS  20           2HZ      LYS  20   8.937  11.803   0.530
  170    H    SER  21           H        SER  21   3.392  12.102   6.062
  171    HA   SER  21           HA       SER  21   3.258  14.813   6.698
  172    HB2  SER  21           2HB      SER  21   1.268  14.763   5.167
  173    HB3  SER  21           1HB      SER  21   0.545  13.527   6.185
  174    HG   SER  21           HG       SER  21   0.544  16.194   6.439
  175    H    ILE  22           H        ILE  22   1.200  14.590   8.618
  176    HA   ILE  22           HA       ILE  22   2.625  13.029  10.574
  177    HB   ILE  22           HB       ILE  22   0.993  13.916  12.216
  178   HG12  ILE  22          2HG1      ILE  22  -0.170  15.408   9.839
  179   HG13  ILE  22          1HG1      ILE  22  -0.956  14.084  10.683
  180   HG21  ILE  22          1HG2      ILE  22   1.720  16.266  12.078
  181   HG22  ILE  22          2HG2      ILE  22   2.279  15.979  10.430
  182   HG23  ILE  22          3HG2      ILE  22   3.039  15.135  11.777
  183   HD11  ILE  22          3HD1      ILE  22  -0.260  16.766  11.863
  184   HD12  ILE  22          1HD1      ILE  22  -1.063  15.444  12.709
  185   HD13  ILE  22          2HD1      ILE  22  -1.864  16.237  11.352
  186    H    ALA  23           H        ALA  23   1.282  11.797  12.188
  187    HA   ALA  23           HA       ALA  23   0.390   9.415  11.080
  188    HB1  ALA  23           1HB      ALA  23   1.280   9.664  13.341
  189    HB2  ALA  23           2HB      ALA  23  -0.271   8.816  13.329
  190    HB3  ALA  23           3HB      ALA  23  -0.195  10.517  13.798
  191    H    LEU  24           H        LEU  24  -1.405  12.284  11.736
  192    HA   LEU  24           HA       LEU  24  -3.969  11.011  12.001
  193    HB2  LEU  24           2HB      LEU  24  -3.323  13.232  13.038
  194    HB3  LEU  24           1HB      LEU  24  -3.312  13.920  11.438
  195    HG   LEU  24           HG       LEU  24  -5.310  14.507  12.813
  196   HD11  LEU  24          1HD1      LEU  24  -5.958  12.994  10.299
  197   HD12  LEU  24          2HD1      LEU  24  -5.488  14.689  10.415
  198   HD13  LEU  24          3HD1      LEU  24  -7.015  14.147  11.112
  199   HD21  LEU  24          3HD2      LEU  24  -5.580  12.408  14.004
  200   HD22  LEU  24          1HD2      LEU  24  -6.018  11.594  12.502
  201   HD23  LEU  24          2HD2      LEU  24  -7.067  12.848  13.165
  202    H    THR  25           H        THR  25  -2.094  12.616   9.489
  203    HA   THR  25           HA       THR  25  -4.055  12.714   7.527
  204    HB   THR  25           HB       THR  25  -1.096  12.450   7.187
  205    HG1  THR  25           HG1      THR  25  -0.961  14.591   7.671
  206   HG21  THR  25          3HG2      THR  25  -1.508  13.686   5.123
  207   HG22  THR  25          1HG2      THR  25  -3.219  13.881   5.580
  208   HG23  THR  25          2HG2      THR  25  -2.599  12.287   5.242
  209    H    ILE  26           H        ILE  26  -1.419  10.436   8.184
  210    HA   ILE  26           HA       ILE  26  -1.666   8.744   6.036
  211    HB   ILE  26           HB       ILE  26  -1.123   7.659   8.829
  212   HG12  ILE  26          2HG1      ILE  26   0.806   8.941   6.848
  213   HG13  ILE  26          1HG1      ILE  26   0.288   9.678   8.353
  214   HG21  ILE  26          1HG2      ILE  26   0.214   6.024   7.573
  215   HG22  ILE  26          2HG2      ILE  26  -0.329   6.795   6.065
  216   HG23  ILE  26          3HG2      ILE  26  -1.500   6.028   7.134
  217   HD11  ILE  26          3HD1      ILE  26   1.908   7.154   8.079
  218   HD12  ILE  26          1HD1      ILE  26   1.389   7.879   9.601
  219   HD13  ILE  26          2HD1      ILE  26   2.513   8.742   8.552
  220    H    ALA  27           H        ALA  27  -3.487   8.615   9.034
  221    HA   ALA  27           HA       ALA  27  -4.963   6.311   8.509
  222    HB1  ALA  27           1HB      ALA  27  -4.817   7.379  10.699
  223    HB2  ALA  27           2HB      ALA  27  -6.493   7.107  10.213
  224    HB3  ALA  27           3HB      ALA  27  -5.791   8.726  10.108
  225    H    LYS  28           H        LYS  28  -5.651   9.777   7.635
  226    HA   LYS  28           HA       LYS  28  -8.170   9.312   6.656
  227    HB2  LYS  28           2HB      LYS  28  -6.713  11.393   7.404
  228    HB3  LYS  28           1HB      LYS  28  -6.433  11.449   5.669
  229    HG2  LYS  28           2HG      LYS  28  -9.012  11.030   5.699
  230    HG3  LYS  28           1HG      LYS  28  -8.741  11.843   7.263
  231    HD2  LYS  28           2HD      LYS  28  -9.129  13.715   5.855
  232    HD3  LYS  28           1HD      LYS  28  -7.376  13.566   5.835
  233    HE2  LYS  28           2HE      LYS  28  -9.317  12.631   3.691
  234    HE3  LYS  28           1HE      LYS  28  -8.191  13.971   3.571
  235    HZ1  LYS  28           3HZ      LYS  28  -7.500  11.054   3.610
  236    HZ2  LYS  28           1HZ      LYS  28  -6.360  12.263   3.752
  237    HZ3  LYS  28           2HZ      LYS  28  -7.200  12.154   2.377
  238    H    GLU  29           H        GLU  29  -4.937   9.074   5.315
  239    HA   GLU  29           HA       GLU  29  -5.880   9.286   2.608
  240    HB2  GLU  29           2HB      GLU  29  -3.156   8.328   3.491
  241    HB3  GLU  29           1HB      GLU  29  -3.604   8.941   1.911
  242    HG2  GLU  29           2HG      GLU  29  -3.140  10.408   4.461
  243    HG3  GLU  29           1HG      GLU  29  -2.444  10.700   2.877
  244    H    ILE  30           H        ILE  30  -4.929   6.784   4.791
  245    HA   ILE  30           HA       ILE  30  -5.262   4.816   2.660
  246    HB   ILE  30           HB       ILE  30  -4.480   3.102   4.263
  247   HG12  ILE  30          2HG1      ILE  30  -4.149   5.444   6.159
  248   HG13  ILE  30          1HG1      ILE  30  -5.268   4.108   6.369
  249   HG21  ILE  30          1HG2      ILE  30  -2.143   3.882   4.396
  250   HG22  ILE  30          2HG2      ILE  30  -2.686   5.510   3.993
  251   HG23  ILE  30          3HG2      ILE  30  -2.880   4.203   2.825
  252   HD11  ILE  30          3HD1      ILE  30  -3.351   3.839   7.815
  253   HD12  ILE  30          1HD1      ILE  30  -2.258   3.960   6.433
  254   HD13  ILE  30          2HD1      ILE  30  -3.341   2.581   6.577
  255    H    GLY  31           H        GLY  31  -7.090   6.208   5.076
  256    HA2  GLY  31           2HA      GLY  31  -9.320   5.953   5.562
  257    HA3  GLY  31           1HA      GLY  31  -9.384   4.657   4.373
  258    H    LEU  32           H        LEU  32  -7.123   4.656   7.001
  259    HA   LEU  32           HA       LEU  32  -8.608   2.369   8.107
  260    HB2  LEU  32           2HB      LEU  32  -5.600   2.641   8.203
  261    HB3  LEU  32           1HB      LEU  32  -6.552   1.270   8.705
  262    HG   LEU  32           HG       LEU  32  -5.877   2.164   5.921
  263   HD11  LEU  32          1HD1      LEU  32  -4.242   0.782   7.017
  264   HD12  LEU  32          2HD1      LEU  32  -5.004  -0.081   5.684
  265   HD13  LEU  32          3HD1      LEU  32  -5.469  -0.440   7.345
  266   HD21  LEU  32          3HD2      LEU  32  -7.986   0.144   6.696
  267   HD22  LEU  32          1HD2      LEU  32  -7.294   0.350   5.069
  268   HD23  LEU  32          2HD2      LEU  32  -8.172   1.675   5.813
  269    H    ASP  33           H        ASP  33  -7.699   1.872  10.357
  270    HA   ASP  33           HA       ASP  33  -8.331   4.017  12.044
  271    HB2  ASP  33           2HB      ASP  33  -8.880   2.081  13.108
  272    HB3  ASP  33           1HB      ASP  33  -7.549   1.186  12.392
  273    H    LYS  34           H        LYS  34  -7.191   5.181  13.417
  274    HA   LYS  34           HA       LYS  34  -4.689   6.206  12.562
  275    HB2  LYS  34           2HB      LYS  34  -4.810   7.573  14.627
  276    HB3  LYS  34           1HB      LYS  34  -6.249   7.665  13.630
  277    HG2  LYS  34           2HG      LYS  34  -7.576   6.604  15.153
  278    HG3  LYS  34           1HG      LYS  34  -6.261   5.619  15.778
  279    HD2  LYS  34           2HD      LYS  34  -6.586   8.575  16.312
  280    HD3  LYS  34           1HD      LYS  34  -7.133   7.300  17.402
  281    HE2  LYS  34           2HE      LYS  34  -4.262   7.773  16.531
  282    HE3  LYS  34           1HE      LYS  34  -4.955   8.180  18.092
  283    HZ1  LYS  34           3HZ      LYS  34  -4.943   5.386  17.080
  284    HZ2  LYS  34           1HZ      LYS  34  -5.186   5.901  18.649
  285    HZ3  LYS  34           2HZ      LYS  34  -3.646   6.010  17.919
  286    H    SER  35           H        SER  35  -5.550   3.717  14.840
  287    HA   SER  35           HA       SER  35  -3.173   4.014  16.456
  288    HB2  SER  35           2HB      SER  35  -5.190   1.770  16.463
  289    HB3  SER  35           1HB      SER  35  -4.182   2.334  17.806
  290    HG   SER  35           HG       SER  35  -6.504   3.321  16.743
  291    H    THR  36           H        THR  36  -4.497   2.041  13.915
  292    HA   THR  36           HA       THR  36  -2.573   0.217  13.561
  293    HB   THR  36           HB       THR  36  -4.601   1.703  11.983
  294    HG1  THR  36           HG1      THR  36  -5.472   0.284  13.294
  295   HG21  THR  36          3HG2      THR  36  -2.833  -0.474  10.944
  296   HG22  THR  36          1HG2      THR  36  -2.908   1.238  10.474
  297   HG23  THR  36          2HG2      THR  36  -4.309   0.180  10.150
  298    H    VAL  37           H        VAL  37  -2.926   3.531  12.093
  299    HA   VAL  37           HA       VAL  37  -0.577   3.684  10.717
  300    HB   VAL  37           HB       VAL  37  -2.036   5.760  12.302
  301   HG11  VAL  37          1HG1      VAL  37  -0.033   6.134  10.070
  302   HG12  VAL  37          2HG1      VAL  37   0.194   6.523  11.778
  303   HG13  VAL  37          3HG1      VAL  37  -0.981   7.422  10.828
  304   HG21  VAL  37          3HG2      VAL  37  -3.054   6.358  10.120
  305   HG22  VAL  37          1HG2      VAL  37  -3.466   4.732  10.670
  306   HG23  VAL  37          2HG2      VAL  37  -2.251   4.957   9.413
  307    H    ASN  38           H        ASN  38  -1.225   4.520  14.117
  308    HA   ASN  38           HA       ASN  38   1.279   5.435  14.917
  309    HB2  ASN  38           2HB      ASN  38  -0.749   3.854  16.528
  310    HB3  ASN  38           1HB      ASN  38   0.641   4.680  17.208
  311   HD21  ASN  38          2HD2      ASN  38  -0.987   7.851  15.938
  312   HD22  ASN  38          1HD2      ASN  38   0.322   6.878  15.352
  313    H    ARG  39           H        ARG  39   0.028   2.200  14.966
  314    HA   ARG  39           HA       ARG  39   2.107   0.783  16.123
  315    HB2  ARG  39           2HB      ARG  39  -0.017  -0.172  15.740
  316    HB3  ARG  39           1HB      ARG  39   0.056   0.193  14.024
  317    HG2  ARG  39           2HG      ARG  39   2.027  -1.241  13.977
  318    HG3  ARG  39           1HG      ARG  39   1.534  -1.880  15.550
  319    HD2  ARG  39           2HD      ARG  39   0.088  -1.941  12.906
  320    HD3  ARG  39           1HD      ARG  39   0.568  -3.349  13.864
  321    HE   ARG  39           HE       ARG  39  -1.138  -2.388  15.514
  322   HH11  ARG  39          1HH1      ARG  39  -1.431  -2.265  11.950
  323   HH12  ARG  39          2HH1      ARG  39  -3.116  -2.097  11.963
  324   HH21  ARG  39          2HH2      ARG  39  -4.322  -1.978  13.969
  325   HH22  ARG  39          1HH2      ARG  39  -3.553  -2.138  15.477
  326    H    HIS  40           H        HIS  40   1.403   1.453  12.822
  327    HA   HIS  40           HA       HIS  40   3.612   0.016  11.769
  328    HB2  HIS  40           2HB      HIS  40   1.641   1.885  10.510
  329    HB3  HIS  40           1HB      HIS  40   2.958   1.166   9.596
  330    HD1  HIS  40           HD1      HIS  40   2.804  -1.537   9.321
  331    HD2  HIS  40           HD2      HIS  40  -0.513   0.244  11.065
  332    HE1  HIS  40           HE1      HIS  40   0.998  -3.286   9.334
  333    H    LEU  41           H        LEU  41   3.115   3.335  12.548
  334    HA   LEU  41           HA       LEU  41   5.545   4.084  11.267
  335    HB2  LEU  41           2HB      LEU  41   5.274   6.291  12.300
  336    HB3  LEU  41           1HB      LEU  41   3.872   5.797  11.376
  337    HG   LEU  41           HG       LEU  41   2.959   5.109  13.721
  338   HD11  LEU  41          1HD1      LEU  41   4.952   5.468  14.997
  339   HD12  LEU  41          2HD1      LEU  41   3.665   6.549  15.531
  340   HD13  LEU  41          3HD1      LEU  41   4.988   7.175  14.531
  341   HD21  LEU  41          3HD2      LEU  41   1.967   7.279  13.949
  342   HD22  LEU  41          1HD2      LEU  41   2.042   6.696  12.287
  343   HD23  LEU  41          2HD2      LEU  41   3.179   7.951  12.829
  344    H    TYR  42           H        TYR  42   4.634   3.008  14.462
  345    HA   TYR  42           HA       TYR  42   6.819   3.932  15.820
  346    HB2  TYR  42           2HB      TYR  42   4.644   2.108  16.037
  347    HB3  TYR  42           1HB      TYR  42   5.967   1.638  17.018
  348    HD1  TYR  42           HD1      TYR  42   6.845   4.499  17.726
  349    HD2  TYR  42           HD2      TYR  42   3.051   2.679  17.547
  350    HE1  TYR  42           HE1      TYR  42   6.007   6.152  19.366
  351    HE2  TYR  42           HE2      TYR  42   2.160   4.319  19.184
  352    HH   TYR  42           HH       TYR  42   3.846   7.131  20.046
  353    H    ASN  43           H        ASN  43   6.184   1.137  14.033
  354    HA   ASN  43           HA       ASN  43   8.633  -0.167  14.854
  355    HB2  ASN  43           2HB      ASN  43   8.187  -2.067  13.489
  356    HB3  ASN  43           1HB      ASN  43   6.628  -1.541  14.112
  357   HD21  ASN  43          2HD2      ASN  43   5.276  -1.134  10.937
  358   HD22  ASN  43          1HD2      ASN  43   5.032  -1.015  12.647
  359    H    LEU  44           H        LEU  44   7.604   1.506  11.974
  360    HA   LEU  44           HA       LEU  44  10.106   1.256  10.641
  361    HB2  LEU  44           2HB      LEU  44   8.174   3.558  10.271
  362    HB3  LEU  44           1HB      LEU  44   9.454   3.069   9.244
  363    HG   LEU  44           HG       LEU  44   7.049   1.375   9.767
  364   HD11  LEU  44          1HD1      LEU  44   6.439   1.993   7.452
  365   HD12  LEU  44          2HD1      LEU  44   7.852   3.034   7.367
  366   HD13  LEU  44          3HD1      LEU  44   6.549   3.415   8.487
  367   HD21  LEU  44          3HD2      LEU  44   9.077   0.085   9.291
  368   HD22  LEU  44          1HD2      LEU  44   9.371   1.059   7.852
  369   HD23  LEU  44          2HD2      LEU  44   7.959   0.011   7.940
  370    H    GLN  45           H        GLN  45   8.867   3.512  13.009
  371    HA   GLN  45           HA       GLN  45  10.826   5.355  12.966
  372    HB2  GLN  45           2HB      GLN  45   8.718   4.432  14.544
  373    HB3  GLN  45           1HB      GLN  45   9.976   4.918  15.604
  374    HG2  GLN  45           2HG      GLN  45  10.028   6.908  13.872
  375    HG3  GLN  45           1HG      GLN  45   8.383   6.342  13.582
  376   HE21  GLN  45          2HE2      GLN  45   8.748   8.841  16.188
  377   HE22  GLN  45          1HE2      GLN  45   9.443   8.601  14.602
  378    H    ARG  46           H        ARG  46  10.664   2.138  14.347
  379    HA   ARG  46           HA       ARG  46  12.996   2.403  16.015
  380    HB2  ARG  46           2HB      ARG  46  11.799  -0.152  14.948
  381    HB3  ARG  46           1HB      ARG  46  12.949  -0.022  16.259
  382    HG2  ARG  46           2HG      ARG  46  10.051   0.784  16.245
  383    HG3  ARG  46           1HG      ARG  46  10.813  -0.489  17.192
  384    HD2  ARG  46           2HD      ARG  46  10.767   1.089  18.821
  385    HD3  ARG  46           1HD      ARG  46  12.232   1.636  17.997
  386    HE   ARG  46           HE       ARG  46   9.878   2.764  16.888
  387   HH11  ARG  46          1HH1      ARG  46  12.287   3.157  19.441
  388   HH12  ARG  46          2HH1      ARG  46  11.939   4.788  19.781
  389   HH21  ARG  46          2HH2      ARG  46  10.184   5.896  18.548
  390   HH22  ARG  46          1HH2      ARG  46   9.317   5.072  17.368
  391    H    SER  47           H        SER  47  12.358   1.456  12.749
  392    HA   SER  47           HA       SER  47  15.087   0.579  12.387
  393    HB2  SER  47           2HB      SER  47  14.144  -0.132  10.123
  394    HB3  SER  47           1HB      SER  47  13.551  -0.982  11.551
  395    HG   SER  47           HG       SER  47  11.717  -0.478  10.627
  396    H    ASN  48           H        ASN  48  13.668   3.588  12.322
  397    HA   ASN  48           HA       ASN  48  14.097   5.501  11.370
  398    HB2  ASN  48           2HB      ASN  48  16.615   4.039  10.659
  399    HB3  ASN  48           1HB      ASN  48  16.385   5.720  10.172
  400   HD21  ASN  48          2HD2      ASN  48  18.096   5.302  13.515
  401   HD22  ASN  48          1HD2      ASN  48  18.314   4.493  11.990
  402    H    GLN  49           H        GLN  49  12.453   3.704   9.956
  403    HA   GLN  49           HA       GLN  49  13.096   4.382   7.164
  404    HB2  GLN  49           2HB      GLN  49  12.352   1.933   8.066
  405    HB3  GLN  49           1HB      GLN  49  10.756   2.627   7.900
  406    HG2  GLN  49           2HG      GLN  49  12.603   2.727   5.546
  407    HG3  GLN  49           1HG      GLN  49  11.888   1.193   5.974
  408   HE21  GLN  49          2HE2      GLN  49   9.081   3.956   4.882
  409   HE22  GLN  49          1HE2      GLN  49  10.172   4.333   6.147
  410    H    VAL  50           H        VAL  50  11.236   5.033   9.921
  411    HA   VAL  50           HA       VAL  50  10.138   7.269   8.545
  412    HB   VAL  50           HB       VAL  50   8.423   5.176   8.756
  413   HG11  VAL  50          1HG1      VAL  50   8.695   5.155  11.180
  414   HG12  VAL  50          2HG1      VAL  50   6.999   5.338  10.659
  415   HG13  VAL  50          3HG1      VAL  50   7.909   6.729  11.266
  416   HG21  VAL  50          3HG2      VAL  50   7.930   7.213   7.609
  417   HG22  VAL  50          1HG2      VAL  50   7.694   8.068   9.134
  418   HG23  VAL  50          2HG2      VAL  50   6.577   6.784   8.659
  419    H    PHE  51           H        PHE  51  10.123   8.777   9.757
  420    HA   PHE  51           HA       PHE  51   9.796   8.971  12.519
  421    HB2  PHE  51           2HB      PHE  51  12.104  10.044  13.048
  422    HB3  PHE  51           1HB      PHE  51  12.092   8.302  12.830
  423    HD1  PHE  51           HD1      PHE  51  13.172   7.268  11.024
  424    HD2  PHE  51           HD2      PHE  51  13.221  11.488  11.391
  425    HE1  PHE  51           HE1      PHE  51  14.987   7.346   9.429
  426    HE2  PHE  51           HE2      PHE  51  15.061  11.611   9.755
  427    HZ   PHE  51           HZ       PHE  51  15.959   9.540   8.760
  428    H    ASN  52           H        ASN  52  10.755  11.628  12.915
  429    HA   ASN  52           HA       ASN  52   9.290  12.850  10.704
  430    HB2  ASN  52           2HB      ASN  52   9.260  14.945  11.892
  431    HB3  ASN  52           1HB      ASN  52   8.482  13.678  12.807
  432   HD21  ASN  52          2HD2      ASN  52  10.830  13.866  15.406
  433   HD22  ASN  52          1HD2      ASN  52   9.609  12.918  14.585
  434    H    SER  53           H        SER  53  10.126  14.389   9.454
  435    HA   SER  53           HA       SER  53  13.014  14.247   9.486
  436    HB2  SER  53           2HB      SER  53  11.148  13.453   7.298
  437    HB3  SER  53           1HB      SER  53  12.891  13.588   7.205
  438    HG   SER  53           HG       SER  53  11.314  11.597   8.309
  439    H    ASN  54           H        ASN  54  13.769  15.275   7.702
  440    HA   ASN  54           HA       ASN  54  14.509  16.895   6.321
  441    HB2  ASN  54           2HB      ASN  54  12.795  15.976   4.907
  442    HB3  ASN  54           1HB      ASN  54  11.591  17.049   5.597
  443   HD21  ASN  54          2HD2      ASN  54  12.348  19.692   3.436
  444   HD22  ASN  54          1HD2      ASN  54  11.331  19.144   4.682
  445    H    GLU  55           H        GLU  55  12.320  18.090   8.705
  446    HA   GLU  55           HA       GLU  55  13.494  20.716   8.494
  447    HB2  GLU  55           2HB      GLU  55  11.267  21.778   7.820
  448    HB3  GLU  55           1HB      GLU  55  12.134  20.877   6.603
  449    HG2  GLU  55           2HG      GLU  55  10.756  18.957   6.955
  450    HG3  GLU  55           1HG      GLU  55   9.770  19.766   8.152
  451    H    LYS  56           H        LYS  56  11.292  22.122   9.570
  452    HA   LYS  56           HA       LYS  56  11.303  20.954  12.167
  453    HB2  LYS  56           2HB      LYS  56  10.860  23.789  11.347
  454    HB3  LYS  56           1HB      LYS  56  10.372  23.231  12.944
  455    HG2  LYS  56           2HG      LYS  56  13.151  22.713  11.941
  456    HG3  LYS  56           1HG      LYS  56  12.729  24.276  12.623
  457    HD2  LYS  56           2HD      LYS  56  13.781  22.770  14.292
  458    HD3  LYS  56           1HD      LYS  56  12.164  23.252  14.754
  459    HE2  LYS  56           2HE      LYS  56  12.604  20.906  15.298
  460    HE3  LYS  56           1HE      LYS  56  11.312  21.021  14.124
  461    HZ1  LYS  56           3HZ      LYS  56  12.862  20.291  12.386
  462    HZ2  LYS  56           1HZ      LYS  56  12.888  19.227  13.667
  463    HZ3  LYS  56           2HZ      LYS  56  14.159  20.314  13.467
  464    HA   PRO  57           HA       PRO  57   6.600  20.896  11.329
  465    HB2  PRO  57           2HB      PRO  57   6.874  20.567   8.358
  466    HB3  PRO  57           1HB      PRO  57   5.551  21.334   9.265
  467    HG2  PRO  57           2HG      PRO  57   7.217  22.840   7.940
  468    HG3  PRO  57           1HG      PRO  57   6.707  23.308   9.578
  469    HD2  PRO  57           2HD      PRO  57   9.284  22.073   8.708
  470    HD3  PRO  57           1HD      PRO  57   8.995  23.378   9.878
  471    HA   PRO  58           HA       PRO  58   8.726  16.925  11.354
  472    HB2  PRO  58           2HB      PRO  58   6.262  15.893  12.593
  473    HB3  PRO  58           1HB      PRO  58   7.903  15.965  13.264
  474    HG2  PRO  58           2HG      PRO  58   5.974  17.533  14.190
  475    HG3  PRO  58           1HG      PRO  58   7.658  18.083  14.066
  476    HD2  PRO  58           2HD      PRO  58   5.354  18.697  12.275
  477    HD3  PRO  58           1HD      PRO  58   6.658  19.747  12.881
  478    H    VAL  59           H        VAL  59   8.774  16.118   9.150
  479    HA   VAL  59           HA       VAL  59   6.196  15.134   8.252
  480    HB   VAL  59           HB       VAL  59   7.689  16.327   6.632
  481   HG11  VAL  59          1HG1      VAL  59   9.347  13.873   6.714
  482   HG12  VAL  59          2HG1      VAL  59   9.838  15.470   7.289
  483   HG13  VAL  59          3HG1      VAL  59   9.539  15.196   5.565
  484   HG21  VAL  59          3HG2      VAL  59   7.292  14.831   4.745
  485   HG22  VAL  59          1HG2      VAL  59   5.896  14.876   5.823
  486   HG23  VAL  59          2HG2      VAL  59   7.017  13.502   5.854
  487    H    TRP  60           H        TRP  60   5.466  13.326   8.743
  488    HA   TRP  60           HA       TRP  60   7.338  11.339   9.627
  489    HB2  TRP  60           2HB      TRP  60   4.307  11.289   9.605
  490    HB3  TRP  60           1HB      TRP  60   5.343  10.009  10.236
  491    HD1  TRP  60           HD1      TRP  60   4.768  13.763  10.872
  492    HE1  TRP  60           HE1      TRP  60   5.015  14.217  13.397
  493    HE3  TRP  60           HE3      TRP  60   6.031   9.069  12.381
  494    HZ2  TRP  60           HZ2      TRP  60   5.668  12.750  15.728
  495    HZ3  TRP  60           HZ3      TRP  60   6.456   8.670  14.771
  496    HH2  TRP  60           HH2      TRP  60   6.276  10.468  16.404
  497    H    ASP  61           H        ASP  61   8.349  10.684   8.114
  498    HA   ASP  61           HA       ASP  61   7.600   8.744   6.350
  499    HB2  ASP  61           2HB      ASP  61   6.497  10.799   5.269
  500    HB3  ASP  61           1HB      ASP  61   8.121  11.414   4.985
  501    H    LEU  62           H        LEU  62   9.587   9.511   4.500
  502    HA   LEU  62           HA       LEU  62  11.888  10.055   6.080
  503    HB2  LEU  62           2HB      LEU  62  13.117   8.127   5.411
  504    HB3  LEU  62           1HB      LEU  62  11.563   7.672   6.083
  505    HG   LEU  62           HG       LEU  62  12.137   7.664   3.114
  506   HD11  LEU  62          1HD1      LEU  62  12.298   5.390   5.081
  507   HD12  LEU  62          2HD1      LEU  62  13.655   6.147   4.247
  508   HD13  LEU  62          3HD1      LEU  62  12.443   5.255   3.329
  509   HD21  LEU  62          3HD2      LEU  62   9.746   7.729   3.713
  510   HD22  LEU  62          1HD2      LEU  62   9.970   6.321   4.752
  511   HD23  LEU  62          2HD2      LEU  62  10.186   6.173   3.008
  512    H    MET  63           H        MET  63  13.548   9.268   3.469
  513    HA   MET  63           HA       MET  63  12.948  11.825   2.336
  514    HB2  MET  63           2HB      MET  63  15.611  10.381   2.562
  515    HB3  MET  63           1HB      MET  63  15.345  11.941   1.807
  516    HG2  MET  63           2HG      MET  63  15.095  11.297   4.742
  517    HG3  MET  63           1HG      MET  63  16.388  12.208   3.975
  518    HE1  MET  63           3HE      MET  63  16.028  14.651   2.892
  519    HE2  MET  63           1HE      MET  63  14.481  15.497   2.892
  520    HE3  MET  63           2HE      MET  63  14.694  14.053   1.906
  521    H    GLU  64           H        GLU  64  11.490   9.829   1.738
  522    HA   GLU  64           HA       GLU  64  10.561   8.993  -0.116
  523    HB2  GLU  64           2HB      GLU  64  13.159   9.579  -0.986
  524    HB3  GLU  64           1HB      GLU  64  12.116   8.760  -2.202
  525    HG2  GLU  64           2HG      GLU  64  12.173  11.591  -1.143
  526    HG3  GLU  64           1HG      GLU  64  11.814  11.049  -2.780
  Start of MODEL    7
    1    HA   MET   1           HA       MET   1  11.696 -10.535   8.628
    2    HB2  MET   1           2HB      MET   1  13.700 -12.781   9.043
    3    HB3  MET   1           1HB      MET   1  14.052 -11.262   8.240
    4    HG2  MET   1           2HG      MET   1  14.910 -11.143  10.460
    5    HG3  MET   1           1HG      MET   1  13.511 -10.080  10.361
    6    HE1  MET   1           2HE      MET   1  15.026 -13.366  11.836
    7    HE2  MET   1           3HE      MET   1  13.768 -14.039  10.798
    8    HE3  MET   1           1HE      MET   1  13.621 -14.155  12.550
    9    H    SER   2           H        SER   2  10.465 -10.631   6.901
   10    HA   SER   2           HA       SER   2  11.466 -12.159   4.695
   11    HB2  SER   2           2HB      SER   2   9.821 -13.732   5.748
   12    HB3  SER   2           1HB      SER   2   8.576 -12.498   5.591
   13    HG   SER   2           HG       SER   2   9.897 -13.049   3.247
   14    H    ALA   3           H        ALA   3   8.496 -10.381   5.641
   15    HA   ALA   3           HA       ALA   3   9.208  -8.081   4.107
   16    HB1  ALA   3           1HB      ALA   3   6.922  -9.785   3.075
   17    HB2  ALA   3           2HB      ALA   3   8.485  -9.617   2.275
   18    HB3  ALA   3           3HB      ALA   3   7.421  -8.219   2.436
   19    H    GLU   4           H        GLU   4   8.653  -8.549   6.685
   20    HA   GLU   4           HA       GLU   4   6.126  -7.919   7.613
   21    HB2  GLU   4           2HB      GLU   4   8.868  -7.303   8.433
   22    HB3  GLU   4           1HB      GLU   4   7.529  -6.844   9.508
   23    HG2  GLU   4           2HG      GLU   4   8.397  -8.870  10.398
   24    HG3  GLU   4           1HG      GLU   4   7.009  -9.398   9.458
   25    H    THR   5           H        THR   5   8.881  -5.716   7.248
   26    HA   THR   5           HA       THR   5   7.366  -3.351   7.594
   27    HB   THR   5           HB       THR   5   9.693  -3.421   8.303
   28    HG1  THR   5           HG1      THR   5   8.728  -1.585   6.582
   29   HG21  THR   5          3HG2      THR   5  10.384  -3.730   5.373
   30   HG22  THR   5          1HG2      THR   5  10.586  -4.963   6.618
   31   HG23  THR   5          2HG2      THR   5  11.546  -3.485   6.677
   32    H    GLN   6           H        GLN   6   7.429  -5.302   4.990
   33    HA   GLN   6           HA       GLN   6   7.665  -3.390   2.857
   34    HB2  GLN   6           2HB      GLN   6   7.913  -5.943   2.666
   35    HB3  GLN   6           1HB      GLN   6   6.159  -6.000   2.733
   36    HG2  GLN   6           2HG      GLN   6   6.358  -4.252   0.774
   37    HG3  GLN   6           1HG      GLN   6   7.944  -4.992   0.575
   38   HE21  GLN   6          2HE2      GLN   6   6.390  -7.269  -1.528
   39   HE22  GLN   6          1HE2      GLN   6   7.495  -5.959  -1.356
   40    H    MET   7           H        MET   7   5.267  -4.506   5.083
   41    HA   MET   7           HA       MET   7   2.957  -3.939   3.558
   42    HB2  MET   7           2HB      MET   7   3.221  -4.096   6.562
   43    HB3  MET   7           1HB      MET   7   1.719  -4.156   5.655
   44    HG2  MET   7           2HG      MET   7   3.925  -6.201   5.627
   45    HG3  MET   7           1HG      MET   7   2.343  -6.365   6.380
   46    HE1  MET   7           3HE      MET   7   3.580  -8.541   4.452
   47    HE2  MET   7           1HE      MET   7   2.183  -8.946   3.453
   48    HE3  MET   7           2HE      MET   7   1.982  -8.684   5.185
   49    H    GLU   8           H        GLU   8   4.543  -2.170   6.199
   50    HA   GLU   8           HA       GLU   8   2.858   0.030   5.987
   51    HB2  GLU   8           2HB      GLU   8   5.700  -0.016   6.984
   52    HB3  GLU   8           1HB      GLU   8   4.485   1.231   7.231
   53    HG2  GLU   8           2HG      GLU   8   4.701  -0.003   9.252
   54    HG3  GLU   8           1HG      GLU   8   3.144  -0.393   8.525
   55    H    ARG   9           H        ARG   9   5.825  -0.867   4.411
   56    HA   ARG   9           HA       ARG   9   6.294   1.694   3.292
   57    HB2  ARG   9           2HB      ARG   9   8.193   0.254   3.341
   58    HB3  ARG   9           1HB      ARG   9   7.331  -1.045   2.545
   59    HG2  ARG   9           2HG      ARG   9   9.062   0.023   1.129
   60    HG3  ARG   9           1HG      ARG   9   7.452   0.091   0.430
   61    HD2  ARG   9           2HD      ARG   9   8.617   2.191   0.087
   62    HD3  ARG   9           1HD      ARG   9   7.245   2.423   1.156
   63    HE   ARG   9           HE       ARG   9   9.518   2.024   2.737
   64   HH11  ARG   9          1HH1      ARG   9   8.284   4.375   0.380
   65   HH12  ARG   9          2HH1      ARG   9   9.040   5.715   1.092
   66   HH21  ARG   9          2HH2      ARG   9  10.425   5.420   3.086
   67   HH22  ARG   9          1HH2      ARG   9  10.588   3.855   3.724
   68    H    LYS  10           H        LYS  10   4.461  -1.032   2.126
   69    HA   LYS  10           HA       LYS  10   3.904   0.103  -0.399
   70    HB2  LYS  10           2HB      LYS  10   2.427  -1.984   1.203
   71    HB3  LYS  10           1HB      LYS  10   1.947  -1.515  -0.423
   72    HG2  LYS  10           2HG      LYS  10   4.028  -2.290  -1.335
   73    HG3  LYS  10           1HG      LYS  10   4.683  -2.566   0.273
   74    HD2  LYS  10           2HD      LYS  10   2.345  -4.061  -0.944
   75    HD3  LYS  10           1HD      LYS  10   4.001  -4.665  -0.845
   76    HE2  LYS  10           2HE      LYS  10   3.824  -4.339   1.660
   77    HE3  LYS  10           1HE      LYS  10   2.097  -4.081   1.418
   78    HZ1  LYS  10           3HZ      LYS  10   2.010  -6.339   0.407
   79    HZ2  LYS  10           1HZ      LYS  10   2.526  -6.332   2.026
   80    HZ3  LYS  10           2HZ      LYS  10   3.659  -6.525   0.810
   81    H    ILE  11           H        ILE  11   2.223   0.453   2.766
   82    HA   ILE  11           HA       ILE  11   0.062   1.776   1.491
   83    HB   ILE  11           HB       ILE  11  -0.727   2.250   3.729
   84   HG12  ILE  11          2HG1      ILE  11   1.908   1.061   4.567
   85   HG13  ILE  11          1HG1      ILE  11   1.252   2.631   4.985
   86   HG21  ILE  11          1HG2      ILE  11  -1.262   0.114   2.677
   87   HG22  ILE  11          2HG2      ILE  11  -1.024  -0.140   4.420
   88   HG23  ILE  11          3HG2      ILE  11   0.266  -0.539   3.273
   89   HD11  ILE  11          3HD1      ILE  11   0.310  -0.027   5.884
   90   HD12  ILE  11          1HD1      ILE  11  -0.475   1.494   6.348
   91   HD13  ILE  11          2HD1      ILE  11   1.187   1.153   6.877
   92    H    ILE  12           H        ILE  12   2.929   2.794   3.312
   93    HA   ILE  12           HA       ILE  12   2.056   5.471   3.207
   94    HB   ILE  12           HB       ILE  12   3.978   6.186   4.217
   95   HG12  ILE  12          2HG1      ILE  12   5.947   4.205   4.318
   96   HG13  ILE  12          1HG1      ILE  12   5.325   4.139   2.681
   97   HG21  ILE  12          1HG2      ILE  12   3.597   3.415   5.256
   98   HG22  ILE  12          2HG2      ILE  12   2.761   4.885   5.759
   99   HG23  ILE  12          3HG2      ILE  12   4.485   4.694   6.083
  100   HD11  ILE  12          3HD1      ILE  12   5.678   6.560   2.363
  101   HD12  ILE  12          1HD1      ILE  12   7.190   5.721   2.728
  102   HD13  ILE  12          2HD1      ILE  12   6.360   6.670   3.961
  103    H    ASP  13           H        ASP  13   3.792   3.414   1.021
  104    HA   ASP  13           HA       ASP  13   4.947   5.553  -0.362
  105    HB2  ASP  13           2HB      ASP  13   5.226   2.813  -0.538
  106    HB3  ASP  13           1HB      ASP  13   4.481   3.244  -2.081
  107    H    PHE  14           H        PHE  14   1.906   3.873  -0.570
  108    HA   PHE  14           HA       PHE  14   0.831   5.000  -2.850
  109    HB2  PHE  14           2HB      PHE  14  -0.363   3.270  -1.730
  110    HB3  PHE  14           1HB      PHE  14  -0.346   4.144  -0.208
  111    HD1  PHE  14           HD1      PHE  14  -2.107   5.434   0.404
  112    HD2  PHE  14           HD2      PHE  14  -1.735   4.240  -3.632
  113    HE1  PHE  14           HE1      PHE  14  -4.359   6.343  -0.039
  114    HE2  PHE  14           HE2      PHE  14  -3.990   5.139  -4.125
  115    HZ   PHE  14           HZ       PHE  14  -5.305   6.195  -2.323
  116    H    LEU  15           H        LEU  15   0.604   6.236   0.514
  117    HA   LEU  15           HA       LEU  15  -0.408   8.755  -0.487
  118    HB2  LEU  15           2HB      LEU  15  -0.372   9.573   1.735
  119    HB3  LEU  15           1HB      LEU  15  -1.077   7.967   1.689
  120    HG   LEU  15           HG       LEU  15   1.723   7.792   2.195
  121   HD11  LEU  15          1HD1      LEU  15   1.774   8.850   4.359
  122   HD12  LEU  15          2HD1      LEU  15   0.134   9.487   4.111
  123   HD13  LEU  15          3HD1      LEU  15   1.471  10.008   3.066
  124   HD21  LEU  15          3HD2      LEU  15  -0.799   7.094   3.607
  125   HD22  LEU  15          1HD2      LEU  15   0.840   6.598   4.134
  126   HD23  LEU  15          2HD2      LEU  15   0.233   6.153   2.514
  127    H    ARG  16           H        ARG  16   2.550   7.511  -0.390
  128    HA   ARG  16           HA       ARG  16   4.160   9.821   0.273
  129    HB2  ARG  16           2HB      ARG  16   5.284   7.742   0.446
  130    HB3  ARG  16           1HB      ARG  16   4.572   7.216  -1.079
  131    HG2  ARG  16           2HG      ARG  16   5.991   8.469  -2.334
  132    HG3  ARG  16           1HG      ARG  16   6.522   9.403  -0.947
  133    HD2  ARG  16           2HD      ARG  16   7.551   7.271  -0.049
  134    HD3  ARG  16           1HD      ARG  16   7.007   6.442  -1.490
  135    HE   ARG  16           HE       ARG  16   8.948   8.647  -1.560
  136   HH11  ARG  16          1HH1      ARG  16   7.886   5.426  -2.743
  137   HH12  ARG  16          2HH1      ARG  16   9.210   5.157  -3.700
  138   HH21  ARG  16          2HH2      ARG  16  10.953   6.800  -3.847
  139   HH22  ARG  16          1HH2      ARG  16  10.862   8.256  -2.966
  140    H    GLN  17           H        GLN  17   2.654   8.390  -2.211
  141    HA   GLN  17           HA       GLN  17   3.751   9.915  -4.364
  142    HB2  GLN  17           2HB      GLN  17   3.229   7.819  -5.072
  143    HB3  GLN  17           1HB      GLN  17   1.916   7.652  -3.934
  144    HG2  GLN  17           2HG      GLN  17   0.958   7.529  -5.973
  145    HG3  GLN  17           1HG      GLN  17   0.652   9.142  -5.329
  146   HE21  GLN  17          2HE2      GLN  17   3.196  10.441  -7.827
  147   HE22  GLN  17          1HE2      GLN  17   3.173  10.337  -6.102
  148    H    ASN  18           H        ASN  18   0.843   9.819  -2.412
  149    HA   ASN  18           HA       ASN  18  -0.426  11.991  -3.813
  150    HB2  ASN  18           2HB      ASN  18  -1.038  10.954  -1.036
  151    HB3  ASN  18           1HB      ASN  18  -2.122  11.843  -2.101
  152   HD21  ASN  18          2HD2      ASN  18  -2.557   8.085  -2.133
  153   HD22  ASN  18          1HD2      ASN  18  -2.313   9.220  -0.842
  154    H    GLY  19           H        GLY  19   1.540  11.571  -0.972
  155    HA2  GLY  19           2HA      GLY  19   2.966  13.761  -0.781
  156    HA3  GLY  19           1HA      GLY  19   1.395  14.379  -0.284
  157    H    LYS  20           H        LYS  20   3.986  12.005   0.576
  158    HA   LYS  20           HA       LYS  20   3.288  11.000   2.913
  159    HB2  LYS  20           2HB      LYS  20   5.764  11.131   3.371
  160    HB3  LYS  20           1HB      LYS  20   5.328  10.453   1.820
  161    HG2  LYS  20           2HG      LYS  20   5.655  13.058   1.128
  162    HG3  LYS  20           1HG      LYS  20   6.815  12.921   2.452
  163    HD2  LYS  20           2HD      LYS  20   7.679  10.821   1.289
  164    HD3  LYS  20           1HD      LYS  20   6.697  11.307  -0.092
  165    HE2  LYS  20           2HE      LYS  20   8.838  12.133  -0.577
  166    HE3  LYS  20           1HE      LYS  20   7.936  13.522   0.025
  167    HZ1  LYS  20           3HZ      LYS  20  10.149  13.500   1.114
  168    HZ2  LYS  20           1HZ      LYS  20   9.896  11.914   1.626
  169    HZ3  LYS  20           2HZ      LYS  20   8.980  13.060   2.256
  170    H    SER  21           H        SER  21   3.554  11.699   5.261
  171    HA   SER  21           HA       SER  21   3.429  14.466   5.818
  172    HB2  SER  21           2HB      SER  21   1.588  14.403   4.141
  173    HB3  SER  21           1HB      SER  21   0.761  13.194   5.111
  174    HG   SER  21           HG       SER  21  -0.133  15.147   5.529
  175    H    ILE  22           H        ILE  22   1.163  14.369   7.505
  176    HA   ILE  22           HA       ILE  22   2.400  13.116   9.768
  177    HB   ILE  22           HB       ILE  22   0.532  14.028  11.103
  178   HG12  ILE  22          2HG1      ILE  22  -0.450  15.142   8.454
  179   HG13  ILE  22          1HG1      ILE  22  -1.238  13.871   9.378
  180   HG21  ILE  22          1HG2      ILE  22   1.860  15.993   9.239
  181   HG22  ILE  22          2HG2      ILE  22   2.522  15.367  10.749
  182   HG23  ILE  22          3HG2      ILE  22   1.096  16.406  10.773
  183   HD11  ILE  22          3HD1      ILE  22  -0.863  16.728  10.258
  184   HD12  ILE  22          1HD1      ILE  22  -1.653  15.458  11.194
  185   HD13  ILE  22          2HD1      ILE  22  -2.360  16.002   9.673
  186    H    ALA  23           H        ALA  23   1.330  11.759  11.274
  187    HA   ALA  23           HA       ALA  23   0.497   9.339  10.232
  188    HB1  ALA  23           1HB      ALA  23  -0.011  10.415  13.000
  189    HB2  ALA  23           2HB      ALA  23   1.473   9.631  12.459
  190    HB3  ALA  23           3HB      ALA  23  -0.034   8.716  12.528
  191    H    LEU  24           H        LEU  24  -1.385  12.131  11.022
  192    HA   LEU  24           HA       LEU  24  -3.911  10.840  11.222
  193    HB2  LEU  24           2HB      LEU  24  -3.338  13.101  12.181
  194    HB3  LEU  24           1HB      LEU  24  -3.285  13.733  10.558
  195    HG   LEU  24           HG       LEU  24  -5.813  12.582  11.774
  196   HD11  LEU  24          1HD1      LEU  24  -6.465  14.894  12.240
  197   HD12  LEU  24          2HD1      LEU  24  -4.872  15.447  11.720
  198   HD13  LEU  24          3HD1      LEU  24  -5.030  14.431  13.154
  199   HD21  LEU  24          3HD2      LEU  24  -5.378  14.501   9.474
  200   HD22  LEU  24          1HD2      LEU  24  -6.938  13.911  10.050
  201   HD23  LEU  24          2HD2      LEU  24  -5.784  12.796   9.311
  202    H    THR  25           H        THR  25  -1.983  12.247   8.585
  203    HA   THR  25           HA       THR  25  -4.024  12.127   6.652
  204    HB   THR  25           HB       THR  25  -1.031  12.020   6.294
  205    HG1  THR  25           HG1      THR  25  -2.808  14.007   6.987
  206   HG21  THR  25          3HG2      THR  25  -3.252  12.852   4.401
  207   HG22  THR  25          1HG2      THR  25  -2.392  11.319   4.365
  208   HG23  THR  25          2HG2      THR  25  -1.518  12.819   4.021
  209    H    ILE  26           H        ILE  26  -1.246  10.048   7.429
  210    HA   ILE  26           HA       ILE  26  -1.573   8.020   5.585
  211    HB   ILE  26           HB       ILE  26  -0.836   7.457   8.491
  212   HG12  ILE  26          2HG1      ILE  26   0.932   8.431   6.204
  213   HG13  ILE  26          1HG1      ILE  26   0.493   9.365   7.619
  214   HG21  ILE  26          1HG2      ILE  26  -0.126   6.054   5.923
  215   HG22  ILE  26          2HG2      ILE  26  -1.239   5.500   7.175
  216   HG23  ILE  26          3HG2      ILE  26   0.483   5.642   7.532
  217   HD11  ILE  26          3HD1      ILE  26   2.167   6.864   7.617
  218   HD12  ILE  26          1HD1      ILE  26   1.736   7.814   9.039
  219   HD13  ILE  26          2HD1      ILE  26   2.761   8.515   7.787
  220    H    ALA  27           H        ALA  27  -3.130   8.406   8.691
  221    HA   ALA  27           HA       ALA  27  -4.600   6.063   8.806
  222    HB1  ALA  27           1HB      ALA  27  -5.359   8.763   9.869
  223    HB2  ALA  27           2HB      ALA  27  -4.264   7.619  10.640
  224    HB3  ALA  27           3HB      ALA  27  -5.968   7.197  10.427
  225    H    LYS  28           H        LYS  28  -5.357   9.110   7.161
  226    HA   LYS  28           HA       LYS  28  -7.993   8.068   6.536
  227    HB2  LYS  28           2HB      LYS  28  -6.710  10.699   5.882
  228    HB3  LYS  28           1HB      LYS  28  -8.343  10.245   5.421
  229    HG2  LYS  28           2HG      LYS  28  -7.374  10.394   8.277
  230    HG3  LYS  28           1HG      LYS  28  -8.176  11.714   7.445
  231    HD2  LYS  28           2HD      LYS  28 -10.044  10.847   8.427
  232    HD3  LYS  28           1HD      LYS  28 -10.009   9.746   7.065
  233    HE2  LYS  28           2HE      LYS  28  -8.654   9.055   9.683
  234    HE3  LYS  28           1HE      LYS  28 -10.373   8.803   9.465
  235    HZ1  LYS  28           3HZ      LYS  28  -9.795   7.266   7.580
  236    HZ2  LYS  28           1HZ      LYS  28  -9.185   6.773   9.061
  237    HZ3  LYS  28           2HZ      LYS  28  -8.150   7.432   8.003
  238    H    GLU  29           H        GLU  29  -4.940   8.548   4.953
  239    HA   GLU  29           HA       GLU  29  -5.661   8.082   2.300
  240    HB2  GLU  29           2HB      GLU  29  -3.186   7.245   3.813
  241    HB3  GLU  29           1HB      GLU  29  -3.338   7.263   2.063
  242    HG2  GLU  29           2HG      GLU  29  -3.646   9.682   3.801
  243    HG3  GLU  29           1HG      GLU  29  -2.129   9.209   3.046
  244    H    ILE  30           H        ILE  30  -4.857   5.863   4.911
  245    HA   ILE  30           HA       ILE  30  -5.480   3.589   3.187
  246    HB   ILE  30           HB       ILE  30  -4.702   2.129   5.017
  247   HG12  ILE  30          2HG1      ILE  30  -4.130   4.713   6.502
  248   HG13  ILE  30          1HG1      ILE  30  -5.364   3.547   6.944
  249   HG21  ILE  30          1HG2      ILE  30  -2.336   2.784   4.970
  250   HG22  ILE  30          2HG2      ILE  30  -2.797   4.356   4.316
  251   HG23  ILE  30          3HG2      ILE  30  -3.096   2.889   3.381
  252   HD11  ILE  30          3HD1      ILE  30  -2.384   3.094   6.968
  253   HD12  ILE  30          1HD1      ILE  30  -3.602   1.886   7.382
  254   HD13  ILE  30          2HD1      ILE  30  -3.424   3.333   8.373
  255    H    GLY  31           H        GLY  31  -7.174   5.628   4.943
  256    HA2  GLY  31           2HA      GLY  31  -9.427   5.637   5.467
  257    HA3  GLY  31           1HA      GLY  31  -9.495   3.951   4.996
  258    H    LEU  32           H        LEU  32  -7.124   3.989   7.173
  259    HA   LEU  32           HA       LEU  32  -8.933   2.809   9.144
  260    HB2  LEU  32           2HB      LEU  32  -5.920   2.749   9.215
  261    HB3  LEU  32           1HB      LEU  32  -7.031   1.684  10.042
  262    HG   LEU  32           HG       LEU  32  -6.262   1.708   7.145
  263   HD11  LEU  32          1HD1      LEU  32  -5.718  -0.620   7.526
  264   HD12  LEU  32          2HD1      LEU  32  -6.183  -0.445   9.218
  265   HD13  LEU  32          3HD1      LEU  32  -4.817   0.468   8.581
  266   HD21  LEU  32          3HD2      LEU  32  -8.613   1.535   7.123
  267   HD22  LEU  32          1HD2      LEU  32  -8.621   0.240   8.338
  268   HD23  LEU  32          2HD2      LEU  32  -7.917  -0.035   6.727
  269    H    ASP  33           H        ASP  33  -7.220   3.011  11.422
  270    HA   ASP  33           HA       ASP  33  -7.825   5.778  12.164
  271    HB2  ASP  33           2HB      ASP  33  -8.717   3.825  13.572
  272    HB3  ASP  33           1HB      ASP  33  -7.056   3.541  14.018
  273    H    LYS  34           H        LYS  34  -6.380   6.942  13.421
  274    HA   LYS  34           HA       LYS  34  -3.709   6.967  12.565
  275    HB2  LYS  34           2HB      LYS  34  -3.318   8.653  14.385
  276    HB3  LYS  34           1HB      LYS  34  -4.623   9.054  13.289
  277    HG2  LYS  34           2HG      LYS  34  -5.303   7.672  15.851
  278    HG3  LYS  34           1HG      LYS  34  -4.849   9.372  15.912
  279    HD2  LYS  34           2HD      LYS  34  -6.645   9.936  14.365
  280    HD3  LYS  34           1HD      LYS  34  -7.073   8.242  14.177
  281    HE2  LYS  34           2HE      LYS  34  -7.176   9.729  16.804
  282    HE3  LYS  34           1HE      LYS  34  -8.556   9.542  15.726
  283    HZ1  LYS  34           3HZ      LYS  34  -8.439   7.187  15.971
  284    HZ2  LYS  34           1HZ      LYS  34  -8.535   7.828  17.514
  285    HZ3  LYS  34           2HZ      LYS  34  -7.080   7.196  16.852
  286    H    SER  35           H        SER  35  -5.232   5.325  15.255
  287    HA   SER  35           HA       SER  35  -2.977   4.877  16.832
  288    HB2  SER  35           2HB      SER  35  -5.280   4.462  17.612
  289    HB3  SER  35           1HB      SER  35  -5.433   3.137  16.463
  290    HG   SER  35           HG       SER  35  -4.731   2.806  18.839
  291    H    THR  36           H        THR  36  -4.323   2.992  14.117
  292    HA   THR  36           HA       THR  36  -2.317   1.024  14.466
  293    HB   THR  36           HB       THR  36  -4.492   0.451  13.338
  294    HG1  THR  36           HG1      THR  36  -2.399  -0.160  11.527
  295   HG21  THR  36          3HG2      THR  36  -3.291   1.890  10.961
  296   HG22  THR  36          1HG2      THR  36  -4.710   2.411  11.869
  297   HG23  THR  36          2HG2      THR  36  -4.761   0.916  10.935
  298    H    VAL  37           H        VAL  37  -2.541   3.917  12.439
  299    HA   VAL  37           HA       VAL  37  -0.275   3.575  10.921
  300    HB   VAL  37           HB       VAL  37  -1.530   5.997  12.126
  301   HG11  VAL  37          1HG1      VAL  37   0.433   5.835   9.834
  302   HG12  VAL  37          2HG1      VAL  37   0.726   6.488  11.452
  303   HG13  VAL  37          3HG1      VAL  37  -0.404   7.297  10.385
  304   HG21  VAL  37          3HG2      VAL  37  -1.866   4.730   9.423
  305   HG22  VAL  37          1HG2      VAL  37  -2.573   6.270   9.908
  306   HG23  VAL  37          2HG2      VAL  37  -3.054   4.782  10.726
  307    H    ASN  38           H        ASN  38  -0.634   5.224  14.056
  308    HA   ASN  38           HA       ASN  38   2.010   5.972  14.321
  309    HB2  ASN  38           2HB      ASN  38  -0.151   5.568  16.347
  310    HB3  ASN  38           1HB      ASN  38   1.495   5.878  16.880
  311   HD21  ASN  38          2HD2      ASN  38  -0.743   8.849  15.335
  312   HD22  ASN  38          1HD2      ASN  38  -1.287   7.196  15.282
  313    H    ARG  39           H        ARG  39   0.474   3.008  15.397
  314    HA   ARG  39           HA       ARG  39   2.786   2.107  16.803
  315    HB2  ARG  39           2HB      ARG  39   1.757  -0.098  16.909
  316    HB3  ARG  39           1HB      ARG  39   0.555   1.143  17.265
  317    HG2  ARG  39           2HG      ARG  39  -0.273   0.930  14.963
  318    HG3  ARG  39           1HG      ARG  39   0.907  -0.332  14.680
  319    HD2  ARG  39           2HD      ARG  39  -0.130  -1.713  16.406
  320    HD3  ARG  39           1HD      ARG  39  -1.322  -0.443  16.704
  321    HE   ARG  39           HE       ARG  39  -1.412  -0.967  14.010
  322   HH11  ARG  39          1HH1      ARG  39  -2.032  -2.845  16.929
  323   HH12  ARG  39          2HH1      ARG  39  -3.212  -3.850  16.220
  324   HH21  ARG  39          2HH2      ARG  39  -3.785  -3.509  13.866
  325   HH22  ARG  39          1HH2      ARG  39  -2.991  -2.244  13.036
  326    H    HIS  40           H        HIS  40   1.686   1.708  13.524
  327    HA   HIS  40           HA       HIS  40   3.667  -0.234  12.860
  328    HB2  HIS  40           2HB      HIS  40   1.748   1.355  11.168
  329    HB3  HIS  40           1HB      HIS  40   3.034   0.433  10.434
  330    HD1  HIS  40           HD1      HIS  40   2.675  -2.195  10.304
  331    HD2  HIS  40           HD2      HIS  40  -0.262  -0.146  12.441
  332    HE1  HIS  40           HE1      HIS  40   0.853  -3.842  10.753
  333    H    LEU  41           H        LEU  41   3.524   3.236  12.699
  334    HA   LEU  41           HA       LEU  41   5.877   3.320  11.085
  335    HB2  LEU  41           2HB      LEU  41   5.789   5.748  11.327
  336    HB3  LEU  41           1HB      LEU  41   4.284   5.079  10.741
  337    HG   LEU  41           HG       LEU  41   3.557   5.259  13.223
  338   HD11  LEU  41          1HD1      LEU  41   5.778   7.288  13.200
  339   HD12  LEU  41          2HD1      LEU  41   5.694   5.815  14.169
  340   HD13  LEU  41          3HD1      LEU  41   4.529   7.106  14.440
  341   HD21  LEU  41          3HD2      LEU  41   3.884   7.657  11.464
  342   HD22  LEU  41          1HD2      LEU  41   2.732   7.482  12.807
  343   HD23  LEU  41          2HD2      LEU  41   2.632   6.414  11.390
  344    H    TYR  42           H        TYR  42   5.145   3.417  14.543
  345    HA   TYR  42           HA       TYR  42   7.511   4.355  15.431
  346    HB2  TYR  42           2HB      TYR  42   5.309   2.629  16.219
  347    HB3  TYR  42           1HB      TYR  42   6.686   2.594  17.238
  348    HD1  TYR  42           HD1      TYR  42   3.995   3.332  18.103
  349    HD2  TYR  42           HD2      TYR  42   7.015   5.818  16.476
  350    HE1  TYR  42           HE1      TYR  42   2.947   5.302  19.183
  351    HE2  TYR  42           HE2      TYR  42   5.999   7.783  17.535
  352    HH   TYR  42           HH       TYR  42   3.726   8.447  18.339
  353    H    ASN  43           H        ASN  43   6.417   1.221  14.399
  354    HA   ASN  43           HA       ASN  43   8.675  -0.361  15.060
  355    HB2  ASN  43           2HB      ASN  43   6.878  -0.666  12.629
  356    HB3  ASN  43           1HB      ASN  43   7.953  -1.902  13.266
  357   HD21  ASN  43          2HD2      ASN  43   4.363  -2.254  14.372
  358   HD22  ASN  43          1HD2      ASN  43   5.071  -1.892  12.840
  359    H    LEU  44           H        LEU  44   7.847   1.363  12.140
  360    HA   LEU  44           HA       LEU  44  10.176   0.797  10.638
  361    HB2  LEU  44           2HB      LEU  44   8.470   3.239  10.387
  362    HB3  LEU  44           1HB      LEU  44   9.389   2.480   9.147
  363    HG   LEU  44           HG       LEU  44   6.922   1.351  10.409
  364   HD11  LEU  44          1HD1      LEU  44   7.416   2.560   7.697
  365   HD12  LEU  44          2HD1      LEU  44   6.550   3.318   9.029
  366   HD13  LEU  44          3HD1      LEU  44   5.908   1.858   8.284
  367   HD21  LEU  44          3HD2      LEU  44   8.465  -0.408   9.695
  368   HD22  LEU  44          1HD2      LEU  44   8.590   0.336   8.103
  369   HD23  LEU  44          2HD2      LEU  44   7.053  -0.338   8.646
  370    H    GLN  45           H        GLN  45   9.329   3.304  12.917
  371    HA   GLN  45           HA       GLN  45  11.150   5.321  12.335
  372    HB2  GLN  45           2HB      GLN  45   9.187   5.371  13.944
  373    HB3  GLN  45           1HB      GLN  45  10.221   4.520  15.037
  374    HG2  GLN  45           2HG      GLN  45  11.685   6.235  15.367
  375    HG3  GLN  45           1HG      GLN  45  11.224   7.057  13.875
  376   HE21  GLN  45          2HE2      GLN  45   8.599   8.762  15.226
  377   HE22  GLN  45          1HE2      GLN  45   9.405   8.242  13.807
  378    H    ARG  46           H        ARG  46  11.289   2.699  14.491
  379    HA   ARG  46           HA       ARG  46  13.910   3.268  15.556
  380    HB2  ARG  46           2HB      ARG  46  12.150   0.858  15.678
  381    HB3  ARG  46           1HB      ARG  46  13.694   0.976  16.515
  382    HG2  ARG  46           2HG      ARG  46  12.936   2.718  17.887
  383    HG3  ARG  46           1HG      ARG  46  11.506   2.984  16.881
  384    HD2  ARG  46           2HD      ARG  46  12.036   0.368  18.026
  385    HD3  ARG  46           1HD      ARG  46  11.305   1.604  19.099
  386    HE   ARG  46           HE       ARG  46   9.859   1.518  16.741
  387   HH11  ARG  46          1HH1      ARG  46  10.633  -0.816  19.307
  388   HH12  ARG  46          2HH1      ARG  46   9.170  -1.681  19.191
  389   HH21  ARG  46          2HH2      ARG  46   7.514  -1.025  17.561
  390   HH22  ARG  46          1HH2      ARG  46   7.809   0.311  16.597
  391    H    SER  47           H        SER  47  12.754   1.659  12.912
  392    HA   SER  47           HA       SER  47  15.259   0.265  12.371
  393    HB2  SER  47           2HB      SER  47  13.153  -0.973  12.042
  394    HB3  SER  47           1HB      SER  47  12.636   0.219  10.855
  395    HG   SER  47           HG       SER  47  14.803  -0.428   9.868
  396    H    ASN  48           H        ASN  48  14.243   3.422  11.929
  397    HA   ASN  48           HA       ASN  48  14.675   5.092  10.572
  398    HB2  ASN  48           2HB      ASN  48  16.998   3.305   9.960
  399    HB3  ASN  48           1HB      ASN  48  16.837   4.862   9.142
  400   HD21  ASN  48          2HD2      ASN  48  18.740   6.128  11.759
  401   HD22  ASN  48          1HD2      ASN  48  18.632   5.759  10.063
  402    H    GLN  49           H        GLN  49  12.835   3.201   9.674
  403    HA   GLN  49           HA       GLN  49  13.225   3.064   6.761
  404    HB2  GLN  49           2HB      GLN  49  12.506   1.078   8.211
  405    HB3  GLN  49           1HB      GLN  49  11.015   1.908   8.517
  406    HG2  GLN  49           2HG      GLN  49  11.998   0.687   5.940
  407    HG3  GLN  49           1HG      GLN  49  10.605   0.218   6.897
  408   HE21  GLN  49          2HE2      GLN  49   8.526   2.731   5.562
  409   HE22  GLN  49          1HE2      GLN  49   8.817   1.681   6.905
  410    H    VAL  50           H        VAL  50  11.432   4.449   9.399
  411    HA   VAL  50           HA       VAL  50  10.503   6.521   7.660
  412    HB   VAL  50           HB       VAL  50   8.637   4.698   8.283
  413   HG11  VAL  50          1HG1      VAL  50   8.437   6.516  10.670
  414   HG12  VAL  50          2HG1      VAL  50   9.216   4.975  10.715
  415   HG13  VAL  50          3HG1      VAL  50   7.467   5.065  10.342
  416   HG21  VAL  50          3HG2      VAL  50   6.913   6.453   8.177
  417   HG22  VAL  50          1HG2      VAL  50   8.195   6.709   6.990
  418   HG23  VAL  50          2HG2      VAL  50   8.157   7.672   8.469
  419    H    PHE  51           H        PHE  51  10.143   8.398   9.057
  420    HA   PHE  51           HA       PHE  51  10.366   8.366  11.813
  421    HB2  PHE  51           2HB      PHE  51  12.611   9.869  11.868
  422    HB3  PHE  51           1HB      PHE  51  12.666   8.127  11.910
  423    HD1  PHE  51           HD1      PHE  51  13.906   6.969  10.459
  424    HD2  PHE  51           HD2      PHE  51  12.936  10.995   9.541
  425    HE1  PHE  51           HE1      PHE  51  15.435   6.856   8.605
  426    HE2  PHE  51           HE2      PHE  51  14.489  10.928   7.627
  427    HZ   PHE  51           HZ       PHE  51  15.752   8.860   7.139
  428    H    ASN  52           H        ASN  52  11.333  11.084  12.138
  429    HA   ASN  52           HA       ASN  52   9.279  12.512  10.605
  430    HB2  ASN  52           2HB      ASN  52  10.514  13.263  13.258
  431    HB3  ASN  52           1HB      ASN  52   9.256  14.106  12.404
  432   HD21  ASN  52          2HD2      ASN  52   6.607  12.211  13.454
  433   HD22  ASN  52          1HD2      ASN  52   7.188  13.466  12.421
  434    H    SER  53           H        SER  53   9.950  14.548   9.749
  435    HA   SER  53           HA       SER  53  12.827  14.988   9.668
  436    HB2  SER  53           2HB      SER  53  12.593  13.082   8.196
  437    HB3  SER  53           1HB      SER  53  11.255  13.834   7.348
  438    HG   SER  53           HG       SER  53  13.834  14.993   7.417
  439    H    ASN  54           H        ASN  54  13.407  16.809   8.322
  440    HA   ASN  54           HA       ASN  54  13.279  18.644   7.041
  441    HB2  ASN  54           2HB      ASN  54  11.647  17.591   5.631
  442    HB3  ASN  54           1HB      ASN  54  10.352  17.973   6.748
  443   HD21  ASN  54          2HD2      ASN  54   9.777  21.155   5.400
  444   HD22  ASN  54          1HD2      ASN  54   9.308  20.041   6.587
  445    H    GLU  55           H        GLU  55  11.452  18.609  10.002
  446    HA   GLU  55           HA       GLU  55  11.840  21.436  10.282
  447    HB2  GLU  55           2HB      GLU  55   9.393  22.028  10.298
  448    HB3  GLU  55           1HB      GLU  55  10.100  21.664   8.733
  449    HG2  GLU  55           2HG      GLU  55   9.200  19.401   8.874
  450    HG3  GLU  55           1HG      GLU  55   8.366  19.804  10.369
  451    H    LYS  56           H        LYS  56   9.942  22.212  12.007
  452    HA   LYS  56           HA       LYS  56  10.720  20.823  14.382
  453    HB2  LYS  56           2HB      LYS  56   9.000  23.288  14.081
  454    HB3  LYS  56           1HB      LYS  56   9.344  22.525  15.626
  455    HG2  LYS  56           2HG      LYS  56  11.758  22.876  15.210
  456    HG3  LYS  56           1HG      LYS  56  11.343  23.731  13.726
  457    HD2  LYS  56           2HD      LYS  56  11.775  25.312  15.538
  458    HD3  LYS  56           1HD      LYS  56  10.086  25.388  15.041
  459    HE2  LYS  56           2HE      LYS  56  10.340  25.460  17.489
  460    HE3  LYS  56           1HE      LYS  56   9.429  24.048  16.978
  461    HZ1  LYS  56           3HZ      LYS  56  11.448  22.715  17.236
  462    HZ2  LYS  56           1HZ      LYS  56  11.040  23.489  18.681
  463    HZ3  LYS  56           2HZ      LYS  56  12.310  24.082  17.735
  464    HA   PRO  57           HA       PRO  57   6.495  18.932  14.388
  465    HB2  PRO  57           2HB      PRO  57   4.637  19.773  12.448
  466    HB3  PRO  57           1HB      PRO  57   4.649  20.361  14.121
  467    HG2  PRO  57           2HG      PRO  57   5.147  21.902  11.830
  468    HG3  PRO  57           1HG      PRO  57   5.415  22.381  13.516
  469    HD2  PRO  57           2HD      PRO  57   7.369  21.368  11.518
  470    HD3  PRO  57           1HD      PRO  57   7.599  22.535  12.837
  471    HA   PRO  58           HA       PRO  58   8.596  17.704  10.584
  472    HB2  PRO  58           2HB      PRO  58  10.006  15.550  11.534
  473    HB3  PRO  58           1HB      PRO  58  10.499  17.227  11.654
  474    HG2  PRO  58           2HG      PRO  58   9.706  15.541  13.832
  475    HG3  PRO  58           1HG      PRO  58  10.329  17.195  13.862
  476    HD2  PRO  58           2HD      PRO  58   7.562  16.271  14.053
  477    HD3  PRO  58           1HD      PRO  58   8.275  17.834  14.499
  478    H    VAL  59           H        VAL  59   8.380  16.387   9.007
  479    HA   VAL  59           HA       VAL  59   5.902  15.101   8.609
  480    HB   VAL  59           HB       VAL  59   7.374  16.217   6.907
  481   HG11  VAL  59          1HG1      VAL  59   9.040  14.889   5.705
  482   HG12  VAL  59          2HG1      VAL  59   8.956  13.690   7.000
  483   HG13  VAL  59          3HG1      VAL  59   9.495  15.329   7.350
  484   HG21  VAL  59          3HG2      VAL  59   5.471  15.051   6.068
  485   HG22  VAL  59          1HG2      VAL  59   6.266  13.486   6.311
  486   HG23  VAL  59          2HG2      VAL  59   6.856  14.558   5.071
  487    H    TRP  60           H        TRP  60   5.174  13.145   8.697
  488    HA   TRP  60           HA       TRP  60   7.004  11.214   9.811
  489    HB2  TRP  60           2HB      TRP  60   4.026  10.927   9.219
  490    HB3  TRP  60           1HB      TRP  60   5.035   9.877  10.221
  491    HD1  TRP  60           HD1      TRP  60   4.142  13.693  10.335
  492    HE1  TRP  60           HE1      TRP  60   3.633  14.360  12.745
  493    HE3  TRP  60           HE3      TRP  60   4.875   9.175  12.611
  494    HZ2  TRP  60           HZ2      TRP  60   3.536  13.166  15.278
  495    HZ3  TRP  60           HZ3      TRP  60   4.550   9.044  15.056
  496    HH2  TRP  60           HH2      TRP  60   3.897  10.992  16.350
  497    H    ASP  61           H        ASP  61   8.230  10.707   8.341
  498    HA   ASP  61           HA       ASP  61   7.813   9.330   5.963
  499    HB2  ASP  61           2HB      ASP  61   6.622  11.253   5.141
  500    HB3  ASP  61           1HB      ASP  61   7.754  12.332   5.908
  501    H    LEU  62           H        LEU  62   9.874  10.161   4.571
  502    HA   LEU  62           HA       LEU  62  12.046  10.787   6.333
  503    HB2  LEU  62           2HB      LEU  62  13.450   8.936   5.686
  504    HB3  LEU  62           1HB      LEU  62  11.885   8.375   6.222
  505    HG   LEU  62           HG       LEU  62  12.571   6.925   4.498
  506   HD11  LEU  62          1HD1      LEU  62  10.921   7.130   2.722
  507   HD12  LEU  62          2HD1      LEU  62  10.509   8.731   3.335
  508   HD13  LEU  62          3HD1      LEU  62  10.269   7.310   4.350
  509   HD21  LEU  62          3HD2      LEU  62  13.136   9.298   2.728
  510   HD22  LEU  62          1HD2      LEU  62  13.197   7.611   2.216
  511   HD23  LEU  62          2HD2      LEU  62  14.319   8.201   3.441
  512    H    MET  63           H        MET  63  13.261  12.367   5.502
  513    HA   MET  63           HA       MET  63  13.222  12.742   2.603
  514    HB2  MET  63           2HB      MET  63  11.369  14.064   3.729
  515    HB3  MET  63           1HB      MET  63  12.622  14.957   4.573
  516    HG2  MET  63           2HG      MET  63  11.884  16.265   2.725
  517    HG3  MET  63           1HG      MET  63  13.508  15.679   2.369
  518    HE1  MET  63           3HE      MET  63  11.902  15.776  -1.179
  519    HE2  MET  63           1HE      MET  63  13.267  16.260  -0.175
  520    HE3  MET  63           2HE      MET  63  11.661  16.917   0.144
  521    H    GLU  64           H        GLU  64  15.087  12.217   5.237
  522    HA   GLU  64           HA       GLU  64  17.324  13.528   4.199
  523    HB2  GLU  64           2HB      GLU  64  17.885  14.641   6.338
  524    HB3  GLU  64           1HB      GLU  64  16.372  15.277   5.724
  525    HG2  GLU  64           2HG      GLU  64  15.214  13.669   7.316
  526    HG3  GLU  64           1HG      GLU  64  16.797  13.406   8.038
  Start of MODEL    8
    1    HA   MET   1           HA       MET   1   9.153  -8.480  -3.735
    2    HB2  MET   1           2HB      MET   1  11.182  -7.984  -2.443
    3    HB3  MET   1           1HB      MET   1  10.872  -6.683  -3.578
    4    HG2  MET   1           2HG      MET   1   9.959  -5.313  -1.776
    5    HG3  MET   1           1HG      MET   1  10.218  -6.627  -0.636
    6    HE1  MET   1           2HE      MET   1  12.648  -5.441  -3.573
    7    HE2  MET   1           3HE      MET   1  13.643  -4.285  -2.690
    8    HE3  MET   1           1HE      MET   1  11.935  -3.948  -2.958
    9    H    SER   2           H        SER   2   9.889  -9.850  -1.730
   10    HA   SER   2           HA       SER   2   7.648  -9.824   0.100
   11    HB2  SER   2           2HB      SER   2   9.721 -11.956  -0.456
   12    HB3  SER   2           1HB      SER   2   8.215 -12.150   0.449
   13    HG   SER   2           HG       SER   2   7.561 -12.773  -1.479
   14    H    ALA   3           H        ALA   3   8.083  -8.671   1.894
   15    HA   ALA   3           HA       ALA   3  10.280  -9.306   3.582
   16    HB1  ALA   3           1HB      ALA   3  11.102  -6.971   3.723
   17    HB2  ALA   3           2HB      ALA   3  10.040  -6.521   2.391
   18    HB3  ALA   3           3HB      ALA   3  11.372  -7.639   2.112
   19    H    GLU   4           H        GLU   4   9.995  -8.007   5.594
   20    HA   GLU   4           HA       GLU   4   7.236  -8.201   6.256
   21    HB2  GLU   4           2HB      GLU   4   7.948  -7.953   8.581
   22    HB3  GLU   4           1HB      GLU   4   8.992  -9.071   7.722
   23    HG2  GLU   4           2HG      GLU   4   9.655  -6.273   8.648
   24    HG3  GLU   4           1HG      GLU   4  10.376  -7.789   9.176
   25    H    THR   5           H        THR   5   9.570  -5.492   6.474
   26    HA   THR   5           HA       THR   5   7.621  -3.556   7.207
   27    HB   THR   5           HB       THR   5   9.502  -1.942   6.672
   28    HG1  THR   5           HG1      THR   5  11.053  -4.321   6.351
   29   HG21  THR   5          3HG2      THR   5  10.162  -4.252   8.516
   30   HG22  THR   5          1HG2      THR   5   9.168  -2.859   8.941
   31   HG23  THR   5          2HG2      THR   5  10.879  -2.644   8.580
   32    H    GLN   6           H        GLN   6   7.991  -5.066   4.456
   33    HA   GLN   6           HA       GLN   6   7.852  -3.111   2.438
   34    HB2  GLN   6           2HB      GLN   6   8.436  -5.398   1.918
   35    HB3  GLN   6           1HB      GLN   6   6.900  -5.975   2.526
   36    HG2  GLN   6           2HG      GLN   6   6.751  -6.124   0.194
   37    HG3  GLN   6           1HG      GLN   6   5.828  -4.698   0.618
   38   HE21  GLN   6          2HE2      GLN   6   8.788  -2.721  -0.723
   39   HE22  GLN   6          1HE2      GLN   6   8.256  -2.972   0.879
   40    H    MET   7           H        MET   7   5.529  -4.424   4.672
   41    HA   MET   7           HA       MET   7   3.235  -3.639   3.135
   42    HB2  MET   7           2HB      MET   7   3.415  -4.349   6.068
   43    HB3  MET   7           1HB      MET   7   1.932  -4.199   5.141
   44    HG2  MET   7           2HG      MET   7   4.089  -6.263   4.756
   45    HG3  MET   7           1HG      MET   7   2.501  -6.524   5.470
   46    HE1  MET   7           3HE      MET   7   3.678  -8.347   3.173
   47    HE2  MET   7           1HE      MET   7   2.273  -8.525   2.123
   48    HE3  MET   7           2HE      MET   7   2.076  -8.576   3.874
   49    H    GLU   8           H        GLU   8   4.802  -2.491   6.052
   50    HA   GLU   8           HA       GLU   8   3.344  -0.220   6.549
   51    HB2  GLU   8           2HB      GLU   8   6.278  -0.769   6.988
   52    HB3  GLU   8           1HB      GLU   8   5.417   0.607   7.652
   53    HG2  GLU   8           2HG      GLU   8   5.825  -1.171   9.287
   54    HG3  GLU   8           1HG      GLU   8   4.120  -0.816   9.067
   55    H    ARG   9           H        ARG   9   6.072  -0.696   4.429
   56    HA   ARG   9           HA       ARG   9   6.338   2.114   3.890
   57    HB2  ARG   9           2HB      ARG   9   8.243   0.473   3.647
   58    HB3  ARG   9           1HB      ARG   9   7.418  -0.226   2.275
   59    HG2  ARG   9           2HG      ARG   9   9.291   1.255   1.624
   60    HG3  ARG   9           1HG      ARG   9   7.744   1.814   0.988
   61    HD2  ARG   9           2HD      ARG   9   7.623   3.573   2.530
   62    HD3  ARG   9           1HD      ARG   9   8.838   2.854   3.576
   63    HE   ARG   9           HE       ARG   9  10.277   3.381   1.364
   64   HH11  ARG   9          1HH1      ARG   9   7.861   5.446   2.761
   65   HH12  ARG   9          2HH1      ARG   9   8.744   6.896   2.721
   66   HH21  ARG   9          2HH2      ARG   9  10.960   6.804   1.767
   67   HH22  ARG   9          1HH2      ARG   9  11.570   5.306   1.181
   68    H    LYS  10           H        LYS  10   4.658  -0.508   2.309
   69    HA   LYS  10           HA       LYS  10   4.084   0.912  -0.091
   70    HB2  LYS  10           2HB      LYS  10   2.644  -1.377   1.200
   71    HB3  LYS  10           1HB      LYS  10   2.123  -0.692  -0.324
   72    HG2  LYS  10           2HG      LYS  10   4.255  -1.306  -1.345
   73    HG3  LYS  10           1HG      LYS  10   4.811  -1.956   0.200
   74    HD2  LYS  10           2HD      LYS  10   2.421  -2.961  -1.367
   75    HD3  LYS  10           1HD      LYS  10   4.004  -3.736  -1.312
   76    HE2  LYS  10           2HE      LYS  10   3.758  -4.044   1.116
   77    HE3  LYS  10           1HE      LYS  10   2.172  -3.286   1.052
   78    HZ1  LYS  10           3HZ      LYS  10   1.379  -5.087  -0.311
   79    HZ2  LYS  10           1HZ      LYS  10   2.053  -5.667   1.128
   80    HZ3  LYS  10           2HZ      LYS  10   2.918  -5.812  -0.316
   81    H    ILE  11           H        ILE  11   2.362   0.781   3.009
   82    HA   ILE  11           HA       ILE  11   0.095   2.081   1.890
   83    HB   ILE  11           HB       ILE  11  -0.672   2.242   4.215
   84   HG12  ILE  11          2HG1      ILE  11   2.027   1.021   4.813
   85   HG13  ILE  11          1HG1      ILE  11   1.376   2.535   5.417
   86   HG21  ILE  11          1HG2      ILE  11  -1.140   0.259   2.868
   87   HG22  ILE  11          2HG2      ILE  11  -0.841  -0.226   4.552
   88   HG23  ILE  11          3HG2      ILE  11   0.435  -0.393   3.332
   89   HD11  ILE  11          3HD1      ILE  11  -0.309   1.249   6.665
   90   HD12  ILE  11          1HD1      ILE  11   1.370   0.857   7.115
   91   HD13  ILE  11          2HD1      ILE  11   0.478  -0.212   6.031
   92    H    ILE  12           H        ILE  12   2.920   3.054   3.750
   93    HA   ILE  12           HA       ILE  12   1.853   5.675   3.865
   94    HB   ILE  12           HB       ILE  12   3.641   6.361   5.112
   95   HG12  ILE  12          2HG1      ILE  12   5.754   4.613   5.070
   96   HG13  ILE  12          1HG1      ILE  12   5.214   4.636   3.412
   97   HG21  ILE  12          1HG2      ILE  12   3.515   3.453   5.727
   98   HG22  ILE  12          2HG2      ILE  12   2.495   4.738   6.376
   99   HG23  ILE  12          3HG2      ILE  12   4.216   4.691   6.768
  100   HD11  ILE  12          3HD1      ILE  12   6.885   6.462   3.715
  101   HD12  ILE  12          1HD1      ILE  12   5.859   7.177   4.947
  102   HD13  ILE  12          2HD1      ILE  12   5.309   7.119   3.302
  103    H    ASP  13           H        ASP  13   3.830   3.854   1.528
  104    HA   ASP  13           HA       ASP  13   4.979   5.931   0.239
  105    HB2  ASP  13           2HB      ASP  13   4.135   3.183  -0.442
  106    HB3  ASP  13           1HB      ASP  13   4.615   4.259  -1.733
  107    H    PHE  14           H        PHE  14   1.824   4.465  -0.013
  108    HA   PHE  14           HA       PHE  14   0.793   5.909  -2.130
  109    HB2  PHE  14           2HB      PHE  14  -0.427   4.060  -1.188
  110    HB3  PHE  14           1HB      PHE  14  -0.469   4.821   0.395
  111    HD1  PHE  14           HD1      PHE  14  -1.854   4.840  -2.977
  112    HD2  PHE  14           HD2      PHE  14  -2.012   6.470   0.905
  113    HE1  PHE  14           HE1      PHE  14  -4.048   5.851  -3.517
  114    HE2  PHE  14           HE2      PHE  14  -4.185   7.493   0.432
  115    HZ   PHE  14           HZ       PHE  14  -5.228   7.186  -1.806
  116    H    LEU  15           H        LEU  15   0.645   6.666   1.413
  117    HA   LEU  15           HA       LEU  15  -0.420   9.176   1.116
  118    HB2  LEU  15           2HB      LEU  15  -0.738   8.477   3.043
  119    HB3  LEU  15           1HB      LEU  15   0.643   7.408   3.158
  120    HG   LEU  15           HG       LEU  15   0.473   8.901   4.942
  121   HD11  LEU  15          1HD1      LEU  15   2.706  10.034   4.972
  122   HD12  LEU  15          2HD1      LEU  15   2.845   9.648   3.255
  123   HD13  LEU  15          3HD1      LEU  15   2.733   8.351   4.444
  124   HD21  LEU  15          3HD2      LEU  15   0.512  11.145   2.973
  125   HD22  LEU  15          1HD2      LEU  15   0.850  11.397   4.689
  126   HD23  LEU  15          2HD2      LEU  15  -0.715  10.768   4.201
  127    H    ARG  16           H        ARG  16   2.827   8.087   1.104
  128    HA   ARG  16           HA       ARG  16   4.235  10.415   1.293
  129    HB2  ARG  16           2HB      ARG  16   5.437   8.453   1.460
  130    HB3  ARG  16           1HB      ARG  16   4.630   7.770   0.064
  131    HG2  ARG  16           2HG      ARG  16   5.977   8.973  -1.414
  132    HG3  ARG  16           1HG      ARG  16   6.673   9.931  -0.109
  133    HD2  ARG  16           2HD      ARG  16   7.667   7.871   0.842
  134    HD3  ARG  16           1HD      ARG  16   6.886   6.914  -0.407
  135    HE   ARG  16           HE       ARG  16   8.784   8.932  -1.280
  136   HH11  ARG  16          1HH1      ARG  16   8.172   5.427  -0.635
  137   HH12  ARG  16          2HH1      ARG  16   9.639   4.988  -1.393
  138   HH21  ARG  16          2HH2      ARG  16  11.008   6.397  -2.318
  139   HH22  ARG  16          1HH2      ARG  16  10.823   8.087  -2.385
  140    H    GLN  17           H        GLN  17   2.911   8.815  -1.463
  141    HA   GLN  17           HA       GLN  17   3.764  10.661  -3.448
  142    HB2  GLN  17           2HB      GLN  17   1.504   8.667  -3.527
  143    HB3  GLN  17           1HB      GLN  17   2.046   9.608  -4.907
  144    HG2  GLN  17           2HG      GLN  17   4.239   8.542  -4.775
  145    HG3  GLN  17           1HG      GLN  17   3.702   7.606  -3.380
  146   HE21  GLN  17          2HE2      GLN  17   1.600   6.666  -6.704
  147   HE22  GLN  17          1HE2      GLN  17   1.647   8.300  -6.131
  148    H    ASN  18           H        ASN  18   0.926  10.570  -1.334
  149    HA   ASN  18           HA       ASN  18  -0.272  12.768  -2.818
  150    HB2  ASN  18           2HB      ASN  18  -1.071  11.452  -0.199
  151    HB3  ASN  18           1HB      ASN  18  -1.964  12.776  -0.939
  152   HD21  ASN  18          2HD2      ASN  18  -2.255   9.011  -2.379
  153   HD22  ASN  18          1HD2      ASN  18  -1.076   9.421  -1.204
  154    H    GLY  19           H        GLY  19   1.575  12.192  -0.007
  155    HA2  GLY  19           2HA      GLY  19   3.110  14.325   0.100
  156    HA3  GLY  19           1HA      GLY  19   1.613  14.960   0.772
  157    H    LYS  20           H        LYS  20   4.335  12.744   1.307
  158    HA   LYS  20           HA       LYS  20   4.109  11.493   3.592
  159    HB2  LYS  20           2HB      LYS  20   6.379  12.507   4.104
  160    HB3  LYS  20           1HB      LYS  20   6.208  11.719   2.534
  161    HG2  LYS  20           2HG      LYS  20   5.964  13.837   1.419
  162    HG3  LYS  20           1HG      LYS  20   5.869  14.683   2.953
  163    HD2  LYS  20           2HD      LYS  20   8.226  14.044   3.383
  164    HD3  LYS  20           1HD      LYS  20   8.279  13.310   1.770
  165    HE2  LYS  20           2HE      LYS  20   7.916  15.351   0.728
  166    HE3  LYS  20           1HE      LYS  20   7.405  16.125   2.220
  167    HZ1  LYS  20           3HZ      LYS  20  10.233  15.253   1.664
  168    HZ2  LYS  20           1HZ      LYS  20   9.643  15.957   3.069
  169    HZ3  LYS  20           2HZ      LYS  20   9.617  16.854   1.735
  170    H    SER  21           H        SER  21   3.637  11.990   5.841
  171    HA   SER  21           HA       SER  21   3.451  14.671   6.749
  172    HB2  SER  21           2HB      SER  21   0.907  13.300   5.854
  173    HB3  SER  21           1HB      SER  21   0.923  14.647   6.975
  174    HG   SER  21           HG       SER  21   1.652  14.569   4.257
  175    H    ILE  22           H        ILE  22   1.501  14.409   8.665
  176    HA   ILE  22           HA       ILE  22   2.846  12.697  10.517
  177    HB   ILE  22           HB       ILE  22   1.268  13.610  12.188
  178   HG12  ILE  22          2HG1      ILE  22   0.129  15.186   9.854
  179   HG13  ILE  22          1HG1      ILE  22  -0.689  13.873  10.688
  180   HG21  ILE  22          1HG2      ILE  22   3.350  14.778  11.750
  181   HG22  ILE  22          2HG2      ILE  22   2.072  15.940  12.098
  182   HG23  ILE  22          3HG2      ILE  22   2.598  15.679  10.436
  183   HD11  ILE  22          3HD1      ILE  22  -1.528  16.034  11.403
  184   HD12  ILE  22          1HD1      ILE  22   0.095  16.523  11.890
  185   HD13  ILE  22          2HD1      ILE  22  -0.723  15.211  12.737
  186    H    ALA  23           H        ALA  23   1.471  11.462  12.094
  187    HA   ALA  23           HA       ALA  23   0.440   9.179  10.943
  188    HB1  ALA  23           1HB      ALA  23   1.296   9.322  13.233
  189    HB2  ALA  23           2HB      ALA  23  -0.293   8.558  13.171
  190    HB3  ALA  23           3HB      ALA  23  -0.140  10.231  13.704
  191    H    LEU  24           H        LEU  24  -1.265  12.090  11.871
  192    HA   LEU  24           HA       LEU  24  -3.879  10.985  11.882
  193    HB2  LEU  24           2HB      LEU  24  -3.167  13.082  13.066
  194    HB3  LEU  24           1HB      LEU  24  -2.985  13.864  11.522
  195    HG   LEU  24           HG       LEU  24  -5.024  14.510  12.835
  196   HD11  LEU  24          1HD1      LEU  24  -5.580  13.328  10.126
  197   HD12  LEU  24          2HD1      LEU  24  -4.981  14.953  10.466
  198   HD13  LEU  24          3HD1      LEU  24  -6.602  14.487  10.977
  199   HD21  LEU  24          3HD2      LEU  24  -6.942  13.000  12.868
  200   HD22  LEU  24          1HD2      LEU  24  -5.578  12.341  13.771
  201   HD23  LEU  24          2HD2      LEU  24  -5.954  11.722  12.161
  202    H    THR  25           H        THR  25  -1.765  12.355   9.438
  203    HA   THR  25           HA       THR  25  -3.800  12.602   7.477
  204    HB   THR  25           HB       THR  25  -0.827  12.418   7.100
  205    HG1  THR  25           HG1      THR  25  -2.518  14.462   8.045
  206   HG21  THR  25          3HG2      THR  25  -1.305  13.616   5.034
  207   HG22  THR  25          1HG2      THR  25  -3.013  13.789   5.519
  208   HG23  THR  25          2HG2      THR  25  -2.372  12.201   5.188
  209    H    ILE  26           H        ILE  26  -1.122  10.349   8.098
  210    HA   ILE  26           HA       ILE  26  -1.455   8.602   6.015
  211    HB   ILE  26           HB       ILE  26  -0.918   7.580   8.836
  212   HG12  ILE  26          2HG1      ILE  26   1.074   8.697   6.805
  213   HG13  ILE  26          1HG1      ILE  26   0.583   9.528   8.273
  214   HG21  ILE  26          1HG2      ILE  26  -0.167   6.614   6.104
  215   HG22  ILE  26          2HG2      ILE  26  -1.419   5.973   7.164
  216   HG23  ILE  26          3HG2      ILE  26   0.288   5.836   7.643
  217   HD11  ILE  26          3HD1      ILE  26   1.585   7.738   9.602
  218   HD12  ILE  26          1HD1      ILE  26   2.755   8.488   8.517
  219   HD13  ILE  26          2HD1      ILE  26   2.067   6.914   8.119
  220    H    ALA  27           H        ALA  27  -3.201   8.657   9.059
  221    HA   ALA  27           HA       ALA  27  -4.754   6.394   8.797
  222    HB1  ALA  27           1HB      ALA  27  -5.522   8.987  10.107
  223    HB2  ALA  27           2HB      ALA  27  -4.520   7.724  10.820
  224    HB3  ALA  27           3HB      ALA  27  -6.217   7.392  10.441
  225    H    LYS  28           H        LYS  28  -5.436   9.695   7.575
  226    HA   LYS  28           HA       LYS  28  -8.017   8.855   6.656
  227    HB2  LYS  28           2HB      LYS  28  -8.098  10.929   5.426
  228    HB3  LYS  28           1HB      LYS  28  -7.786  11.181   7.182
  229    HG2  LYS  28           2HG      LYS  28  -5.597  11.872   6.680
  230    HG3  LYS  28           1HG      LYS  28  -5.696  11.242   5.039
  231    HD2  LYS  28           2HD      LYS  28  -7.322  13.559   6.094
  232    HD3  LYS  28           1HD      LYS  28  -5.834  13.717   5.162
  233    HE2  LYS  28           2HE      LYS  28  -8.453  12.502   4.204
  234    HE3  LYS  28           1HE      LYS  28  -7.736  14.016   3.688
  235    HZ1  LYS  28           3HZ      LYS  28  -7.121  12.465   1.961
  236    HZ2  LYS  28           1HZ      LYS  28  -6.714  11.271   3.078
  237    HZ3  LYS  28           2HZ      LYS  28  -5.770  12.557   2.952
  238    H    GLU  29           H        GLU  29  -4.981   9.363   5.294
  239    HA   GLU  29           HA       GLU  29  -5.595   9.052   2.549
  240    HB2  GLU  29           2HB      GLU  29  -2.995   8.139   3.781
  241    HB3  GLU  29           1HB      GLU  29  -3.278   8.511   2.095
  242    HG2  GLU  29           2HG      GLU  29  -3.019  10.358   4.425
  243    HG3  GLU  29           1HG      GLU  29  -2.110  10.305   2.926
  244    H    ILE  30           H        ILE  30  -4.553   6.627   4.883
  245    HA   ILE  30           HA       ILE  30  -4.946   4.589   2.849
  246    HB   ILE  30           HB       ILE  30  -4.071   2.943   4.444
  247   HG12  ILE  30          2HG1      ILE  30  -3.785   5.279   6.359
  248   HG13  ILE  30          1HG1      ILE  30  -4.926   3.959   6.552
  249   HG21  ILE  30          1HG2      ILE  30  -2.425   5.447   4.154
  250   HG22  ILE  30          2HG2      ILE  30  -2.486   4.076   3.041
  251   HG23  ILE  30          3HG2      ILE  30  -1.781   3.887   4.650
  252   HD11  ILE  30          3HD1      ILE  30  -3.023   2.396   6.771
  253   HD12  ILE  30          1HD1      ILE  30  -3.012   3.649   8.006
  254   HD13  ILE  30          2HD1      ILE  30  -1.914   3.755   6.630
  255    H    GLY  31           H        GLY  31  -6.806   6.067   5.145
  256    HA2  GLY  31           2HA      GLY  31  -9.013   5.767   5.696
  257    HA3  GLY  31           1HA      GLY  31  -9.049   4.403   4.588
  258    H    LEU  32           H        LEU  32  -6.733   4.544   7.141
  259    HA   LEU  32           HA       LEU  32  -8.201   2.351   8.436
  260    HB2  LEU  32           2HB      LEU  32  -5.197   2.673   8.501
  261    HB3  LEU  32           1HB      LEU  32  -6.122   1.332   9.125
  262    HG   LEU  32           HG       LEU  32  -5.432   1.992   6.285
  263   HD11  LEU  32          1HD1      LEU  32  -5.108  -0.508   7.891
  264   HD12  LEU  32          2HD1      LEU  32  -3.856   0.669   7.522
  265   HD13  LEU  32          3HD1      LEU  32  -4.594  -0.268   6.222
  266   HD21  LEU  32          3HD2      LEU  32  -7.609   0.092   7.167
  267   HD22  LEU  32          1HD2      LEU  32  -6.886   0.157   5.541
  268   HD23  LEU  32          2HD2      LEU  32  -7.734   1.561   6.171
  269    H    ASP  33           H        ASP  33  -7.393   2.066  10.761
  270    HA   ASP  33           HA       ASP  33  -8.079   4.519  12.073
  271    HB2  ASP  33           2HB      ASP  33  -8.974   2.313  12.843
  272    HB3  ASP  33           1HB      ASP  33  -7.349   1.832  13.267
  273    H    LYS  34           H        LYS  34  -6.929   5.175  13.969
  274    HA   LYS  34           HA       LYS  34  -4.261   5.968  13.598
  275    HB2  LYS  34           2HB      LYS  34  -4.458   6.745  15.936
  276    HB3  LYS  34           1HB      LYS  34  -5.904   7.150  15.012
  277    HG2  LYS  34           2HG      LYS  34  -6.795   4.884  15.920
  278    HG3  LYS  34           1HG      LYS  34  -5.542   5.082  17.134
  279    HD2  LYS  34           2HD      LYS  34  -6.538   7.168  17.849
  280    HD3  LYS  34           1HD      LYS  34  -7.728   7.070  16.542
  281    HE2  LYS  34           2HE      LYS  34  -7.431   5.166  18.866
  282    HE3  LYS  34           1HE      LYS  34  -8.756   6.293  18.588
  283    HZ1  LYS  34           3HZ      LYS  34  -9.493   4.094  17.858
  284    HZ2  LYS  34           1HZ      LYS  34  -8.115   3.877  16.920
  285    HZ3  LYS  34           2HZ      LYS  34  -9.174   4.969  16.442
  286    H    SER  35           H        SER  35  -5.673   3.039  15.078
  287    HA   SER  35           HA       SER  35  -3.404   2.317  16.594
  288    HB2  SER  35           2HB      SER  35  -5.686   1.453  17.058
  289    HB3  SER  35           1HB      SER  35  -5.667   0.606  15.514
  290    HG   SER  35           HG       SER  35  -4.462  -0.013  17.907
  291    H    THR  36           H        THR  36  -4.560   1.644  13.310
  292    HA   THR  36           HA       THR  36  -2.519  -0.142  12.724
  293    HB   THR  36           HB       THR  36  -3.364   0.999  10.325
  294    HG1  THR  36           HG1      THR  36  -4.981   2.215  11.299
  295   HG21  THR  36          3HG2      THR  36  -4.588  -1.202  11.943
  296   HG22  THR  36          1HG2      THR  36  -3.175  -1.394  10.891
  297   HG23  THR  36          2HG2      THR  36  -4.752  -0.988  10.188
  298    H    VAL  37           H        VAL  37  -2.874   3.385  11.919
  299    HA   VAL  37           HA       VAL  37  -0.501   3.661  10.548
  300    HB   VAL  37           HB       VAL  37  -1.913   5.561  12.359
  301   HG11  VAL  37          1HG1      VAL  37  -0.900   7.328  10.917
  302   HG12  VAL  37          2HG1      VAL  37   0.083   6.067  10.150
  303   HG13  VAL  37          3HG1      VAL  37   0.252   6.412  11.875
  304   HG21  VAL  37          3HG2      VAL  37  -2.240   5.073   9.413
  305   HG22  VAL  37          1HG2      VAL  37  -2.999   6.390  10.301
  306   HG23  VAL  37          2HG2      VAL  37  -3.416   4.722  10.685
  307    H    ASN  38           H        ASN  38  -1.118   4.132  14.030
  308    HA   ASN  38           HA       ASN  38   1.471   4.931  14.657
  309    HB2  ASN  38           2HB      ASN  38  -0.733   3.803  16.332
  310    HB3  ASN  38           1HB      ASN  38   0.871   4.013  17.025
  311   HD21  ASN  38          2HD2      ASN  38  -1.507   7.194  16.373
  312   HD22  ASN  38          1HD2      ASN  38  -1.946   5.604  15.807
  313    H    ARG  39           H        ARG  39   0.074   1.713  14.615
  314    HA   ARG  39           HA       ARG  39   2.335   0.493  15.853
  315    HB2  ARG  39           2HB      ARG  39   1.438  -1.654  15.274
  316    HB3  ARG  39           1HB      ARG  39   0.067  -0.610  15.640
  317    HG2  ARG  39           2HG      ARG  39  -0.291  -0.322  13.212
  318    HG3  ARG  39           1HG      ARG  39   1.025  -1.453  12.913
  319    HD2  ARG  39           2HD      ARG  39  -1.061  -2.621  12.721
  320    HD3  ARG  39           1HD      ARG  39  -0.242  -3.169  14.180
  321    HE   ARG  39           HE       ARG  39  -1.879  -1.119  14.972
  322   HH11  ARG  39          1HH1      ARG  39  -2.359  -4.217  13.355
  323   HH12  ARG  39          2HH1      ARG  39  -3.900  -4.531  14.005
  324   HH21  ARG  39          2HH2      ARG  39  -4.884  -2.915  15.515
  325   HH22  ARG  39          1HH2      ARG  39  -4.042  -1.507  15.919
  326    H    HIS  40           H        HIS  40   1.527   1.213  12.575
  327    HA   HIS  40           HA       HIS  40   3.674  -0.286  11.438
  328    HB2  HIS  40           2HB      HIS  40   1.873   1.833  10.315
  329    HB3  HIS  40           1HB      HIS  40   3.124   1.095   9.347
  330    HD1  HIS  40           HD1      HIS  40   2.673  -1.924   9.379
  331    HD2  HIS  40           HD2      HIS  40  -0.509   0.722   9.983
  332    HE1  HIS  40           HE1      HIS  40   0.624  -3.199   8.964
  333    H    LEU  41           H        LEU  41   3.257   3.081  12.384
  334    HA   LEU  41           HA       LEU  41   5.727   3.827  11.156
  335    HB2  LEU  41           2HB      LEU  41   5.414   6.016  12.186
  336    HB3  LEU  41           1HB      LEU  41   4.058   5.532  11.186
  337    HG   LEU  41           HG       LEU  41   3.044   4.812  13.494
  338   HD11  LEU  41          1HD1      LEU  41   4.990   5.244  14.864
  339   HD12  LEU  41          2HD1      LEU  41   3.641   6.274  15.339
  340   HD13  LEU  41          3HD1      LEU  41   4.968   6.945  14.388
  341   HD21  LEU  41          3HD2      LEU  41   1.942   6.901  13.660
  342   HD22  LEU  41          1HD2      LEU  41   2.183   6.437  11.983
  343   HD23  LEU  41          2HD2      LEU  41   3.210   7.700  12.701
  344    H    TYR  42           H        TYR  42   4.722   2.808  14.344
  345    HA   TYR  42           HA       TYR  42   6.952   3.667  15.658
  346    HB2  TYR  42           2HB      TYR  42   4.689   1.986  15.985
  347    HB3  TYR  42           1HB      TYR  42   6.029   1.433  16.912
  348    HD1  TYR  42           HD1      TYR  42   7.125   3.317  18.362
  349    HD2  TYR  42           HD2      TYR  42   3.292   3.606  16.693
  350    HE1  TYR  42           HE1      TYR  42   6.579   5.073  20.029
  351    HE2  TYR  42           HE2      TYR  42   2.676   5.383  18.339
  352    HH   TYR  42           HH       TYR  42   3.381   6.189  20.503
  353    H    ASN  43           H        ASN  43   6.169   0.828  13.922
  354    HA   ASN  43           HA       ASN  43   8.563  -0.558  14.676
  355    HB2  ASN  43           2HB      ASN  43   6.534  -1.108  12.536
  356    HB3  ASN  43           1HB      ASN  43   8.059  -1.988  12.538
  357   HD21  ASN  43          2HD2      ASN  43   5.218  -2.857  15.254
  358   HD22  ASN  43          1HD2      ASN  43   5.034  -1.482  14.212
  359    H    LEU  44           H        LEU  44   7.695   1.405  11.918
  360    HA   LEU  44           HA       LEU  44  10.226   1.042  10.674
  361    HB2  LEU  44           2HB      LEU  44   8.336   3.340  10.236
  362    HB3  LEU  44           1HB      LEU  44   9.646   2.870   9.239
  363    HG   LEU  44           HG       LEU  44   7.144   1.264   9.632
  364   HD11  LEU  44          1HD1      LEU  44   6.764   3.232   8.292
  365   HD12  LEU  44          2HD1      LEU  44   6.841   1.842   7.194
  366   HD13  LEU  44          3HD1      LEU  44   8.215   2.920   7.353
  367   HD21  LEU  44          3HD2      LEU  44   9.555   0.750   7.876
  368   HD22  LEU  44          1HD2      LEU  44   8.056  -0.176   7.850
  369   HD23  LEU  44          2HD2      LEU  44   9.077  -0.198   9.284
  370    H    GLN  45           H        GLN  45   9.083   3.204  13.217
  371    HA   GLN  45           HA       GLN  45  10.960   5.257  12.813
  372    HB2  GLN  45           2HB      GLN  45   8.929   5.566  14.044
  373    HB3  GLN  45           1HB      GLN  45   9.437   4.381  15.236
  374    HG2  GLN  45           2HG      GLN  45  11.080   5.780  16.102
  375    HG3  GLN  45           1HG      GLN  45  11.043   6.826  14.673
  376   HE21  GLN  45          2HE2      GLN  45   8.420   8.716  15.704
  377   HE22  GLN  45          1HE2      GLN  45   9.522   8.307  14.456
  378    H    ARG  46           H        ARG  46  10.841   2.288  14.581
  379    HA   ARG  46           HA       ARG  46  13.335   2.773  16.002
  380    HB2  ARG  46           2HB      ARG  46  11.823   0.183  15.794
  381    HB3  ARG  46           1HB      ARG  46  12.962   0.658  17.055
  382    HG2  ARG  46           2HG      ARG  46  10.236   1.855  16.557
  383    HG3  ARG  46           1HG      ARG  46  10.680   0.785  17.886
  384    HD2  ARG  46           2HD      ARG  46  11.795   2.428  19.008
  385    HD3  ARG  46           1HD      ARG  46  12.248   3.291  17.543
  386    HE   ARG  46           HE       ARG  46   9.830   3.877  17.402
  387   HH11  ARG  46          1HH1      ARG  46  11.303   3.230  20.568
  388   HH12  ARG  46          2HH1      ARG  46  10.490   4.469  21.403
  389   HH21  ARG  46          2HH2      ARG  46   8.968   5.912  20.217
  390   HH22  ARG  46          1HH2      ARG  46   8.751   5.704  18.555
  391    H    SER  47           H        SER  47  12.363   1.574  13.033
  392    HA   SER  47           HA       SER  47  14.808   0.073  12.635
  393    HB2  SER  47           2HB      SER  47  12.691  -0.946  11.891
  394    HB3  SER  47           1HB      SER  47  12.383   0.442  10.854
  395    HG   SER  47           HG       SER  47  14.635  -0.229  10.032
  396    H    ASN  48           H        ASN  48  13.855   3.298  12.477
  397    HA   ASN  48           HA       ASN  48  14.670   5.155  11.530
  398    HB2  ASN  48           2HB      ASN  48  16.819   3.969  12.167
  399    HB3  ASN  48           1HB      ASN  48  16.947   3.415  10.508
  400   HD21  ASN  48          2HD2      ASN  48  17.954   7.208  11.502
  401   HD22  ASN  48          1HD2      ASN  48  17.166   6.157  12.638
  402    H    GLN  49           H        GLN  49  12.826   3.488  10.167
  403    HA   GLN  49           HA       GLN  49  13.553   3.785   7.321
  404    HB2  GLN  49           2HB      GLN  49  12.807   1.508   8.448
  405    HB3  GLN  49           1HB      GLN  49  11.208   2.194   8.390
  406    HG2  GLN  49           2HG      GLN  49  12.975   1.357   6.103
  407    HG3  GLN  49           1HG      GLN  49  11.373   0.771   6.519
  408   HE21  GLN  49          2HE2      GLN  49   9.772   3.466   4.912
  409   HE22  GLN  49          1HE2      GLN  49   9.576   2.227   6.124
  410    H    VAL  50           H        VAL  50  11.468   4.684   9.934
  411    HA   VAL  50           HA       VAL  50  10.503   6.789   8.261
  412    HB   VAL  50           HB       VAL  50   8.737   4.781   8.646
  413   HG11  VAL  50          1HG1      VAL  50   8.963   4.964  11.068
  414   HG12  VAL  50          2HG1      VAL  50   7.267   5.127  10.526
  415   HG13  VAL  50          3HG1      VAL  50   8.198   6.548  11.022
  416   HG21  VAL  50          3HG2      VAL  50   6.914   6.400   8.361
  417   HG22  VAL  50          1HG2      VAL  50   8.296   6.731   7.316
  418   HG23  VAL  50          2HG2      VAL  50   8.038   7.702   8.766
  419    H    PHE  51           H        PHE  51  10.384   8.512   9.462
  420    HA   PHE  51           HA       PHE  51   9.918   8.630  12.199
  421    HB2  PHE  51           2HB      PHE  51  12.137   9.713  12.964
  422    HB3  PHE  51           1HB      PHE  51  12.133   7.974  12.721
  423    HD1  PHE  51           HD1      PHE  51  13.333  11.173  11.386
  424    HD2  PHE  51           HD2      PHE  51  13.436   6.951  11.092
  425    HE1  PHE  51           HE1      PHE  51  15.338  11.324   9.940
  426    HE2  PHE  51           HE2      PHE  51  15.395   7.050   9.685
  427    HZ   PHE  51           HZ       PHE  51  16.380   9.259   9.080
  428    H    ASN  52           H        ASN  52  10.400  10.983  13.086
  429    HA   ASN  52           HA       ASN  52   9.378  12.691  11.018
  430    HB2  ASN  52           2HB      ASN  52   9.207  14.383  12.914
  431    HB3  ASN  52           1HB      ASN  52   8.069  13.057  12.840
  432   HD21  ASN  52          2HD2      ASN  52   9.604  13.698  16.280
  433   HD22  ASN  52          1HD2      ASN  52   8.995  14.781  15.065
  434    H    SER  53           H        SER  53  10.414  14.259  10.106
  435    HA   SER  53           HA       SER  53  13.059  14.832  11.096
  436    HB2  SER  53           2HB      SER  53  13.283  12.668  10.015
  437    HB3  SER  53           1HB      SER  53  12.573  13.335   8.549
  438    HG   SER  53           HG       SER  53  14.364  14.200   8.045
  439    H    ASN  54           H        ASN  54  14.000  16.321  10.210
  440    HA   ASN  54           HA       ASN  54  14.849  18.118   9.161
  441    HB2  ASN  54           2HB      ASN  54  15.452  17.658   6.906
  442    HB3  ASN  54           1HB      ASN  54  15.314  16.201   7.918
  443   HD21  ASN  54          2HD2      ASN  54  12.716  16.574   4.821
  444   HD22  ASN  54          1HD2      ASN  54  13.617  17.953   5.340
  445    H    GLU  55           H        GLU  55  11.478  17.927   8.303
  446    HA   GLU  55           HA       GLU  55  12.014  20.451   7.012
  447    HB2  GLU  55           2HB      GLU  55   9.869  20.036   5.658
  448    HB3  GLU  55           1HB      GLU  55  11.340  19.179   5.248
  449    HG2  GLU  55           2HG      GLU  55  10.390  17.300   6.722
  450    HG3  GLU  55           1HG      GLU  55   8.848  18.134   6.523
  451    H    LYS  56           H        LYS  56   9.647  21.665   6.680
  452    HA   LYS  56           HA       LYS  56   9.426  22.619   9.307
  453    HB2  LYS  56           2HB      LYS  56   8.325  23.547   6.702
  454    HB3  LYS  56           1HB      LYS  56   7.622  24.172   8.189
  455    HG2  LYS  56           2HG      LYS  56   9.405  25.594   7.197
  456    HG3  LYS  56           1HG      LYS  56   9.706  25.111   8.873
  457    HD2  LYS  56           2HD      LYS  56  10.901  23.254   6.992
  458    HD3  LYS  56           1HD      LYS  56  11.449  24.896   6.673
  459    HE2  LYS  56           2HE      LYS  56  12.973  23.754   8.226
  460    HE3  LYS  56           1HE      LYS  56  12.185  25.113   9.012
  461    HZ1  LYS  56           3HZ      LYS  56  12.325  23.115  10.424
  462    HZ2  LYS  56           1HZ      LYS  56  11.360  22.245   9.362
  463    HZ3  LYS  56           2HZ      LYS  56  10.726  23.566  10.186
  464    HA   PRO  57           HA       PRO  57   5.408  20.402   9.663
  465    HB2  PRO  57           2HB      PRO  57   5.014  18.662   7.360
  466    HB3  PRO  57           1HB      PRO  57   3.913  19.925   7.938
  467    HG2  PRO  57           2HG      PRO  57   5.211  20.080   5.567
  468    HG3  PRO  57           1HG      PRO  57   4.706  21.494   6.515
  469    HD2  PRO  57           2HD      PRO  57   7.404  20.242   6.309
  470    HD3  PRO  57           1HD      PRO  57   6.952  21.961   6.361
  471    HA   PRO  58           HA       PRO  58   8.651  17.353  10.699
  472    HB2  PRO  58           2HB      PRO  58   6.433  16.273  12.383
  473    HB3  PRO  58           1HB      PRO  58   8.092  16.693  12.863
  474    HG2  PRO  58           2HG      PRO  58   6.078  18.249  13.567
  475    HG3  PRO  58           1HG      PRO  58   7.642  18.931  13.075
  476    HD2  PRO  58           2HD      PRO  58   5.084  18.830  11.553
  477    HD3  PRO  58           1HD      PRO  58   6.345  20.079  11.582
  478    H    VAL  59           H        VAL  59   8.934  15.887   9.055
  479    HA   VAL  59           HA       VAL  59   6.596  14.786   7.838
  480    HB   VAL  59           HB       VAL  59   8.733  15.408   6.564
  481   HG11  VAL  59          1HG1      VAL  59   9.658  12.673   7.452
  482   HG12  VAL  59          2HG1      VAL  59  10.416  14.193   7.945
  483   HG13  VAL  59          3HG1      VAL  59  10.428  13.683   6.251
  484   HG21  VAL  59          3HG2      VAL  59   8.492  13.384   5.080
  485   HG22  VAL  59          1HG2      VAL  59   7.029  14.349   5.388
  486   HG23  VAL  59          2HG2      VAL  59   7.299  12.842   6.253
  487    H    TRP  60           H        TRP  60   5.709  12.815   8.113
  488    HA   TRP  60           HA       TRP  60   7.453  10.932   9.421
  489    HB2  TRP  60           2HB      TRP  60   4.411  10.929   9.335
  490    HB3  TRP  60           1HB      TRP  60   5.400   9.612   9.970
  491    HD1  TRP  60           HD1      TRP  60   4.856  13.347  10.643
  492    HE1  TRP  60           HE1      TRP  60   5.080  13.773  13.185
  493    HE3  TRP  60           HE3      TRP  60   6.123   8.650  12.096
  494    HZ2  TRP  60           HZ2      TRP  60   5.734  12.278  15.496
  495    HZ3  TRP  60           HZ3      TRP  60   6.550   8.221  14.481
  496    HH2  TRP  60           HH2      TRP  60   6.357   9.992  16.141
  497    H    ASP  61           H        ASP  61   8.482  10.249   7.954
  498    HA   ASP  61           HA       ASP  61   7.815   8.393   6.070
  499    HB2  ASP  61           2HB      ASP  61   6.638  10.281   4.850
  500    HB3  ASP  61           1HB      ASP  61   8.130  11.200   4.882
  501    H    LEU  62           H        LEU  62   9.738   8.493   4.469
  502    HA   LEU  62           HA       LEU  62  12.154   9.654   5.556
  503    HB2  LEU  62           2HB      LEU  62  11.847   7.232   6.243
  504    HB3  LEU  62           1HB      LEU  62  11.939   6.868   4.520
  505    HG   LEU  62           HG       LEU  62  14.042   6.384   5.877
  506   HD11  LEU  62          1HD1      LEU  62  14.144   6.497   3.475
  507   HD12  LEU  62          2HD1      LEU  62  15.591   7.209   4.195
  508   HD13  LEU  62          3HD1      LEU  62  14.323   8.250   3.543
  509   HD21  LEU  62          3HD2      LEU  62  14.002   8.368   7.281
  510   HD22  LEU  62          1HD2      LEU  62  14.264   9.389   5.870
  511   HD23  LEU  62          2HD2      LEU  62  15.515   8.258   6.381
  512    H    MET  63           H        MET  63  13.430  10.287   3.802
  513    HA   MET  63           HA       MET  63  11.833  10.300   1.411
  514    HB2  MET  63           2HB      MET  63  14.001  12.208   2.122
  515    HB3  MET  63           1HB      MET  63  13.258  11.961   0.529
  516    HG2  MET  63           2HG      MET  63  11.044  12.511   1.473
  517    HG3  MET  63           1HG      MET  63  11.804  12.856   3.024
  518    HE1  MET  63           3HE      MET  63  13.327  13.771  -0.520
  519    HE2  MET  63           1HE      MET  63  12.603  15.353  -0.793
  520    HE3  MET  63           2HE      MET  63  11.586  13.911  -0.769
  521    H    GLU  64           H        GLU  64  12.611  10.098  -0.518
  522    HA   GLU  64           HA       GLU  64  14.923   8.537  -0.955
  523    HB2  GLU  64           2HB      GLU  64  13.405   7.360   0.485
  524    HB3  GLU  64           1HB      GLU  64  12.124   7.582  -0.650
  525    HG2  GLU  64           2HG      GLU  64  13.553   6.242  -2.345
  526    HG3  GLU  64           1HG      GLU  64  14.523   5.753  -0.950
  Start of MODEL    9
    1    HA   MET   1           HA       MET   1  14.618  -5.336  -3.479
    2    HB2  MET   1           2HB      MET   1  14.714  -7.172  -5.147
    3    HB3  MET   1           1HB      MET   1  13.357  -7.963  -4.364
    4    HG2  MET   1           2HG      MET   1  11.932  -6.027  -4.933
    5    HG3  MET   1           1HG      MET   1  13.296  -5.296  -5.775
    6    HE1  MET   1           2HE      MET   1  14.658  -7.815  -7.230
    7    HE2  MET   1           3HE      MET   1  14.351  -6.269  -8.024
    8    HE3  MET   1           1HE      MET   1  13.821  -7.773  -8.779
    9    H    SER   2           H        SER   2  12.156  -7.889  -2.851
   10    HA   SER   2           HA       SER   2  10.411  -6.091  -1.623
   11    HB2  SER   2           2HB      SER   2  10.473  -9.094  -1.441
   12    HB3  SER   2           1HB      SER   2   9.065  -8.025  -1.501
   13    HG   SER   2           HG       SER   2   9.117  -8.350  -3.567
   14    H    ALA   3           H        ALA   3   9.817  -6.206   0.633
   15    HA   ALA   3           HA       ALA   3  11.668  -7.528   2.505
   16    HB1  ALA   3           1HB      ALA   3  10.847  -4.617   2.673
   17    HB2  ALA   3           2HB      ALA   3  12.456  -5.179   2.221
   18    HB3  ALA   3           3HB      ALA   3  11.830  -5.505   3.837
   19    H    GLU   4           H        GLU   4  10.799  -7.050   4.748
   20    HA   GLU   4           HA       GLU   4   8.210  -8.260   4.601
   21    HB2  GLU   4           2HB      GLU   4   8.902  -8.804   7.116
   22    HB3  GLU   4           1HB      GLU   4   9.490  -9.679   5.697
   23    HG2  GLU   4           2HG      GLU   4  11.245  -9.205   7.428
   24    HG3  GLU   4           1HG      GLU   4  11.618  -8.704   5.789
   25    H    THR   5           H        THR   5   9.842  -5.617   6.287
   26    HA   THR   5           HA       THR   5   7.372  -4.673   7.408
   27    HB   THR   5           HB       THR   5   9.594  -4.377   8.571
   28    HG1  THR   5           HG1      THR   5   7.662  -2.911   8.707
   29   HG21  THR   5          3HG2      THR   5  10.108  -2.331   6.398
   30   HG22  THR   5          1HG2      THR   5  10.984  -3.847   6.614
   31   HG23  THR   5          2HG2      THR   5  11.110  -2.574   7.829
   32    H    GLN   6           H        GLN   6   8.099  -4.894   4.451
   33    HA   GLN   6           HA       GLN   6   7.884  -2.287   3.323
   34    HB2  GLN   6           2HB      GLN   6   8.827  -4.333   2.163
   35    HB3  GLN   6           1HB      GLN   6   7.177  -4.902   1.987
   36    HG2  GLN   6           2HG      GLN   6   6.650  -2.866   0.688
   37    HG3  GLN   6           1HG      GLN   6   8.341  -2.389   0.805
   38   HE21  GLN   6          2HE2      GLN   6   7.584  -4.213  -2.376
   39   HE22  GLN   6          1HE2      GLN   6   6.782  -2.921  -1.550
   40    H    MET   7           H        MET   7   5.695  -4.293   4.879
   41    HA   MET   7           HA       MET   7   3.307  -3.584   3.474
   42    HB2  MET   7           2HB      MET   7   3.622  -4.462   6.362
   43    HB3  MET   7           1HB      MET   7   2.116  -4.427   5.461
   44    HG2  MET   7           2HG      MET   7   4.490  -6.181   4.865
   45    HG3  MET   7           1HG      MET   7   3.002  -6.687   5.660
   46    HE1  MET   7           3HE      MET   7   2.862  -8.694   3.904
   47    HE2  MET   7           1HE      MET   7   4.330  -8.115   3.114
   48    HE3  MET   7           2HE      MET   7   2.895  -8.471   2.154
   49    H    GLU   8           H        GLU   8   4.879  -2.505   6.411
   50    HA   GLU   8           HA       GLU   8   3.275  -0.298   6.999
   51    HB2  GLU   8           2HB      GLU   8   6.212  -0.771   7.524
   52    HB3  GLU   8           1HB      GLU   8   5.271   0.513   8.257
   53    HG2  GLU   8           2HG      GLU   8   5.632  -1.248   9.827
   54    HG3  GLU   8           1HG      GLU   8   3.930  -1.210   9.415
   55    H    ARG   9           H        ARG   9   6.080  -0.742   5.025
   56    HA   ARG   9           HA       ARG   9   6.505   2.028   4.412
   57    HB2  ARG   9           2HB      ARG   9   8.005  -0.215   4.129
   58    HB3  ARG   9           1HB      ARG   9   7.378  -0.086   2.502
   59    HG2  ARG   9           2HG      ARG   9   8.954   2.067   3.911
   60    HG3  ARG   9           1HG      ARG   9   9.652   0.859   2.857
   61    HD2  ARG   9           2HD      ARG   9   8.312   1.798   0.975
   62    HD3  ARG   9           1HD      ARG   9   7.709   3.050   2.074
   63    HE   ARG   9           HE       ARG   9  10.490   3.040   2.266
   64   HH11  ARG   9          1HH1      ARG   9   8.170   3.890  -0.408
   65   HH12  ARG   9          2HH1      ARG   9   9.255   5.043  -0.992
   66   HH21  ARG   9          2HH2      ARG   9  11.299   5.469  -0.072
   67   HH22  ARG   9          1HH2      ARG   9  11.909   4.541   1.210
   68    H    LYS  10           H        LYS  10   4.658  -0.535   2.807
   69    HA   LYS  10           HA       LYS  10   4.239   1.050   0.481
   70    HB2  LYS  10           2HB      LYS  10   2.736  -0.647  -0.306
   71    HB3  LYS  10           1HB      LYS  10   4.073  -1.455   0.495
   72    HG2  LYS  10           2HG      LYS  10   2.643  -1.680   2.512
   73    HG3  LYS  10           1HG      LYS  10   1.308  -1.012   1.583
   74    HD2  LYS  10           2HD      LYS  10   1.527  -2.877  -0.018
   75    HD3  LYS  10           1HD      LYS  10   2.812  -3.558   0.986
   76    HE2  LYS  10           2HE      LYS  10   1.207  -3.622   2.889
   77    HE3  LYS  10           1HE      LYS  10  -0.060  -3.104   1.781
   78    HZ1  LYS  10           3HZ      LYS  10   1.508  -5.609   1.654
   79    HZ2  LYS  10           1HZ      LYS  10   0.388  -5.133   0.461
   80    HZ3  LYS  10           2HZ      LYS  10  -0.118  -5.460   2.048
   81    H    ILE  11           H        ILE  11   2.488   0.827   3.576
   82    HA   ILE  11           HA       ILE  11   0.233   2.134   2.442
   83    HB   ILE  11           HB       ILE  11  -0.513   2.427   4.742
   84   HG12  ILE  11          2HG1      ILE  11   2.162   1.209   5.410
   85   HG13  ILE  11          1HG1      ILE  11   1.504   2.741   5.959
   86   HG21  ILE  11          1HG2      ILE  11  -0.761  -0.011   5.212
   87   HG22  ILE  11          2HG2      ILE  11   0.550  -0.280   4.052
   88   HG23  ILE  11          3HG2      ILE  11  -0.995   0.374   3.489
   89   HD11  ILE  11          3HD1      ILE  11  -0.187   1.476   7.248
   90   HD12  ILE  11          1HD1      ILE  11   1.500   1.131   7.720
   91   HD13  ILE  11          2HD1      ILE  11   0.637   0.011   6.665
   92    H    ILE  12           H        ILE  12   3.110   3.135   4.224
   93    HA   ILE  12           HA       ILE  12   2.147   5.818   4.247
   94    HB   ILE  12           HB       ILE  12   4.069   6.482   5.317
   95   HG12  ILE  12          2HG1      ILE  12   6.134   4.636   5.140
   96   HG13  ILE  12          1HG1      ILE  12   5.442   4.643   3.532
   97   HG21  ILE  12          1HG2      ILE  12   2.984   4.937   6.744
   98   HG22  ILE  12          2HG2      ILE  12   4.729   4.846   6.986
   99   HG23  ILE  12          3HG2      ILE  12   3.901   3.597   6.057
  100   HD11  ILE  12          3HD1      ILE  12   6.375   7.145   4.927
  101   HD12  ILE  12          1HD1      ILE  12   5.620   7.072   3.348
  102   HD13  ILE  12          2HD1      ILE  12   7.191   6.328   3.594
  103    H    ASP  13           H        ASP  13   3.889   3.783   2.079
  104    HA   ASP  13           HA       ASP  13   5.253   5.591   0.454
  105    HB2  ASP  13           2HB      ASP  13   5.132   2.980   0.457
  106    HB3  ASP  13           1HB      ASP  13   3.816   3.216  -0.688
  107    H    PHE  14           H        PHE  14   2.035   4.194   0.115
  108    HA   PHE  14           HA       PHE  14   1.058   5.635  -2.006
  109    HB2  PHE  14           2HB      PHE  14  -0.168   3.785  -1.127
  110    HB3  PHE  14           1HB      PHE  14  -0.252   4.512   0.469
  111    HD1  PHE  14           HD1      PHE  14  -1.842   6.120   0.987
  112    HD2  PHE  14           HD2      PHE  14  -1.587   4.578  -2.930
  113    HE1  PHE  14           HE1      PHE  14  -4.032   7.106   0.499
  114    HE2  PHE  14           HE2      PHE  14  -3.795   5.555  -3.481
  115    HZ   PHE  14           HZ       PHE  14  -5.027   6.828  -1.761
  116    H    LEU  15           H        LEU  15   0.813   6.452   1.504
  117    HA   LEU  15           HA       LEU  15  -0.367   8.902   1.094
  118    HB2  LEU  15           2HB      LEU  15  -0.752   8.241   3.023
  119    HB3  LEU  15           1HB      LEU  15   0.663   7.232   3.225
  120    HG   LEU  15           HG       LEU  15   0.352   8.755   4.955
  121   HD11  LEU  15          1HD1      LEU  15   2.539   9.957   5.064
  122   HD12  LEU  15          2HD1      LEU  15   2.775   9.541   3.361
  123   HD13  LEU  15          3HD1      LEU  15   2.644   8.267   4.571
  124   HD21  LEU  15          3HD2      LEU  15  -0.876  10.554   4.048
  125   HD22  LEU  15          1HD2      LEU  15   0.446  10.959   2.942
  126   HD23  LEU  15          2HD2      LEU  15   0.625  11.245   4.675
  127    H    ARG  16           H        ARG  16   2.928   7.949   1.189
  128    HA   ARG  16           HA       ARG  16   4.148  10.406   1.345
  129    HB2  ARG  16           2HB      ARG  16   5.502   8.549   1.728
  130    HB3  ARG  16           1HB      ARG  16   4.949   7.724   0.283
  131    HG2  ARG  16           2HG      ARG  16   6.297   8.942  -1.082
  132    HG3  ARG  16           1HG      ARG  16   6.524  10.217   0.110
  133    HD2  ARG  16           2HD      ARG  16   7.807   8.547   1.512
  134    HD3  ARG  16           1HD      ARG  16   7.620   7.368   0.239
  135    HE   ARG  16           HE       ARG  16   9.308   8.369  -0.947
  136   HH11  ARG  16          1HH1      ARG  16   8.458  10.470   1.751
  137   HH12  ARG  16          2HH1      ARG  16   9.637  11.646   1.456
  138   HH21  ARG  16          2HH2      ARG  16  11.081  11.394  -0.498
  139   HH22  ARG  16          1HH2      ARG  16  10.942   9.950  -1.412
  140    H    GLN  17           H        GLN  17   3.013   8.583  -1.349
  141    HA   GLN  17           HA       GLN  17   3.798  10.290  -3.459
  142    HB2  GLN  17           2HB      GLN  17   1.321   8.562  -3.389
  143    HB3  GLN  17           1HB      GLN  17   2.106   9.195  -4.821
  144    HG2  GLN  17           2HG      GLN  17   4.040   7.777  -4.390
  145    HG3  GLN  17           1HG      GLN  17   3.264   7.166  -2.926
  146   HE21  GLN  17          2HE2      GLN  17   2.193   5.766  -6.539
  147   HE22  GLN  17          1HE2      GLN  17   3.273   7.119  -6.378
  148    H    ASN  18           H        ASN  18   0.930  10.286  -1.363
  149    HA   ASN  18           HA       ASN  18  -0.282  12.426  -2.920
  150    HB2  ASN  18           2HB      ASN  18  -1.145  11.092  -0.340
  151    HB3  ASN  18           1HB      ASN  18  -2.056  12.377  -1.129
  152   HD21  ASN  18          2HD2      ASN  18  -2.071   8.615  -2.608
  153   HD22  ASN  18          1HD2      ASN  18  -0.966   9.061  -1.380
  154    H    GLY  19           H        GLY  19   1.539  11.989  -0.115
  155    HA2  GLY  19           2HA      GLY  19   2.886  14.202   0.167
  156    HA3  GLY  19           1HA      GLY  19   1.299  14.804   0.618
  157    H    LYS  20           H        LYS  20   3.901  12.523   1.535
  158    HA   LYS  20           HA       LYS  20   3.363  11.560   3.880
  159    HB2  LYS  20           2HB      LYS  20   5.731  12.403   4.514
  160    HB3  LYS  20           1HB      LYS  20   5.494  11.237   3.225
  161    HG2  LYS  20           2HG      LYS  20   7.133  12.841   2.542
  162    HG3  LYS  20           1HG      LYS  20   5.677  13.080   1.576
  163    HD2  LYS  20           2HD      LYS  20   5.087  14.998   2.992
  164    HD3  LYS  20           1HD      LYS  20   6.542  14.770   3.945
  165    HE2  LYS  20           2HE      LYS  20   7.855  15.089   1.846
  166    HE3  LYS  20           1HE      LYS  20   6.343  15.521   1.045
  167    HZ1  LYS  20           3HZ      LYS  20   7.432  17.548   1.807
  168    HZ2  LYS  20           1HZ      LYS  20   7.639  16.885   3.320
  169    HZ3  LYS  20           2HZ      LYS  20   6.127  17.283   2.876
  170    H    SER  21           H        SER  21   3.611  12.158   6.172
  171    HA   SER  21           HA       SER  21   3.362  14.791   7.049
  172    HB2  SER  21           2HB      SER  21   1.375  14.839   5.517
  173    HB3  SER  21           1HB      SER  21   0.672  13.503   6.418
  174    HG   SER  21           HG       SER  21   0.731  16.164   6.945
  175    H    ILE  22           H        ILE  22   1.340  14.413   8.935
  176    HA   ILE  22           HA       ILE  22   2.727  12.726  10.795
  177    HB   ILE  22           HB       ILE  22   1.011  13.443  12.434
  178   HG12  ILE  22          2HG1      ILE  22  -0.136  15.041  10.119
  179   HG13  ILE  22          1HG1      ILE  22  -0.897  13.640  10.858
  180   HG21  ILE  22          1HG2      ILE  22   3.019  14.776  12.144
  181   HG22  ILE  22          2HG2      ILE  22   1.642  15.826  12.480
  182   HG23  ILE  22          3HG2      ILE  22   2.257  15.679  10.834
  183   HD11  ILE  22          3HD1      ILE  22  -1.110  14.878  12.959
  184   HD12  ILE  22          1HD1      ILE  22  -1.909  15.710  11.625
  185   HD13  ILE  22          2HD1      ILE  22  -0.343  16.276  12.208
  186    H    ALA  23           H        ALA  23   1.461  11.241  12.193
  187    HA   ALA  23           HA       ALA  23   0.592   9.002  10.799
  188    HB1  ALA  23           1HB      ALA  23   0.022   9.737  13.647
  189    HB2  ALA  23           2HB      ALA  23   1.507   8.983  13.060
  190    HB3  ALA  23           3HB      ALA  23  -0.026   8.109  12.966
  191    H    LEU  24           H        LEU  24  -1.208  11.742  11.833
  192    HA   LEU  24           HA       LEU  24  -3.763  10.450  11.950
  193    HB2  LEU  24           2HB      LEU  24  -3.141  12.488  13.280
  194    HB3  LEU  24           1HB      LEU  24  -3.063  13.401  11.799
  195    HG   LEU  24           HG       LEU  24  -5.093  13.809  13.220
  196   HD11  LEU  24          1HD1      LEU  24  -5.671  12.799  10.449
  197   HD12  LEU  24          2HD1      LEU  24  -5.161  14.429  10.889
  198   HD13  LEU  24          3HD1      LEU  24  -6.731  13.824  11.417
  199   HD21  LEU  24          3HD2      LEU  24  -5.861  11.025  12.356
  200   HD22  LEU  24          1HD2      LEU  24  -6.909  12.172  13.187
  201   HD23  LEU  24          2HD2      LEU  24  -5.476  11.540  13.998
  202    H    THR  25           H        THR  25  -1.819  12.146   9.575
  203    HA   THR  25           HA       THR  25  -3.891  12.458   7.695
  204    HB   THR  25           HB       THR  25  -0.924  12.371   7.269
  205    HG1  THR  25           HG1      THR  25  -0.895  14.395   7.973
  206   HG21  THR  25          3HG2      THR  25  -1.420  13.613   5.223
  207   HG22  THR  25          1HG2      THR  25  -3.141  13.678   5.666
  208   HG23  THR  25          2HG2      THR  25  -2.406  12.139   5.291
  209    H    ILE  26           H        ILE  26  -1.192  10.206   8.043
  210    HA   ILE  26           HA       ILE  26  -1.483   8.637   5.825
  211    HB   ILE  26           HB       ILE  26  -0.951   7.370   8.544
  212   HG12  ILE  26          2HG1      ILE  26   1.014   8.884   6.738
  213   HG13  ILE  26          1HG1      ILE  26   0.464   9.409   8.314
  214   HG21  ILE  26          1HG2      ILE  26  -1.270   5.858   6.739
  215   HG22  ILE  26          2HG2      ILE  26   0.440   5.853   7.199
  216   HG23  ILE  26          3HG2      ILE  26  -0.095   6.709   5.740
  217   HD11  ILE  26          3HD1      ILE  26   2.118   6.962   7.754
  218   HD12  ILE  26          1HD1      ILE  26   1.595   7.516   9.345
  219   HD13  ILE  26          2HD1      ILE  26   2.708   8.497   8.390
  220    H    ALA  27           H        ALA  27  -3.177   8.320   8.870
  221    HA   ALA  27           HA       ALA  27  -4.704   6.071   8.370
  222    HB1  ALA  27           1HB      ALA  27  -6.093   6.825  10.187
  223    HB2  ALA  27           2HB      ALA  27  -5.446   8.463  10.021
  224    HB3  ALA  27           3HB      ALA  27  -4.388   7.146  10.530
  225    H    LYS  28           H        LYS  28  -5.383   9.468   7.588
  226    HA   LYS  28           HA       LYS  28  -8.083   8.998   6.774
  227    HB2  LYS  28           2HB      LYS  28  -6.257  11.253   5.986
  228    HB3  LYS  28           1HB      LYS  28  -7.994  11.224   5.762
  229    HG2  LYS  28           2HG      LYS  28  -8.212  11.156   8.244
  230    HG3  LYS  28           1HG      LYS  28  -6.467  11.384   8.343
  231    HD2  LYS  28           2HD      LYS  28  -8.395  13.294   6.987
  232    HD3  LYS  28           1HD      LYS  28  -7.763  13.503   8.610
  233    HE2  LYS  28           2HE      LYS  28  -6.496  14.946   7.214
  234    HE3  LYS  28           1HE      LYS  28  -5.442  13.593   7.558
  235    HZ1  LYS  28           3HZ      LYS  28  -6.968  13.953   4.996
  236    HZ2  LYS  28           1HZ      LYS  28  -5.855  12.745   5.268
  237    HZ3  LYS  28           2HZ      LYS  28  -5.334  14.278   5.193
  238    H    GLU  29           H        GLU  29  -4.974   9.231   5.130
  239    HA   GLU  29           HA       GLU  29  -6.049   9.340   2.514
  240    HB2  GLU  29           2HB      GLU  29  -3.284   8.320   3.115
  241    HB3  GLU  29           1HB      GLU  29  -3.838   9.203   1.707
  242    HG2  GLU  29           2HG      GLU  29  -3.222  10.249   4.456
  243    HG3  GLU  29           1HG      GLU  29  -2.498  10.673   2.917
  244    H    ILE  30           H        ILE  30  -4.959   6.752   4.571
  245    HA   ILE  30           HA       ILE  30  -5.442   4.840   2.428
  246    HB   ILE  30           HB       ILE  30  -4.699   3.082   4.003
  247   HG12  ILE  30          2HG1      ILE  30  -4.178   5.397   5.886
  248   HG13  ILE  30          1HG1      ILE  30  -5.350   4.116   6.135
  249   HG21  ILE  30          1HG2      ILE  30  -2.315   3.745   4.045
  250   HG22  ILE  30          2HG2      ILE  30  -2.793   5.400   3.666
  251   HG23  ILE  30          3HG2      ILE  30  -3.094   4.108   2.503
  252   HD11  ILE  30          3HD1      ILE  30  -2.349   3.835   6.095
  253   HD12  ILE  30          1HD1      ILE  30  -3.486   2.497   6.266
  254   HD13  ILE  30          2HD1      ILE  30  -3.406   3.745   7.505
  255    H    GLY  31           H        GLY  31  -7.217   6.350   4.737
  256    HA2  GLY  31           2HA      GLY  31  -9.393   6.143   5.386
  257    HA3  GLY  31           1HA      GLY  31  -9.552   4.840   4.218
  258    H    LEU  32           H        LEU  32  -7.218   4.784   6.792
  259    HA   LEU  32           HA       LEU  32  -8.773   2.573   7.971
  260    HB2  LEU  32           2HB      LEU  32  -5.756   2.730   7.995
  261    HB3  LEU  32           1HB      LEU  32  -6.746   1.408   8.552
  262    HG   LEU  32           HG       LEU  32  -6.116   2.217   5.732
  263   HD11  LEU  32          1HD1      LEU  32  -5.323  -0.056   5.519
  264   HD12  LEU  32          2HD1      LEU  32  -5.777  -0.376   7.191
  265   HD13  LEU  32          3HD1      LEU  32  -4.507   0.791   6.835
  266   HD21  LEU  32          3HD2      LEU  32  -8.269   0.290   6.611
  267   HD22  LEU  32          1HD2      LEU  32  -7.627   0.447   4.957
  268   HD23  LEU  32          2HD2      LEU  32  -8.432   1.816   5.711
  269    H    ASP  33           H        ASP  33  -7.794   2.058  10.204
  270    HA   ASP  33           HA       ASP  33  -8.234   4.273  11.900
  271    HB2  ASP  33           2HB      ASP  33  -8.901   2.390  13.012
  272    HB3  ASP  33           1HB      ASP  33  -7.695   1.381  12.229
  273    H    LYS  34           H        LYS  34  -6.868   5.301  13.284
  274    HA   LYS  34           HA       LYS  34  -4.319   6.004  12.201
  275    HB2  LYS  34           2HB      LYS  34  -4.116   7.542  14.040
  276    HB3  LYS  34           1HB      LYS  34  -5.774   7.610  13.450
  277    HG2  LYS  34           2HG      LYS  34  -6.639   6.654  15.332
  278    HG3  LYS  34           1HG      LYS  34  -5.185   5.713  15.647
  279    HD2  LYS  34           2HD      LYS  34  -4.089   7.958  16.208
  280    HD3  LYS  34           1HD      LYS  34  -5.738   8.590  16.278
  281    HE2  LYS  34           2HE      LYS  34  -4.934   7.882  18.493
  282    HE3  LYS  34           1HE      LYS  34  -6.327   6.940  17.962
  283    HZ1  LYS  34           3HZ      LYS  34  -4.943   5.097  17.434
  284    HZ2  LYS  34           1HZ      LYS  34  -4.496   5.589  18.965
  285    HZ3  LYS  34           2HZ      LYS  34  -3.513   5.952  17.630
  286    H    SER  35           H        SER  35  -5.354   3.643  14.528
  287    HA   SER  35           HA       SER  35  -2.931   3.727  16.095
  288    HB2  SER  35           2HB      SER  35  -5.152   1.681  16.186
  289    HB3  SER  35           1HB      SER  35  -4.061   2.163  17.494
  290    HG   SER  35           HG       SER  35  -6.288   3.382  16.433
  291    H    THR  36           H        THR  36  -4.490   1.893  13.590
  292    HA   THR  36           HA       THR  36  -2.767  -0.114  13.192
  293    HB   THR  36           HB       THR  36  -4.575   1.634  11.581
  294    HG1  THR  36           HG1      THR  36  -5.641   0.364  12.998
  295   HG21  THR  36          3HG2      THR  36  -3.179  -0.846  10.697
  296   HG22  THR  36          1HG2      THR  36  -2.938   0.830  10.152
  297   HG23  THR  36          2HG2      THR  36  -4.500   0.020   9.829
  298    H    VAL  37           H        VAL  37  -2.779   3.272  11.849
  299    HA   VAL  37           HA       VAL  37  -0.406   3.103  10.455
  300    HB   VAL  37           HB       VAL  37  -1.686   5.429  11.862
  301   HG11  VAL  37          1HG1      VAL  37   0.248   5.456   9.550
  302   HG12  VAL  37          2HG1      VAL  37   0.656   5.776  11.227
  303   HG13  VAL  37          3HG1      VAL  37  -0.440   6.864  10.382
  304   HG21  VAL  37          3HG2      VAL  37  -2.673   5.945   9.667
  305   HG22  VAL  37          1HG2      VAL  37  -3.213   4.390  10.303
  306   HG23  VAL  37          2HG2      VAL  37  -1.988   4.451   9.034
  307    H    ASN  38           H        ASN  38  -1.107   4.111  13.776
  308    HA   ASN  38           HA       ASN  38   1.387   4.923  14.639
  309    HB2  ASN  38           2HB      ASN  38  -0.750   3.469  16.230
  310    HB3  ASN  38           1HB      ASN  38   0.662   4.235  16.929
  311   HD21  ASN  38          2HD2      ASN  38  -0.786   7.465  15.571
  312   HD22  ASN  38          1HD2      ASN  38   0.489   6.418  15.030
  313    H    ARG  39           H        ARG  39   0.045   1.742  14.780
  314    HA   ARG  39           HA       ARG  39   2.352   0.613  16.076
  315    HB2  ARG  39           2HB      ARG  39   1.392  -1.577  15.760
  316    HB3  ARG  39           1HB      ARG  39   0.078  -0.454  16.121
  317    HG2  ARG  39           2HG      ARG  39  -0.419  -0.348  13.713
  318    HG3  ARG  39           1HG      ARG  39   0.828  -1.551  13.439
  319    HD2  ARG  39           2HD      ARG  39  -0.399  -3.134  14.850
  320    HD3  ARG  39           1HD      ARG  39  -1.667  -1.925  15.085
  321    HE   ARG  39           HE       ARG  39  -0.912  -2.962  12.439
  322   HH11  ARG  39          1HH1      ARG  39  -3.447  -2.079  14.768
  323   HH12  ARG  39          2HH1      ARG  39  -4.721  -2.310  13.670
  324   HH21  ARG  39          2HH2      ARG  39  -4.271  -3.088  11.463
  325   HH22  ARG  39          1HH2      ARG  39  -2.655  -3.333  10.969
  326    H    HIS  40           H        HIS  40   1.425   0.954  12.771
  327    HA   HIS  40           HA       HIS  40   3.524  -0.715  11.782
  328    HB2  HIS  40           2HB      HIS  40   1.506   1.053  10.460
  329    HB3  HIS  40           1HB      HIS  40   2.819   0.392   9.512
  330    HD1  HIS  40           HD1      HIS  40   2.637  -2.413   9.089
  331    HD2  HIS  40           HD2      HIS  40  -0.518  -0.671  11.211
  332    HE1  HIS  40           HE1      HIS  40   0.863  -4.106   9.203
  333    H    LEU  41           H        LEU  41   3.124   2.725  12.306
  334    HA   LEU  41           HA       LEU  41   5.516   3.360  10.925
  335    HB2  LEU  41           2HB      LEU  41   5.349   5.574  11.908
  336    HB3  LEU  41           1HB      LEU  41   3.842   5.104  11.152
  337    HG   LEU  41           HG       LEU  41   3.146   4.526  13.597
  338   HD11  LEU  41          1HD1      LEU  41   5.260   4.784  14.682
  339   HD12  LEU  41          2HD1      LEU  41   4.132   6.001  15.286
  340   HD13  LEU  41          3HD1      LEU  41   5.390   6.452  14.126
  341   HD21  LEU  41          3HD2      LEU  41   2.339   6.796  13.889
  342   HD22  LEU  41          1HD2      LEU  41   2.160   6.143  12.262
  343   HD23  LEU  41          2HD2      LEU  41   3.438   7.326  12.596
  344    H    TYR  42           H        TYR  42   4.697   2.401  14.209
  345    HA   TYR  42           HA       TYR  42   6.998   3.129  15.390
  346    HB2  TYR  42           2HB      TYR  42   4.771   1.373  15.715
  347    HB3  TYR  42           1HB      TYR  42   6.164   0.846  16.577
  348    HD1  TYR  42           HD1      TYR  42   3.274   2.238  17.140
  349    HD2  TYR  42           HD2      TYR  42   7.298   3.394  17.442
  350    HE1  TYR  42           HE1      TYR  42   2.627   3.937  18.841
  351    HE2  TYR  42           HE2      TYR  42   6.717   5.108  19.141
  352    HH   TYR  42           HH       TYR  42   4.752   6.393  19.818
  353    H    ASN  43           H        ASN  43   6.104   0.359  13.546
  354    HA   ASN  43           HA       ASN  43   8.433  -1.199  14.019
  355    HB2  ASN  43           2HB      ASN  43   6.729  -1.145  11.528
  356    HB3  ASN  43           1HB      ASN  43   7.904  -2.398  11.920
  357   HD21  ASN  43          2HD2      ASN  43   4.398  -3.258  12.933
  358   HD22  ASN  43          1HD2      ASN  43   5.073  -2.587  11.487
  359    H    LEU  44           H        LEU  44   7.659   1.071  11.473
  360    HA   LEU  44           HA       LEU  44  10.167   0.956  10.150
  361    HB2  LEU  44           2HB      LEU  44   8.277   3.306  10.193
  362    HB3  LEU  44           1HB      LEU  44   9.499   2.962   9.042
  363    HG   LEU  44           HG       LEU  44   7.093   1.203   9.387
  364   HD11  LEU  44          1HD1      LEU  44   6.328   2.212   7.278
  365   HD12  LEU  44          2HD1      LEU  44   7.701   3.315   7.315
  366   HD13  LEU  44          3HD1      LEU  44   6.459   3.414   8.563
  367   HD21  LEU  44          3HD2      LEU  44   7.862   0.304   7.184
  368   HD22  LEU  44          1HD2      LEU  44   9.001  -0.000   8.500
  369   HD23  LEU  44          2HD2      LEU  44   9.311   1.288   7.341
  370    H    GLN  45           H        GLN  45   8.972   2.744  12.870
  371    HA   GLN  45           HA       GLN  45  10.700   4.929  12.882
  372    HB2  GLN  45           2HB      GLN  45   8.583   4.310  14.356
  373    HB3  GLN  45           1HB      GLN  45   9.798   3.690  15.447
  374    HG2  GLN  45           2HG      GLN  45   9.789   5.794  16.296
  375    HG3  GLN  45           1HG      GLN  45  10.831   6.109  14.900
  376   HE21  GLN  45          2HE2      GLN  45   8.565   8.073  13.227
  377   HE22  GLN  45          1HE2      GLN  45  10.055   7.185  13.155
  378    H    ARG  46           H        ARG  46  10.890   1.795  14.631
  379    HA   ARG  46           HA       ARG  46  13.332   2.172  15.895
  380    HB2  ARG  46           2HB      ARG  46  11.827  -0.239  15.002
  381    HB3  ARG  46           1HB      ARG  46  13.473  -0.423  15.575
  382    HG2  ARG  46           2HG      ARG  46  12.118  -0.860  17.353
  383    HG3  ARG  46           1HG      ARG  46  12.753   0.784  17.628
  384    HD2  ARG  46           2HD      ARG  46  10.452   0.722  18.311
  385    HD3  ARG  46           1HD      ARG  46  10.539   1.610  16.794
  386    HE   ARG  46           HE       ARG  46   9.584  -0.171  15.674
  387   HH11  ARG  46          1HH1      ARG  46   9.680  -0.785  19.166
  388   HH12  ARG  46          2HH1      ARG  46   8.415  -1.921  19.171
  389   HH21  ARG  46          2HH2      ARG  46   7.299  -2.488  17.111
  390   HH22  ARG  46          1HH2      ARG  46   7.762  -1.781  15.671
  391    H    SER  47           H        SER  47  12.585   1.041  12.734
  392    HA   SER  47           HA       SER  47  15.280   0.367  12.067
  393    HB2  SER  47           2HB      SER  47  12.884   0.645  10.261
  394    HB3  SER  47           1HB      SER  47  14.366  -0.258   9.934
  395    HG   SER  47           HG       SER  47  12.708  -1.656  10.688
  396    H    ASN  48           H        ASN  48  13.768   3.419  12.358
  397    HA   ASN  48           HA       ASN  48  14.200   5.461  11.706
  398    HB2  ASN  48           2HB      ASN  48  16.587   4.653  12.183
  399    HB3  ASN  48           1HB      ASN  48  16.769   4.425  10.453
  400   HD21  ASN  48          2HD2      ASN  48  16.953   8.122  12.079
  401   HD22  ASN  48          1HD2      ASN  48  16.456   6.744  13.015
  402    H    GLN  49           H        GLN  49  12.826   3.531  10.058
  403    HA   GLN  49           HA       GLN  49  13.432   4.359   7.321
  404    HB2  GLN  49           2HB      GLN  49  12.798   1.924   8.068
  405    HB3  GLN  49           1HB      GLN  49  11.161   2.520   8.172
  406    HG2  GLN  49           2HG      GLN  49  12.848   2.521   5.662
  407    HG3  GLN  49           1HG      GLN  49  11.673   1.289   6.077
  408   HE21  GLN  49          2HE2      GLN  49   9.118   4.046   5.641
  409   HE22  GLN  49          1HE2      GLN  49   9.675   3.199   7.047
  410    H    VAL  50           H        VAL  50  11.243   4.654   9.960
  411    HA   VAL  50           HA       VAL  50  10.314   7.039   8.662
  412    HB   VAL  50           HB       VAL  50   8.457   5.158   8.905
  413   HG11  VAL  50          1HG1      VAL  50   8.385   6.316  11.662
  414   HG12  VAL  50          2HG1      VAL  50   9.046   4.757  11.250
  415   HG13  VAL  50          3HG1      VAL  50   7.313   5.070  10.994
  416   HG21  VAL  50          3HG2      VAL  50   7.974   7.398   8.167
  417   HG22  VAL  50          1HG2      VAL  50   7.985   7.978   9.833
  418   HG23  VAL  50          2HG2      VAL  50   6.735   6.854   9.300
  419    H    PHE  51           H        PHE  51  10.319   8.525   9.876
  420    HA   PHE  51           HA       PHE  51  10.843   8.786  12.640
  421    HB2  PHE  51           2HB      PHE  51  13.034   8.218  11.025
  422    HB3  PHE  51           1HB      PHE  51  13.140   9.993  11.256
  423    HD1  PHE  51           HD1      PHE  51  12.086   7.163  12.975
  424    HD2  PHE  51           HD2      PHE  51  14.582  10.458  13.019
  425    HE1  PHE  51           HE1      PHE  51  12.952   6.427  15.300
  426    HE2  PHE  51           HE2      PHE  51  15.479   9.871  15.255
  427    HZ   PHE  51           HZ       PHE  51  14.656   7.839  16.398
  428    H    ASN  52           H        ASN  52  11.859  11.387  12.555
  429    HA   ASN  52           HA       ASN  52   9.933  12.684  10.784
  430    HB2  ASN  52           2HB      ASN  52  11.296  13.848  13.200
  431    HB3  ASN  52           1HB      ASN  52  10.260  14.726  12.122
  432   HD21  ASN  52          2HD2      ASN  52   7.424  12.516  13.164
  433   HD22  ASN  52          1HD2      ASN  52   8.350  12.603  11.710
  434    H    SER  53           H        SER  53  10.631  14.356   9.505
  435    HA   SER  53           HA       SER  53  13.495  14.470   9.337
  436    HB2  SER  53           2HB      SER  53  12.805  12.637   7.863
  437    HB3  SER  53           1HB      SER  53  11.763  13.742   6.975
  438    HG   SER  53           HG       SER  53  14.390  13.291   6.730
  439    H    ASN  54           H        ASN  54  14.060  16.256   9.341
  440    HA   ASN  54           HA       ASN  54  14.729  18.392   8.915
  441    HB2  ASN  54           2HB      ASN  54  15.762  18.333   6.902
  442    HB3  ASN  54           1HB      ASN  54  15.220  16.662   7.174
  443   HD21  ASN  54          2HD2      ASN  54  13.012  16.568   4.469
  444   HD22  ASN  54          1HD2      ASN  54  13.559  15.764   5.898
  445    H    GLU  55           H        GLU  55  11.496  18.011   7.585
  446    HA   GLU  55           HA       GLU  55  11.722  20.632   6.487
  447    HB2  GLU  55           2HB      GLU  55   9.331  20.229   5.669
  448    HB3  GLU  55           1HB      GLU  55  10.622  19.283   4.961
  449    HG2  GLU  55           2HG      GLU  55  10.022  17.425   6.430
  450    HG3  GLU  55           1HG      GLU  55   8.643  18.365   7.034
  451    H    LYS  56           H        LYS  56   9.348  21.817   6.755
  452    HA   LYS  56           HA       LYS  56   9.848  22.666   9.414
  453    HB2  LYS  56           2HB      LYS  56   8.033  23.936   7.374
  454    HB3  LYS  56           1HB      LYS  56   8.318  24.591   8.982
  455    HG2  LYS  56           2HG      LYS  56  10.566  24.061   7.041
  456    HG3  LYS  56           1HG      LYS  56   9.679  25.574   7.053
  457    HD2  LYS  56           2HD      LYS  56  11.788  25.815   8.277
  458    HD3  LYS  56           1HD      LYS  56  10.436  25.997   9.372
  459    HE2  LYS  56           2HE      LYS  56  12.372  24.748  10.294
  460    HE3  LYS  56           1HE      LYS  56  10.898  23.823  10.387
  461    HZ1  LYS  56           3HZ      LYS  56  12.755  22.450   9.658
  462    HZ2  LYS  56           1HZ      LYS  56  13.102  23.469   8.363
  463    HZ3  LYS  56           2HZ      LYS  56  11.675  22.556   8.414
  464    HA   PRO  57           HA       PRO  57   5.893  20.730  10.587
  465    HB2  PRO  57           2HB      PRO  57   4.720  19.101   8.564
  466    HB3  PRO  57           1HB      PRO  57   4.034  20.608   9.194
  467    HG2  PRO  57           2HG      PRO  57   4.976  20.196   6.603
  468    HG3  PRO  57           1HG      PRO  57   4.573  21.753   7.347
  469    HD2  PRO  57           2HD      PRO  57   7.219  20.520   6.893
  470    HD3  PRO  57           1HD      PRO  57   6.766  22.231   7.020
  471    HA   PRO  58           HA       PRO  58   9.084  17.477  10.847
  472    HB2  PRO  58           2HB      PRO  58   7.205  16.524  12.967
  473    HB3  PRO  58           1HB      PRO  58   8.962  16.773  13.063
  474    HG2  PRO  58           2HG      PRO  58   7.339  18.495  14.209
  475    HG3  PRO  58           1HG      PRO  58   8.790  19.046  13.346
  476    HD2  PRO  58           2HD      PRO  58   5.940  19.191  12.493
  477    HD3  PRO  58           1HD      PRO  58   7.277  20.324  12.202
  478    H    VAL  59           H        VAL  59   8.879  16.156   9.099
  479    HA   VAL  59           HA       VAL  59   6.321  14.964   8.527
  480    HB   VAL  59           HB       VAL  59   7.875  15.800   6.746
  481   HG11  VAL  59          1HG1      VAL  59   9.421  13.312   7.353
  482   HG12  VAL  59          2HG1      VAL  59   9.971  14.977   7.549
  483   HG13  VAL  59          3HG1      VAL  59   9.635  14.341   5.937
  484   HG21  VAL  59          3HG2      VAL  59   6.058  14.455   6.063
  485   HG22  VAL  59          1HG2      VAL  59   6.863  12.992   6.653
  486   HG23  VAL  59          2HG2      VAL  59   7.515  13.821   5.264
  487    H    TRP  60           H        TRP  60   5.583  13.062   8.791
  488    HA   TRP  60           HA       TRP  60   7.429  11.167   9.903
  489    HB2  TRP  60           2HB      TRP  60   4.390  11.016   9.706
  490    HB3  TRP  60           1HB      TRP  60   5.434   9.776  10.397
  491    HD1  TRP  60           HD1      TRP  60   4.867  13.554  11.045
  492    HE1  TRP  60           HE1      TRP  60   4.812  13.940  13.591
  493    HE3  TRP  60           HE3      TRP  60   5.644   8.756  12.597
  494    HZ2  TRP  60           HZ2      TRP  60   5.048  12.406  15.942
  495    HZ3  TRP  60           HZ3      TRP  60   5.712   8.304  15.018
  496    HH2  TRP  60           HH2      TRP  60   5.422  10.086  16.647
  497    H    ASP  61           H        ASP  61   8.481  10.501   8.323
  498    HA   ASP  61           HA       ASP  61   7.777   8.613   6.491
  499    HB2  ASP  61           2HB      ASP  61   6.619  10.639   5.368
  500    HB3  ASP  61           1HB      ASP  61   8.208  11.368   5.227
  501    H    LEU  62           H        LEU  62   9.753   9.129   4.743
  502    HA   LEU  62           HA       LEU  62  12.124  10.004   6.192
  503    HB2  LEU  62           2HB      LEU  62  11.725   7.579   6.130
  504    HB3  LEU  62           1HB      LEU  62  11.819   7.596   4.381
  505    HG   LEU  62           HG       LEU  62  14.249   8.389   4.632
  506   HD11  LEU  62          1HD1      LEU  62  15.328   8.075   6.772
  507   HD12  LEU  62          2HD1      LEU  62  13.768   7.725   7.517
  508   HD13  LEU  62          3HD1      LEU  62  14.088   9.325   6.847
  509   HD21  LEU  62          3HD2      LEU  62  13.512   5.742   5.860
  510   HD22  LEU  62          1HD2      LEU  62  15.111   6.179   5.250
  511   HD23  LEU  62          2HD2      LEU  62  13.741   6.068   4.144
  512    H    MET  63           H        MET  63  13.741   9.607   3.775
  513    HA   MET  63           HA       MET  63  12.261  11.194   1.819
  514    HB2  MET  63           2HB      MET  63  14.019  12.494   3.237
  515    HB3  MET  63           1HB      MET  63  15.100  11.417   2.309
  516    HG2  MET  63           2HG      MET  63  14.821  13.733   1.297
  517    HG3  MET  63           1HG      MET  63  14.517  12.357   0.239
  518    HE1  MET  63           3HE      MET  63  11.134  14.883   2.166
  519    HE2  MET  63           1HE      MET  63  12.849  15.209   2.416
  520    HE3  MET  63           2HE      MET  63  12.121  13.747   3.082
  521    H    GLU  64           H        GLU  64  11.955   9.350   0.614
  522    HA   GLU  64           HA       GLU  64  14.136   8.439  -0.918
  523    HB2  GLU  64           2HB      GLU  64  14.442   7.429   1.248
  524    HB3  GLU  64           1HB      GLU  64  12.851   6.715   1.210
  525    HG2  GLU  64           2HG      GLU  64  13.558   5.381  -0.812
  526    HG3  GLU  64           1HG      GLU  64  15.197   5.992  -0.567
  Start of MODEL   10
    1    HA   MET   1           HA       MET   1   6.410 -12.364   1.710
    2    HB2  MET   1           2HB      MET   1   5.532 -11.324  -0.422
    3    HB3  MET   1           1HB      MET   1   7.189 -10.950  -0.858
    4    HG2  MET   1           2HG      MET   1   7.715 -13.341  -0.921
    5    HG3  MET   1           1HG      MET   1   6.058 -13.720  -0.464
    6    HE1  MET   1           2HE      MET   1   7.386 -10.947  -3.002
    7    HE2  MET   1           3HE      MET   1   7.293 -11.850  -4.512
    8    HE3  MET   1           1HE      MET   1   8.436 -12.340  -3.264
    9    H    SER   2           H        SER   2   8.621 -10.294   2.643
   10    HA   SER   2           HA       SER   2  10.789 -11.800   3.028
   11    HB2  SER   2           2HB      SER   2  11.079 -11.923   0.504
   12    HB3  SER   2           1HB      SER   2  11.183 -10.166   0.470
   13    HG   SER   2           HG       SER   2  13.142 -10.245   1.322
   14    H    ALA   3           H        ALA   3  10.741 -10.597   4.848
   15    HA   ALA   3           HA       ALA   3  10.863  -8.871   6.309
   16    HB1  ALA   3           1HB      ALA   3  12.259  -6.907   5.778
   17    HB2  ALA   3           2HB      ALA   3  12.253  -7.344   4.071
   18    HB3  ALA   3           3HB      ALA   3  13.078  -8.374   5.239
   19    H    GLU   4           H        GLU   4   8.915  -8.455   6.721
   20    HA   GLU   4           HA       GLU   4   7.144  -7.560   4.737
   21    HB2  GLU   4           2HB      GLU   4   6.767  -8.064   7.626
   22    HB3  GLU   4           1HB      GLU   4   5.419  -7.733   6.514
   23    HG2  GLU   4           2HG      GLU   4   7.254 -10.113   6.673
   24    HG3  GLU   4           1HG      GLU   4   5.491 -10.081   6.669
   25    H    THR   5           H        THR   5   9.231  -5.698   6.063
   26    HA   THR   5           HA       THR   5   7.954  -3.335   6.867
   27    HB   THR   5           HB       THR   5  10.487  -3.665   5.233
   28    HG1  THR   5           HG1      THR   5  10.097  -3.926   8.042
   29   HG21  THR   5          3HG2      THR   5  11.263  -1.715   6.522
   30   HG22  THR   5          1HG2      THR   5   9.724  -1.664   7.381
   31   HG23  THR   5          2HG2      THR   5   9.779  -1.328   5.651
   32    H    GLN   6           H        GLN   6   8.154  -5.027   3.938
   33    HA   GLN   6           HA       GLN   6   7.824  -3.166   1.893
   34    HB2  GLN   6           2HB      GLN   6   6.625  -5.938   2.145
   35    HB3  GLN   6           1HB      GLN   6   6.749  -5.019   0.654
   36    HG2  GLN   6           2HG      GLN   6   9.172  -5.112   0.770
   37    HG3  GLN   6           1HG      GLN   6   9.083  -5.956   2.313
   38   HE21  GLN   6          2HE2      GLN   6   9.611  -8.262  -0.629
   39   HE22  GLN   6          1HE2      GLN   6  10.306  -6.753  -0.165
   40    H    MET   7           H        MET   7   5.616  -4.332   4.345
   41    HA   MET   7           HA       MET   7   3.185  -3.628   3.056
   42    HB2  MET   7           2HB      MET   7   3.788  -4.032   5.986
   43    HB3  MET   7           1HB      MET   7   2.177  -3.815   5.322
   44    HG2  MET   7           2HG      MET   7   4.050  -6.079   4.683
   45    HG3  MET   7           1HG      MET   7   2.681  -6.155   5.792
   46    HE1  MET   7           3HE      MET   7   3.148  -8.196   3.408
   47    HE2  MET   7           1HE      MET   7   1.510  -8.345   2.772
   48    HE3  MET   7           2HE      MET   7   1.779  -8.281   4.514
   49    H    GLU   8           H        GLU   8   5.014  -2.122   5.578
   50    HA   GLU   8           HA       GLU   8   3.458   0.181   5.887
   51    HB2  GLU   8           2HB      GLU   8   6.375  -0.331   6.414
   52    HB3  GLU   8           1HB      GLU   8   5.564   1.151   6.865
   53    HG2  GLU   8           2HG      GLU   8   5.844  -0.339   8.768
   54    HG3  GLU   8           1HG      GLU   8   4.151  -0.065   8.403
   55    H    ARG   9           H        ARG   9   6.124  -0.595   3.853
   56    HA   ARG   9           HA       ARG   9   6.687   2.138   3.113
   57    HB2  ARG   9           2HB      ARG   9   8.060  -0.262   2.917
   58    HB3  ARG   9           1HB      ARG   9   7.523  -0.050   1.271
   59    HG2  ARG   9           2HG      ARG   9   9.315   1.812   2.835
   60    HG3  ARG   9           1HG      ARG   9   9.810   0.704   1.570
   61    HD2  ARG   9           2HD      ARG   9   8.061   3.138   1.274
   62    HD3  ARG   9           1HD      ARG   9   9.726   2.967   0.733
   63    HE   ARG   9           HE       ARG   9   8.119   0.993  -0.444
   64   HH11  ARG   9          1HH1      ARG   9   9.270   4.295  -0.820
   65   HH12  ARG   9          2HH1      ARG   9   8.309   4.626  -2.198
   66   HH21  ARG   9          2HH2      ARG   9   6.930   3.035  -3.111
   67   HH22  ARG   9          1HH2      ARG   9   6.868   1.433  -2.517
   68    H    LYS  10           H        LYS  10   4.743  -0.391   1.699
   69    HA   LYS  10           HA       LYS  10   4.335   1.230  -0.639
   70    HB2  LYS  10           2HB      LYS  10   2.571  -0.436  -1.292
   71    HB3  LYS  10           1HB      LYS  10   4.177  -1.104  -1.060
   72    HG2  LYS  10           2HG      LYS  10   3.500  -1.898   1.159
   73    HG3  LYS  10           1HG      LYS  10   1.884  -1.259   0.875
   74    HD2  LYS  10           2HD      LYS  10   1.474  -2.803  -0.864
   75    HD3  LYS  10           1HD      LYS  10   3.178  -3.250  -0.969
   76    HE2  LYS  10           2HE      LYS  10   1.851  -4.978   0.173
   77    HE3  LYS  10           1HE      LYS  10   3.078  -4.268   1.219
   78    HZ1  LYS  10           3HZ      LYS  10   0.174  -3.623   1.253
   79    HZ2  LYS  10           1HZ      LYS  10   1.366  -2.890   2.227
   80    HZ3  LYS  10           2HZ      LYS  10   1.046  -4.539   2.388
   81    H    ILE  11           H        ILE  11   2.601   0.831   2.442
   82    HA   ILE  11           HA       ILE  11   0.338   2.166   1.366
   83    HB   ILE  11           HB       ILE  11  -0.427   2.284   3.645
   84   HG12  ILE  11          2HG1      ILE  11   2.244   1.055   4.284
   85   HG13  ILE  11          1HG1      ILE  11   1.562   2.547   4.910
   86   HG21  ILE  11          1HG2      ILE  11  -0.642  -0.198   3.942
   87   HG22  ILE  11          2HG2      ILE  11   0.702  -0.353   2.796
   88   HG23  ILE  11          3HG2      ILE  11  -0.847   0.301   2.245
   89   HD11  ILE  11          3HD1      ILE  11   0.674  -0.219   5.430
   90   HD12  ILE  11          1HD1      ILE  11  -0.131   1.214   6.096
   91   HD13  ILE  11          2HD1      ILE  11   1.543   0.832   6.562
   92    H    ILE  12           H        ILE  12   3.204   3.080   3.207
   93    HA   ILE  12           HA       ILE  12   2.099   5.664   3.566
   94    HB   ILE  12           HB       ILE  12   4.050   6.362   4.594
   95   HG12  ILE  12          2HG1      ILE  12   6.108   4.597   4.411
   96   HG13  ILE  12          1HG1      ILE  12   5.417   4.521   2.812
   97   HG21  ILE  12          1HG2      ILE  12   2.956   4.818   5.979
   98   HG22  ILE  12          2HG2      ILE  12   4.699   4.682   6.213
   99   HG23  ILE  12          3HG2      ILE  12   3.841   3.474   5.257
  100   HD11  ILE  12          3HD1      ILE  12   5.494   7.041   2.631
  101   HD12  ILE  12          1HD1      ILE  12   7.094   6.299   2.750
  102   HD13  ILE  12          2HD1      ILE  12   6.353   7.083   4.142
  103    H    ASP  13           H        ASP  13   4.080   4.134   1.096
  104    HA   ASP  13           HA       ASP  13   5.052   6.479  -0.118
  105    HB2  ASP  13           2HB      ASP  13   5.781   4.100  -0.619
  106    HB3  ASP  13           1HB      ASP  13   4.320   3.939  -1.578
  107    H    PHE  14           H        PHE  14   2.074   4.660  -0.531
  108    HA   PHE  14           HA       PHE  14   1.021   6.230  -2.534
  109    HB2  PHE  14           2HB      PHE  14  -0.108   4.193  -2.132
  110    HB3  PHE  14           1HB      PHE  14  -0.209   4.496  -0.406
  111    HD1  PHE  14           HD1      PHE  14  -1.628   5.403  -3.685
  112    HD2  PHE  14           HD2      PHE  14  -2.008   5.619   0.525
  113    HE1  PHE  14           HE1      PHE  14  -3.940   6.242  -3.949
  114    HE2  PHE  14           HE2      PHE  14  -4.321   6.463   0.302
  115    HZ   PHE  14           HZ       PHE  14  -5.289   6.772  -1.952
  116    H    LEU  15           H        LEU  15   0.604   6.578   1.009
  117    HA   LEU  15           HA       LEU  15  -0.899   8.904   0.772
  118    HB2  LEU  15           2HB      LEU  15  -1.293   8.290   2.777
  119    HB3  LEU  15           1HB      LEU  15  -0.006   7.115   2.786
  120    HG   LEU  15           HG       LEU  15   0.039   8.384   4.718
  121   HD11  LEU  15          1HD1      LEU  15   2.270   9.426   4.818
  122   HD12  LEU  15          2HD1      LEU  15   2.364   9.249   3.064
  123   HD13  LEU  15          3HD1      LEU  15   2.218   7.822   4.086
  124   HD21  LEU  15          3HD2      LEU  15  -1.159  10.376   4.203
  125   HD22  LEU  15          1HD2      LEU  15   0.113  10.894   3.090
  126   HD23  LEU  15          2HD2      LEU  15   0.422  10.857   4.827
  127    H    ARG  16           H        ARG  16   2.401   8.286   0.614
  128    HA   ARG  16           HA       ARG  16   3.189  10.947   1.190
  129    HB2  ARG  16           2HB      ARG  16   5.167   9.916   1.562
  130    HB3  ARG  16           1HB      ARG  16   4.270   8.478   1.072
  131    HG2  ARG  16           2HG      ARG  16   5.124   8.518  -1.086
  132    HG3  ARG  16           1HG      ARG  16   5.848  10.121  -0.847
  133    HD2  ARG  16           2HD      ARG  16   7.345   9.321   0.775
  134    HD3  ARG  16           1HD      ARG  16   6.482   7.792   0.903
  135    HE   ARG  16           HE       ARG  16   7.221   7.679  -1.576
  136   HH11  ARG  16          1HH1      ARG  16   9.131   8.656   1.326
  137   HH12  ARG  16          2HH1      ARG  16  10.573   7.996   0.694
  138   HH21  ARG  16          2HH2      ARG  16  10.638   6.902  -1.359
  139   HH22  ARG  16          1HH2      ARG  16   9.240   6.865  -2.364
  140    H    GLN  17           H        GLN  17   2.305   9.189  -1.626
  141    HA   GLN  17           HA       GLN  17   3.143  11.194  -3.482
  142    HB2  GLN  17           2HB      GLN  17   0.949   9.119  -3.748
  143    HB3  GLN  17           1HB      GLN  17   1.569  10.110  -5.055
  144    HG2  GLN  17           2HG      GLN  17   3.750   9.017  -4.839
  145    HG3  GLN  17           1HG      GLN  17   3.114   8.028  -3.524
  146   HE21  GLN  17          2HE2      GLN  17   1.213   7.278  -7.012
  147   HE22  GLN  17          1HE2      GLN  17   1.254   8.888  -6.366
  148    H    ASN  18           H        ASN  18   0.436  10.669  -1.377
  149    HA   ASN  18           HA       ASN  18  -1.182  12.795  -2.488
  150    HB2  ASN  18           2HB      ASN  18  -1.351  11.510   0.266
  151    HB3  ASN  18           1HB      ASN  18  -2.612  12.437  -0.534
  152   HD21  ASN  18          2HD2      ASN  18  -2.743   9.515  -2.932
  153   HD22  ASN  18          1HD2      ASN  18  -2.103  11.121  -3.129
  154    H    GLY  19           H        GLY  19   0.947  12.228   0.147
  155    HA2  GLY  19           2HA      GLY  19   2.503  14.316   0.347
  156    HA3  GLY  19           1HA      GLY  19   1.007  15.016   0.956
  157    H    LYS  20           H        LYS  20   3.584  12.632   1.608
  158    HA   LYS  20           HA       LYS  20   2.835  11.507   3.912
  159    HB2  LYS  20           2HB      LYS  20   5.367  11.954   4.577
  160    HB3  LYS  20           1HB      LYS  20   4.903  10.770   3.381
  161    HG2  LYS  20           2HG      LYS  20   6.855  12.092   2.688
  162    HG3  LYS  20           1HG      LYS  20   5.507  12.301   1.587
  163    HD2  LYS  20           2HD      LYS  20   5.089  14.490   2.364
  164    HD3  LYS  20           1HD      LYS  20   6.091  14.278   3.795
  165    HE2  LYS  20           2HE      LYS  20   7.119  14.241   0.956
  166    HE3  LYS  20           1HE      LYS  20   7.151  15.655   2.008
  167    HZ1  LYS  20           3HZ      LYS  20   8.525  13.080   2.720
  168    HZ2  LYS  20           1HZ      LYS  20   8.613  14.601   3.476
  169    HZ3  LYS  20           2HZ      LYS  20   9.278  14.402   1.970
  170    H    SER  21           H        SER  21   3.309  11.957   6.227
  171    HA   SER  21           HA       SER  21   3.218  14.599   7.159
  172    HB2  SER  21           2HB      SER  21   1.257  14.766   5.601
  173    HB3  SER  21           1HB      SER  21   0.468  13.469   6.485
  174    HG   SER  21           HG       SER  21   0.619  16.108   6.994
  175    H    ILE  22           H        ILE  22   1.056  14.254   8.945
  176    HA   ILE  22           HA       ILE  22   2.317  12.505  10.874
  177    HB   ILE  22           HB       ILE  22   0.655  13.390  12.474
  178   HG12  ILE  22          2HG1      ILE  22  -0.277  15.095  10.138
  179   HG13  ILE  22          1HG1      ILE  22  -1.190  13.777  10.858
  180   HG21  ILE  22          1HG2      ILE  22   2.160  15.480  10.901
  181   HG22  ILE  22          2HG2      ILE  22   2.799  14.499  12.220
  182   HG23  ILE  22          3HG2      ILE  22   1.535  15.688  12.538
  183   HD11  ILE  22          3HD1      ILE  22  -0.398  16.340  12.230
  184   HD12  ILE  22          1HD1      ILE  22  -1.326  15.028  12.957
  185   HD13  ILE  22          2HD1      ILE  22  -2.001  15.945  11.609
  186    H    ALA  23           H        ALA  23   0.863  11.266  12.322
  187    HA   ALA  23           HA       ALA  23  -0.067   9.033  11.018
  188    HB1  ALA  23           1HB      ALA  23   0.706   9.078  13.332
  189    HB2  ALA  23           2HB      ALA  23  -0.869   8.287  13.181
  190    HB3  ALA  23           3HB      ALA  23  -0.763   9.947  13.779
  191    H    LEU  24           H        LEU  24  -1.793  11.914  11.795
  192    HA   LEU  24           HA       LEU  24  -4.415  10.764  11.855
  193    HB2  LEU  24           2HB      LEU  24  -3.730  12.902  13.010
  194    HB3  LEU  24           1HB      LEU  24  -3.583  13.655  11.447
  195    HG   LEU  24           HG       LEU  24  -5.630  14.292  12.725
  196   HD11  LEU  24          1HD1      LEU  24  -5.648  14.586  10.331
  197   HD12  LEU  24          2HD1      LEU  24  -7.243  14.104  10.908
  198   HD13  LEU  24          3HD1      LEU  24  -6.201  12.926  10.111
  199   HD21  LEU  24          3HD2      LEU  24  -6.088  12.167  13.803
  200   HD22  LEU  24          1HD2      LEU  24  -6.472  11.438  12.243
  201   HD23  LEU  24          2HD2      LEU  24  -7.493  12.721  12.892
  202    H    THR  25           H        THR  25  -2.403  12.445   9.486
  203    HA   THR  25           HA       THR  25  -4.293  12.600   7.424
  204    HB   THR  25           HB       THR  25  -1.310  12.406   7.240
  205    HG1  THR  25           HG1      THR  25  -1.199  14.454   7.891
  206   HG21  THR  25          3HG2      THR  25  -3.370  13.803   5.517
  207   HG22  THR  25          1HG2      THR  25  -2.616  12.250   5.181
  208   HG23  THR  25          2HG2      THR  25  -1.622  13.717   5.198
  209    H    ILE  26           H        ILE  26  -1.594  10.422   8.037
  210    HA   ILE  26           HA       ILE  26  -1.791   8.815   5.816
  211    HB   ILE  26           HB       ILE  26  -1.051   7.778   8.575
  212   HG12  ILE  26          2HG1      ILE  26   0.696   9.159   6.488
  213   HG13  ILE  26          1HG1      ILE  26   0.219   9.839   8.031
  214   HG21  ILE  26          1HG2      ILE  26  -1.373   6.035   6.983
  215   HG22  ILE  26          2HG2      ILE  26   0.369   6.207   7.254
  216   HG23  ILE  26          3HG2      ILE  26  -0.383   6.853   5.787
  217   HD11  ILE  26          3HD1      ILE  26   2.513   9.052   8.064
  218   HD12  ILE  26          1HD1      ILE  26   1.975   7.426   7.639
  219   HD13  ILE  26          2HD1      ILE  26   1.517   8.130   9.190
  220    H    ALA  27           H        ALA  27  -3.455   8.511   8.897
  221    HA   ALA  27           HA       ALA  27  -4.827   6.137   8.435
  222    HB1  ALA  27           1HB      ALA  27  -4.636   7.214  10.612
  223    HB2  ALA  27           2HB      ALA  27  -6.319   6.865  10.211
  224    HB3  ALA  27           3HB      ALA  27  -5.698   8.513  10.068
  225    H    LYS  28           H        LYS  28  -5.602   9.503   7.368
  226    HA   LYS  28           HA       LYS  28  -8.219   8.800   6.658
  227    HB2  LYS  28           2HB      LYS  28  -8.143  10.999   7.253
  228    HB3  LYS  28           1HB      LYS  28  -6.459  11.177   6.779
  229    HG2  LYS  28           2HG      LYS  28  -7.073  11.110   4.553
  230    HG3  LYS  28           1HG      LYS  28  -8.812  11.073   4.928
  231    HD2  LYS  28           2HD      LYS  28  -8.561  13.285   6.032
  232    HD3  LYS  28           1HD      LYS  28  -6.836  13.272   5.648
  233    HE2  LYS  28           2HE      LYS  28  -9.119  13.333   3.669
  234    HE3  LYS  28           1HE      LYS  28  -8.024  14.662   4.045
  235    HZ1  LYS  28           3HZ      LYS  28  -6.178  13.106   3.247
  236    HZ2  LYS  28           1HZ      LYS  28  -7.190  13.604   2.001
  237    HZ3  LYS  28           2HZ      LYS  28  -7.287  12.090   2.715
  238    H    GLU  29           H        GLU  29  -5.066   9.157   5.096
  239    HA   GLU  29           HA       GLU  29  -6.092   9.163   2.450
  240    HB2  GLU  29           2HB      GLU  29  -3.311   8.336   3.238
  241    HB3  GLU  29           1HB      GLU  29  -3.834   9.006   1.704
  242    HG2  GLU  29           2HG      GLU  29  -3.408  10.382   4.329
  243    HG3  GLU  29           1HG      GLU  29  -2.649  10.704   2.785
  244    H    ILE  30           H        ILE  30  -4.817   6.694   4.593
  245    HA   ILE  30           HA       ILE  30  -5.171   4.745   2.450
  246    HB   ILE  30           HB       ILE  30  -4.116   3.071   3.911
  247   HG12  ILE  30          2HG1      ILE  30  -3.663   5.390   5.793
  248   HG13  ILE  30          1HG1      ILE  30  -4.714   4.026   6.115
  249   HG21  ILE  30          1HG2      ILE  30  -2.536   5.608   3.476
  250   HG22  ILE  30          2HG2      ILE  30  -2.761   4.292   2.321
  251   HG23  ILE  30          3HG2      ILE  30  -1.829   4.025   3.795
  252   HD11  ILE  30          3HD1      ILE  30  -2.727   2.549   6.068
  253   HD12  ILE  30          1HD1      ILE  30  -2.624   3.797   7.311
  254   HD13  ILE  30          2HD1      ILE  30  -1.715   3.968   5.809
  255    H    GLY  31           H        GLY  31  -7.049   5.981   4.791
  256    HA2  GLY  31           2HA      GLY  31  -9.193   5.441   5.404
  257    HA3  GLY  31           1HA      GLY  31  -9.097   4.061   4.325
  258    H    LEU  32           H        LEU  32  -6.742   4.415   6.792
  259    HA   LEU  32           HA       LEU  32  -8.001   2.158   8.205
  260    HB2  LEU  32           2HB      LEU  32  -5.079   2.947   8.353
  261    HB3  LEU  32           1HB      LEU  32  -5.810   1.521   9.044
  262    HG   LEU  32           HG       LEU  32  -5.127   2.093   6.185
  263   HD11  LEU  32          1HD1      LEU  32  -3.997  -0.038   6.298
  264   HD12  LEU  32          2HD1      LEU  32  -4.510  -0.223   7.974
  265   HD13  LEU  32          3HD1      LEU  32  -3.416   1.086   7.528
  266   HD21  LEU  32          3HD2      LEU  32  -6.295   0.055   5.509
  267   HD22  LEU  32          1HD2      LEU  32  -7.368   1.325   6.087
  268   HD23  LEU  32          2HD2      LEU  32  -7.014  -0.067   7.131
  269    H    ASP  33           H        ASP  33  -6.690   2.295  10.647
  270    HA   ASP  33           HA       ASP  33  -7.780   4.827  11.531
  271    HB2  ASP  33           2HB      ASP  33  -8.680   2.690  12.601
  272    HB3  ASP  33           1HB      ASP  33  -7.088   2.468  13.303
  273    H    LYS  34           H        LYS  34  -6.546   5.375  13.763
  274    HA   LYS  34           HA       LYS  34  -4.082   6.458  12.704
  275    HB2  LYS  34           2HB      LYS  34  -5.380   7.053  15.398
  276    HB3  LYS  34           1HB      LYS  34  -4.182   8.018  14.566
  277    HG2  LYS  34           2HG      LYS  34  -6.301   9.177  14.433
  278    HG3  LYS  34           1HG      LYS  34  -5.948   8.550  12.820
  279    HD2  LYS  34           2HD      LYS  34  -7.403   6.649  13.223
  280    HD3  LYS  34           1HD      LYS  34  -7.733   7.208  14.856
  281    HE2  LYS  34           2HE      LYS  34  -9.004   9.021  13.984
  282    HE3  LYS  34           1HE      LYS  34  -8.454   8.679  12.335
  283    HZ1  LYS  34           3HZ      LYS  34  -9.750   6.538  13.853
  284    HZ2  LYS  34           1HZ      LYS  34  -9.667   6.735  12.230
  285    HZ3  LYS  34           2HZ      LYS  34 -10.778   7.673  13.121
  286    H    SER  35           H        SER  35  -5.300   4.001  14.765
  287    HA   SER  35           HA       SER  35  -3.120   3.850  16.601
  288    HB2  SER  35           2HB      SER  35  -4.358   1.642  17.038
  289    HB3  SER  35           1HB      SER  35  -5.257   3.137  17.373
  290    HG   SER  35           HG       SER  35  -6.531   2.763  15.693
  291    H    THR  36           H        THR  36  -4.364   2.353  13.767
  292    HA   THR  36           HA       THR  36  -2.616   0.317  13.290
  293    HB   THR  36           HB       THR  36  -3.731   2.009  11.105
  294    HG1  THR  36           HG1      THR  36  -5.228   0.656  13.168
  295   HG21  THR  36          3HG2      THR  36  -3.944  -0.816  11.933
  296   HG22  THR  36          1HG2      THR  36  -2.758  -0.217  10.752
  297   HG23  THR  36          2HG2      THR  36  -4.512  -0.137  10.390
  298    H    VAL  37           H        VAL  37  -2.611   3.682  11.962
  299    HA   VAL  37           HA       VAL  37  -0.180   3.590  10.649
  300    HB   VAL  37           HB       VAL  37  -1.511   5.938  11.980
  301   HG11  VAL  37          1HG1      VAL  37  -0.308   7.268  10.303
  302   HG12  VAL  37          2HG1      VAL  37   0.532   5.809   9.766
  303   HG13  VAL  37          3HG1      VAL  37   0.768   6.421  11.407
  304   HG21  VAL  37          3HG2      VAL  37  -3.011   4.822  10.430
  305   HG22  VAL  37          1HG2      VAL  37  -1.775   4.876   9.175
  306   HG23  VAL  37          2HG2      VAL  37  -2.493   6.372   9.770
  307    H    ASN  38           H        ASN  38  -0.914   4.461  13.994
  308    HA   ASN  38           HA       ASN  38   1.601   5.308  14.791
  309    HB2  ASN  38           2HB      ASN  38  -0.692   4.160  16.275
  310    HB3  ASN  38           1HB      ASN  38   0.865   4.174  17.092
  311   HD21  ASN  38          2HD2      ASN  38  -1.172   7.592  16.488
  312   HD22  ASN  38          1HD2      ASN  38  -1.619   6.092  15.711
  313    H    ARG  39           H        ARG  39   0.387   2.002  14.601
  314    HA   ARG  39           HA       ARG  39   2.747   0.979  15.843
  315    HB2  ARG  39           2HB      ARG  39   2.199  -1.255  15.152
  316    HB3  ARG  39           1HB      ARG  39   0.674  -0.457  15.533
  317    HG2  ARG  39           2HG      ARG  39  -0.016  -0.444  13.360
  318    HG3  ARG  39           1HG      ARG  39   1.610  -0.391  12.755
  319    HD2  ARG  39           2HD      ARG  39   0.516  -2.838  14.085
  320    HD3  ARG  39           1HD      ARG  39   0.438  -2.571  12.337
  321    HE   ARG  39           HE       ARG  39   2.881  -2.995  13.935
  322   HH11  ARG  39          1HH1      ARG  39   1.393  -2.720  10.714
  323   HH12  ARG  39          2HH1      ARG  39   2.848  -3.050   9.884
  324   HH21  ARG  39          2HH2      ARG  39   4.753  -3.586  10.986
  325   HH22  ARG  39          1HH2      ARG  39   4.859  -3.551  12.695
  326    H    HIS  40           H        HIS  40   1.876   1.613  12.521
  327    HA   HIS  40           HA       HIS  40   4.087   0.283  11.357
  328    HB2  HIS  40           2HB      HIS  40   2.504   2.617  10.281
  329    HB3  HIS  40           1HB      HIS  40   3.686   1.697   9.358
  330    HD1  HIS  40           HD1      HIS  40   2.819  -0.985   8.832
  331    HD2  HIS  40           HD2      HIS  40  -0.029   1.689  10.278
  332    HE1  HIS  40           HE1      HIS  40   0.607  -1.961   8.309
  333    H    LEU  41           H        LEU  41   3.631   3.537  12.475
  334    HA   LEU  41           HA       LEU  41   6.122   4.439  11.369
  335    HB2  LEU  41           2HB      LEU  41   5.686   6.548  12.519
  336    HB3  LEU  41           1HB      LEU  41   4.402   6.070  11.420
  337    HG   LEU  41           HG       LEU  41   3.311   5.181  13.654
  338   HD11  LEU  41          1HD1      LEU  41   3.759   6.570  15.575
  339   HD12  LEU  41          2HD1      LEU  41   5.095   7.337  14.716
  340   HD13  LEU  41          3HD1      LEU  41   5.167   5.617  15.109
  341   HD21  LEU  41          3HD2      LEU  41   2.127   7.230  13.875
  342   HD22  LEU  41          1HD2      LEU  41   2.436   6.858  12.181
  343   HD23  LEU  41          2HD2      LEU  41   3.403   8.101  12.998
  344    H    TYR  42           H        TYR  42   5.111   3.174  14.363
  345    HA   TYR  42           HA       TYR  42   7.297   4.173  15.790
  346    HB2  TYR  42           2HB      TYR  42   4.869   2.759  16.195
  347    HB3  TYR  42           1HB      TYR  42   6.110   2.208  17.252
  348    HD1  TYR  42           HD1      TYR  42   7.485   4.699  17.892
  349    HD2  TYR  42           HD2      TYR  42   3.380   4.029  17.282
  350    HE1  TYR  42           HE1      TYR  42   6.991   6.691  19.285
  351    HE2  TYR  42           HE2      TYR  42   2.821   6.024  18.667
  352    HH   TYR  42           HH       TYR  42   3.815   7.402  20.363
  353    H    ASN  43           H        ASN  43   6.184   1.337  14.278
  354    HA   ASN  43           HA       ASN  43   8.113  -0.470  15.311
  355    HB2  ASN  43           2HB      ASN  43   6.362  -0.619  12.861
  356    HB3  ASN  43           1HB      ASN  43   7.617  -1.814  13.120
  357   HD21  ASN  43          2HD2      ASN  43   4.859  -1.849  16.121
  358   HD22  ASN  43          1HD2      ASN  43   5.707  -0.402  15.703
  359    H    LEU  44           H        LEU  44   8.132   1.651  12.369
  360    HA   LEU  44           HA       LEU  44  10.684   0.496  11.829
  361    HB2  LEU  44           2HB      LEU  44   9.035   2.501  10.439
  362    HB3  LEU  44           1HB      LEU  44  10.482   1.714   9.782
  363    HG   LEU  44           HG       LEU  44   7.830   0.414  10.409
  364   HD11  LEU  44          1HD1      LEU  44   7.813   1.553   8.300
  365   HD12  LEU  44          2HD1      LEU  44   7.876  -0.186   8.005
  366   HD13  LEU  44          3HD1      LEU  44   9.330   0.791   7.829
  367   HD21  LEU  44          3HD2      LEU  44   9.578  -1.139  11.059
  368   HD22  LEU  44          1HD2      LEU  44  10.397  -0.913   9.511
  369   HD23  LEU  44          2HD2      LEU  44   8.820  -1.696   9.571
  370    H    GLN  45           H        GLN  45   9.401   3.090  13.558
  371    HA   GLN  45           HA       GLN  45  11.410   5.023  13.238
  372    HB2  GLN  45           2HB      GLN  45   9.312   5.440  14.366
  373    HB3  GLN  45           1HB      GLN  45   9.798   4.367  15.675
  374    HG2  GLN  45           2HG      GLN  45  11.520   5.798  16.349
  375    HG3  GLN  45           1HG      GLN  45  11.400   6.755  14.868
  376   HE21  GLN  45          2HE2      GLN  45   8.764   8.618  15.896
  377   HE22  GLN  45          1HE2      GLN  45   9.758   8.110  14.597
  378    H    ARG  46           H        ARG  46  10.979   2.173  15.153
  379    HA   ARG  46           HA       ARG  46  13.143   2.405  16.976
  380    HB2  ARG  46           2HB      ARG  46  11.929  -0.117  15.845
  381    HB3  ARG  46           1HB      ARG  46  12.940  -0.022  17.268
  382    HG2  ARG  46           2HG      ARG  46  10.172   1.123  16.945
  383    HG3  ARG  46           1HG      ARG  46  10.619  -0.305  17.876
  384    HD2  ARG  46           2HD      ARG  46  10.582   1.206  19.585
  385    HD3  ARG  46           1HD      ARG  46  12.235   1.441  19.002
  386    HE   ARG  46           HE       ARG  46  10.476   3.185  17.661
  387   HH11  ARG  46          1HH1      ARG  46  12.128   2.763  20.752
  388   HH12  ARG  46          2HH1      ARG  46  12.023   4.388  21.244
  389   HH21  ARG  46          2HH2      ARG  46  10.936   5.990  19.816
  390   HH22  ARG  46          1HH2      ARG  46  10.285   5.534  18.350
  391    H    SER  47           H        SER  47  12.870   1.352  13.759
  392    HA   SER  47           HA       SER  47  15.547   0.226  13.660
  393    HB2  SER  47           2HB      SER  47  13.727  -1.033  12.611
  394    HB3  SER  47           1HB      SER  47  13.366   0.334  11.563
  395    HG   SER  47           HG       SER  47  15.812  -0.028  11.080
  396    H    ASN  48           H        ASN  48  14.225   3.345  13.315
  397    HA   ASN  48           HA       ASN  48  14.786   5.209  12.370
  398    HB2  ASN  48           2HB      ASN  48  17.452   3.834  12.300
  399    HB3  ASN  48           1HB      ASN  48  17.278   5.517  11.790
  400   HD21  ASN  48          2HD2      ASN  48  17.317   4.486  15.695
  401   HD22  ASN  48          1HD2      ASN  48  17.295   3.289  14.443
  402    H    GLN  49           H        GLN  49  13.683   3.246  10.790
  403    HA   GLN  49           HA       GLN  49  14.762   3.867   8.140
  404    HB2  GLN  49           2HB      GLN  49  14.039   1.486   8.854
  405    HB3  GLN  49           1HB      GLN  49  12.400   2.092   8.852
  406    HG2  GLN  49           2HG      GLN  49  14.229   1.866   6.450
  407    HG3  GLN  49           1HG      GLN  49  12.864   0.823   6.827
  408   HE21  GLN  49          2HE2      GLN  49  10.460   3.156   5.800
  409   HE22  GLN  49          1HE2      GLN  49  10.778   1.745   6.745
  410    H    VAL  50           H        VAL  50  11.781   4.064  10.161
  411    HA   VAL  50           HA       VAL  50  11.002   6.307   8.538
  412    HB   VAL  50           HB       VAL  50   8.853   5.755   8.601
  413   HG11  VAL  50          1HG1      VAL  50   9.896   3.117   8.445
  414   HG12  VAL  50          2HG1      VAL  50   9.570   4.298   7.201
  415   HG13  VAL  50          3HG1      VAL  50   8.235   3.596   8.113
  416   HG21  VAL  50          3HG2      VAL  50   8.243   5.768  10.811
  417   HG22  VAL  50          1HG2      VAL  50   9.169   4.321  11.193
  418   HG23  VAL  50          2HG2      VAL  50   7.698   4.208  10.211
  419    H    PHE  51           H        PHE  51  10.425   7.890   9.633
  420    HA   PHE  51           HA       PHE  51   9.909   8.131  12.364
  421    HB2  PHE  51           2HB      PHE  51  11.973   9.606  12.979
  422    HB3  PHE  51           1HB      PHE  51  12.164   7.861  12.972
  423    HD1  PHE  51           HD1      PHE  51  13.865   6.925  11.897
  424    HD2  PHE  51           HD2      PHE  51  12.698  10.833  10.776
  425    HE1  PHE  51           HE1      PHE  51  15.801   7.037  10.463
  426    HE2  PHE  51           HE2      PHE  51  14.665  11.000   9.291
  427    HZ   PHE  51           HZ       PHE  51  16.233   9.100   9.125
  428    H    ASN  52           H        ASN  52  10.521  10.795  12.900
  429    HA   ASN  52           HA       ASN  52   9.282  12.100  10.635
  430    HB2  ASN  52           2HB      ASN  52   8.301  13.710  12.221
  431    HB3  ASN  52           1HB      ASN  52   7.638  12.090  12.161
  432   HD21  ASN  52          2HD2      ASN  52   8.225  13.497  15.663
  433   HD22  ASN  52          1HD2      ASN  52   7.591  14.201  14.198
  434    H    SER  53           H        SER  53  10.251  13.518   9.766
  435    HA   SER  53           HA       SER  53  12.150  15.306  11.061
  436    HB2  SER  53           2HB      SER  53  13.282  13.043  11.002
  437    HB3  SER  53           1HB      SER  53  13.288  13.226   9.243
  438    HG   SER  53           HG       SER  53  14.867  14.444  11.166
  439    H    ASN  54           H        ASN  54  13.873  15.603   8.847
  440    HA   ASN  54           HA       ASN  54  14.355  16.349   6.789
  441    HB2  ASN  54           2HB      ASN  54  13.483  14.289   6.002
  442    HB3  ASN  54           1HB      ASN  54  11.832  14.876   6.090
  443   HD21  ASN  54          2HD2      ASN  54  11.899  16.347   2.930
  444   HD22  ASN  54          1HD2      ASN  54  10.975  16.051   4.337
  445    H    GLU  55           H        GLU  55  11.384  17.595   8.040
  446    HA   GLU  55           HA       GLU  55  11.754  19.899   6.385
  447    HB2  GLU  55           2HB      GLU  55   9.277  19.708   5.610
  448    HB3  GLU  55           1HB      GLU  55  10.513  18.782   4.772
  449    HG2  GLU  55           2HG      GLU  55   9.932  16.890   6.318
  450    HG3  GLU  55           1HG      GLU  55   8.450  17.758   6.735
  451    H    LYS  56           H        LYS  56   9.725  21.398   6.768
  452    HA   LYS  56           HA       LYS  56  10.045  22.260   9.401
  453    HB2  LYS  56           2HB      LYS  56   7.878  23.112   7.441
  454    HB3  LYS  56           1HB      LYS  56   8.160  23.873   8.997
  455    HG2  LYS  56           2HG      LYS  56  10.408  24.504   8.271
  456    HG3  LYS  56           1HG      LYS  56  10.115  23.730   6.713
  457    HD2  LYS  56           2HD      LYS  56   8.270  25.275   6.277
  458    HD3  LYS  56           1HD      LYS  56   8.518  26.029   7.852
  459    HE2  LYS  56           2HE      LYS  56  10.768  26.720   7.159
  460    HE3  LYS  56           1HE      LYS  56  10.512  25.967   5.585
  461    HZ1  LYS  56           3HZ      LYS  56   8.695  27.519   5.183
  462    HZ2  LYS  56           1HZ      LYS  56  10.133  28.349   5.502
  463    HZ3  LYS  56           2HZ      LYS  56   8.942  28.237   6.693
  464    HA   PRO  57           HA       PRO  57   6.277  19.991  10.846
  465    HB2  PRO  57           2HB      PRO  57   4.848  18.514   8.880
  466    HB3  PRO  57           1HB      PRO  57   4.299  20.024   9.628
  467    HG2  PRO  57           2HG      PRO  57   4.929  19.713   6.949
  468    HG3  PRO  57           1HG      PRO  57   4.798  21.255   7.816
  469    HD2  PRO  57           2HD      PRO  57   7.232  19.702   7.107
  470    HD3  PRO  57           1HD      PRO  57   6.983  21.459   7.161
  471    HA   PRO  58           HA       PRO  58   9.372  16.618  10.739
  472    HB2  PRO  58           2HB      PRO  58   7.504  15.742  12.918
  473    HB3  PRO  58           1HB      PRO  58   9.284  15.763  12.920
  474    HG2  PRO  58           2HG      PRO  58   7.985  17.625  14.220
  475    HG3  PRO  58           1HG      PRO  58   9.414  18.038  13.249
  476    HD2  PRO  58           2HD      PRO  58   6.547  18.554  12.665
  477    HD3  PRO  58           1HD      PRO  58   7.983  19.510  12.244
  478    H    VAL  59           H        VAL  59   9.106  15.295   9.053
  479    HA   VAL  59           HA       VAL  59   6.454  14.493   8.343
  480    HB   VAL  59           HB       VAL  59   8.070  15.327   6.676
  481   HG11  VAL  59          1HG1      VAL  59  10.133  14.253   7.364
  482   HG12  VAL  59          2HG1      VAL  59   9.748  13.846   5.688
  483   HG13  VAL  59          3HG1      VAL  59   9.457  12.673   6.961
  484   HG21  VAL  59          3HG2      VAL  59   6.938  12.602   6.275
  485   HG22  VAL  59          1HG2      VAL  59   7.543  13.595   4.969
  486   HG23  VAL  59          2HG2      VAL  59   6.139  14.140   5.912
  487    H    TRP  60           H        TRP  60   5.520  12.605   8.777
  488    HA   TRP  60           HA       TRP  60   7.303  10.452   9.405
  489    HB2  TRP  60           2HB      TRP  60   4.275  10.446   9.249
  490    HB3  TRP  60           1HB      TRP  60   5.284   9.130   9.854
  491    HD1  TRP  60           HD1      TRP  60   4.217  12.595  10.647
  492    HE1  TRP  60           HE1      TRP  60   4.396  13.010  13.242
  493    HE3  TRP  60           HE3      TRP  60   6.589   8.346  11.888
  494    HZ2  TRP  60           HZ2      TRP  60   5.478  11.634  15.466
  495    HZ3  TRP  60           HZ3      TRP  60   7.212   7.941  14.231
  496    HH2  TRP  60           HH2      TRP  60   6.671   9.551  15.982
  497    H    ASP  61           H        ASP  61   8.235   9.991   7.894
  498    HA   ASP  61           HA       ASP  61   7.195   8.882   5.430
  499    HB2  ASP  61           2HB      ASP  61   7.466  11.366   4.980
  500    HB3  ASP  61           1HB      ASP  61   9.167  11.222   5.387
  501    H    LEU  62           H        LEU  62   9.381   8.462   4.255
  502    HA   LEU  62           HA       LEU  62  11.252   7.437   6.202
  503    HB2  LEU  62           2HB      LEU  62  11.134   5.122   5.246
  504    HB3  LEU  62           1HB      LEU  62   9.802   5.853   6.162
  505    HG   LEU  62           HG       LEU  62   8.435   6.084   4.265
  506   HD11  LEU  62          1HD1      LEU  62  10.673   4.961   2.628
  507   HD12  LEU  62          2HD1      LEU  62  10.072   6.618   2.584
  508   HD13  LEU  62          3HD1      LEU  62   9.039   5.287   2.057
  509   HD21  LEU  62          3HD2      LEU  62   9.643   3.341   4.288
  510   HD22  LEU  62          1HD2      LEU  62   8.065   3.774   3.643
  511   HD23  LEU  62          2HD2      LEU  62   8.379   3.931   5.373
  512    H    MET  63           H        MET  63  12.966   5.920   4.928
  513    HA   MET  63           HA       MET  63  14.342   7.893   3.246
  514    HB2  MET  63           2HB      MET  63  15.291   5.511   4.799
  515    HB3  MET  63           1HB      MET  63  16.332   6.437   3.735
  516    HG2  MET  63           2HG      MET  63  14.883   7.544   6.136
  517    HG3  MET  63           1HG      MET  63  16.590   7.101   6.087
  518    HE1  MET  63           3HE      MET  63  17.239   9.544   6.964
  519    HE2  MET  63           1HE      MET  63  15.529   9.975   7.007
  520    HE3  MET  63           2HE      MET  63  16.684  11.031   6.194
  521    H    GLU  64           H        GLU  64  12.292   5.876   2.299
  522    HA   GLU  64           HA       GLU  64  13.889   4.712   0.150
  523    HB2  GLU  64           2HB      GLU  64  13.500   2.993   1.891
  524    HB3  GLU  64           1HB      GLU  64  11.781   3.284   1.818
  525    HG2  GLU  64           2HG      GLU  64  12.249   1.241   0.652
  526    HG3  GLU  64           1HG      GLU  64  11.781   2.450  -0.533