*HEADER    ELECTRON TRANSPORT                      27-MAY-15   2N3B              
*TITLE     STRUCTURE OF OXIDIZED HORSE HEART CYTOCHROME C ENCAPSULATED IN REVERSE
*TITLE    2 MICELLES                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYTOCHROME C;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS;                                 
*SOURCE   3 ORGANISM_COMMON: DOMESTIC HORSE,EQUINE;                              
*SOURCE   4 ORGANISM_TAXID: 9796;                                                
*SOURCE   5 GENE: CYCS, CYC;                                                     
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   9 EXPRESSION_SYSTEM_VARIANT: (DE3);                                    
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PJRHRSN2                                   
*KEYWDS    REVERSE MICELLE, STRUCTURAL WATER, PARAMAGNETIC, ELECTRON TRANSPORT   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    32                                                                    
*AUTHOR    E.S.O'BRIEN, N.V.NUCCI, B.FUGLESTAD, C.TOMMOS, A.WAND                 
*REVDAT   1   28-OCT-15 2N3B    0                                                


! Amide NOE distance restraints, those commented out were not used in minimization. 
! Modifications to longer distance bins are noted "ed EO".
assign (residue 29 and name HA#) (residue 29 and name HN)          3.350  1.650  2.150  !  3.280e+008     2   1.640e+008        
assign (residue 78 and name HA) (residue 80 and name HN)           3.350  1.650  2.150  !  1.900e+008     1   1.900e+008        
assign (residue 12 and name HN) (residue 15 and name HB#)          3.600  1.900  2.400  !  2.305e+005     3   7.683e+004        
assign (residue 63 and name HA) (residue 65 and name HN)           3.350  1.650  2.150  !  1.260e+008     1   1.260e+008        
assign (residue 85 and name HA) (residue 85 and name HN)           2.350  0.650  0.650  !  2.840e+009     1   2.840e+009        
assign (residue 72 and name HD#) (residue 77 and name HN)          3.350  1.650  2.150  !  4.420e+008     2   2.210e+008        
assign (residue 11 and name HB) (residue 11 and name HN)           2.850  1.150  1.150  !  1.760e+009     1   1.760e+009 ed EO     
assign (residue 92 and name HN) (residue 88 and name HG#)          3.350  1.650  2.150  !  3.140e+005     2   1.570e+005        
assign (residue 75 and name HG2#) (residue 75 and name HN)         3.600  1.900  2.400  !  4.490e+008     3   1.497e+008        
assign (residue 55 and name HA) (residue 55 and name HN)           2.350  0.650  0.650  !  1.320e+009     1   1.320e+009        
assign (residue 51 and name HB#) (residue 77 and name HN)          3.600  1.900  2.400  !  2.050e+008     3   6.833e+007        
assign (residue 97 and name HB2) (residue 96 and name HN)          3.350  1.650  2.150  !  2.980e+008     1   2.980e+008        
assign (residue 12 and name HB#) (residue 12 and name HE21)        3.350  1.650  2.150  !  3.580e+008     2   1.790e+008        
assign (residue 92 and name HG#) (residue 92 and name HN)          3.350  1.650  1.650  !  1.060e+009     2   5.300e+008 ed EO       
assign (residue 38 and name HB#) (residue 38 and name HN)          2.850  1.150  1.150  !  1.590e+009     2   7.950e+008        
assign (residue 54 and name HB1) (residue 54 and name HD22)        2.850  1.150  1.150  !  1.260e+009     1   1.260e+009 ed EO      
assign (residue 99 and name HA) (residue 100 and name HN)          2.850  1.150  1.150  !  5.860e+008     1   5.860e+008        
assign (residue 28 and name HB) (residue 29 and name HN)           3.350  1.650  2.150  !  2.410e+008     1   2.410e+008        
assign (residue 22 and name HN) (residue 24 and name HN)           3.350  1.650  6.150  !  6.570e+008     1   6.570e+008 ed EO   
assign (residue 102 and name HA) (residue 104 and name HN)         2.850  1.150  1.150  !  4.340e+008     1   4.340e+008        
assign (residue 87 and name HN) (residue 86 and name HG#)          3.350  1.650  2.150  !  1.199e+006     2   5.995e+005        
assign (residue 7 and name HA) (residue 9 and name HN)             3.350  1.650  2.150  !  1.930e+008     1   1.930e+008        
assign (residue 52 and name HD22) (residue 59 and name HE1)        3.350  1.650  2.150  !  1.220e+006     1   1.220e+006        
assign (residue 46 and name HB1) (residue 46 and name HN)          2.350  0.650  0.650  !  1.120e+009     1   1.120e+009        
assign (residue 40 and name HA) (residue 40 and name HN)           2.350  0.650  0.650  !  1.020e+009     1   1.020e+009        
assign (residue 99 and name HG#) (residue 99 and name HN)          2.850  1.150  1.150  !  1.810e+009     2   9.050e+008        
assign (residue 52 and name HA) (residue 52 and name HN)           2.850  1.150  1.150  !  8.820e+008     1   8.820e+008        
!assign (residue 39 and name HB#) (residue 42 and name HE22)        2.850  1.150  1.150  !  9.730e+008     2   4.865e+008        
assign (residue 39 and name HN) (residue 42 and name HE21)         3.350  1.650  2.150  !  1.900e+008     1   1.900e+008        
assign (residue 94 and name HD2#) (residue 14 and name HN)         3.600  1.900  2.400  !  7.140e+007     3   2.380e+007        
assign (residue 63 and name HG2#) (residue 58 and name HN)         3.600  1.900  2.400  !  4.240e+008     3   1.413e+008        
assign (residue 48 and name HA) (residue 48 and name HN)           3.350  1.650  2.150  !  1.980e+008     1   1.980e+008        
!assign (residue 40 and name HB) (residue 59 and name HE1)          2.850  1.150  1.150  !  4.050e+008     1   4.050e+008        
assign (residue 47 and name HN) (residue 46 and name HN)           3.350  1.650  2.150  !  1.060e+008     1   1.060e+008        
assign (residue 64 and name HB#) (residue 64 and name HN)          2.350  0.650  0.650  !  2.750e+009     2   1.375e+009        
assign (residue 26 and name HB2) (residue 27 and name HN)          2.850  1.150  1.150  !  6.990e+008     1   6.990e+008        
assign (residue 41 and name HA1) (residue 41 and name HN)          2.850  1.150  1.150  !  4.180e+008     1   4.180e+008        
assign (residue 100 and name HN) (residue 99 and name HN)          2.350  0.650  0.650  !  1.110e+009     1   1.110e+009        
assign (residue 49 and name HB) (residue 49 and name HN)           2.850  1.150  1.150  !  8.030e+008     1   8.030e+008        
assign (residue 82 and name HN) (residue 81 and name HN)           3.350  1.650  2.150  !  2.520e+008     1   2.520e+008        
assign (residue 35 and name HD1#) (residue 35 and name HN)         3.100  1.400  1.400  !  1.280e+009     3   4.267e+008        
assign (residue 39 and name HN) (residue 42 and name HE22)         3.350  1.650  2.150  !  8.810e+007     1   8.810e+007        
assign (residue 9 and name HA) (residue 9 and name HN)             2.850  1.150  1.150  !  5.610e+008     1   5.610e+008        
assign (residue 90 and name HN) (residue 92 and name HN)           2.850  1.150  1.150  !  4.770e+008     1   4.770e+008        
assign (residue 7 and name HN) (residue 6 and name HN)             2.350  0.650  0.650  !  1.780e+009     1   1.780e+009        
assign (residue 65 and name HB#) (residue 65 and name HN)          2.350  0.650  0.650  !  2.000e+009     2   1.000e+009        
assign (residue 101 and name HN) (residue 100 and name HG#)        3.350  1.650  2.150  !  3.888e+005     2   1.944e+005        
assign (residue 21 and name HN) (residue 22 and name HN)           3.350  1.650  2.150  !  3.580e+008     1   3.580e+008 ed EO       
assign (residue 53 and name HG#) (residue 53 and name HN)          2.850  1.150  1.150  !  9.070e+008     2   4.535e+008        
assign (residue 91 and name HN) (residue 90 and name HA)           3.350  1.650  2.150  !  3.448e+005     1   3.448e+005        
assign (residue 26 and name HN) (residue 26 and name HA)           3.350  1.650  2.150  !  3.690e+005     1   3.690e+005        
assign (residue 53 and name HG#) (residue 54 and name HN)          3.350  1.650  2.150  !  3.240e+008     2   1.620e+008        
assign (residue 65 and name HA) (residue 65 and name HN)           2.850  1.150  1.150  !  8.740e+008     1   8.740e+008        
assign (residue 89 and name HB) (residue 89 and name HN)           2.850  1.150  1.150  !  5.380e+008     1   5.380e+008        
assign (residue 17 and name HA) (residue 17 and name HN)           2.850  1.150  1.150  !  4.580e+008     1   4.580e+008        
assign (residue 42 and name HA) (residue 42 and name HE21)         3.350  1.650  2.150  !  1.650e+008     1   1.650e+008        
assign (residue 11 and name HN) (residue 10 and name HN)           2.850  1.150  1.150  !  7.570e+008     1   7.570e+008        
assign (residue 67 and name HB1) (residue 67 and name HN)          2.850  1.150  1.150  !  9.580e+008     1   9.580e+008        
assign (residue 8 and name HD#) (residue 12 and name HE22)         3.350  1.650  2.150  !  2.760e+008     2   1.380e+008        
assign (residue 65 and name HN) (residue 64 and name HN)           2.850  1.150  1.150  !  5.400e+008     1   5.400e+008        
assign (residue 11 and name HN) (residue 8 and name HA)            3.350  1.650  2.150  !  4.631e+005     1   4.631e+005        
assign (residue 72 and name HA) (residue 75 and name HN)           2.850  1.150  1.150  !  6.730e+008     1   6.730e+008        
assign (residue 97 and name HB1) (residue 98 and name HN)          2.850  1.150  1.150  !  4.710e+008     1   4.710e+008        
assign (residue 71 and name HA) (residue 70 and name HN)           3.350  1.650  2.150  !  6.010e+008     1   6.010e+008        
assign (residue 60 and name HN) (residue 63 and name HN)           2.850  1.150  1.150  !  4.450e+008     1   4.450e+008        
assign (residue 91 and name HD#) (residue 65 and name HN)          3.350  1.650  2.150  !  1.950e+008     2   9.750e+007        
assign (residue 41 and name HN) (residue 59 and name HE1)          2.850  1.150  1.150  !  3.220e+008     1   3.220e+008        
assign (residue 12 and name HN) (residue 15 and name HN)           3.350  1.650  2.150  !  7.750e+008     1   7.750e+008  ed EO      
assign (residue 19 and name HB) (residue 20 and name HN)           2.850  1.150  1.150  !  7.710e+008     1   7.710e+008        
assign (residue 54 and name HN) (residue 54 and name HD22)         2.850  1.150  1.150  !  6.840e+008     1   6.840e+008        
assign (residue 10 and name HA) (residue 11 and name HN)           2.850  1.150  1.150  !  3.690e+008     1   3.690e+008        
assign (residue 58 and name HA) (residue 58 and name HN)           2.850  1.150  1.150  !  4.930e+008     1   4.930e+008        
assign (residue 72 and name HN) (residue 71 and name HD2)          3.350  1.650  2.150  !  3.458e+005     1   3.458e+005        
assign (residue 65 and name HB#) (residue 66 and name HN)          2.850  1.150  1.150  !  9.820e+008     2   4.910e+008        
assign (residue 8 and name HN) (residue 9 and name HN)             2.850  1.150  1.150  !  6.320e+008     1   6.320e+008        
assign (residue 42 and name HN) (residue 41 and name HN)           2.850  1.150  1.150  !  7.140e+008     1   7.140e+008        
assign (residue 40 and name HG2#) (residue 59 and name HE1)        3.600  1.900  2.400  !  4.370e+008     3   1.457e+008        
assign (residue 11 and name HA) (residue 11 and name HN)           2.850  1.150  1.150  !  9.750e+008     1   9.750e+008        
assign (residue 101 and name HA) (residue 101 and name HN)         2.350  0.650  0.650  !  1.400e+009     1   1.400e+009        
assign (residue 37 and name HN) (residue 59 and name HN)           3.350  1.650  2.150  !  1.550e+008     1   1.550e+008        
assign (residue 7 and name HN) (residue 4 and name HA)             3.350  1.650  2.150  !  4.574e+005     1   4.574e+005        
assign (residue 36 and name HD1) (residue 60 and name HN)          3.350  1.650  2.150  !  1.240e+009     1   1.240e+009        
assign (residue 3 and name HG2#) (residue 101 and name HN)         3.600  1.900  2.400  !  2.180e+008     3   7.267e+007        
assign (residue 69 and name HB#) (residue 70 and name HN)          2.850  1.150  1.150  !  7.070e+008     2   3.535e+008        
assign (residue 51 and name HN) (residue 52 and name HN)           2.850  1.150  1.150  !  7.720e+008     1   7.720e+008        
assign (residue 57 and name HG12) (residue 57 and name HN)         2.850  1.150  1.150  !  1.500e+009     1   1.500e+009   ed EO     
assign (residue 61 and name HN) (residue 61 and name HG#)          3.350  1.650  2.150  !  3.425e+005     2   1.713e+005        
assign (residue 89 and name HA) (residue 92 and name HN)           2.850  1.150  1.150  !  6.510e+008     1   6.510e+008        
assign (residue 39 and name HD#) (residue 56 and name HN)          3.350  1.650  2.150  !  2.560e+008     2   1.280e+008        
assign (residue 70 and name HB#) (residue 70 and name HD21)        3.350  1.650  2.150  !  4.950e+008     2   2.475e+008        
assign (residue 21 and name HB#) (residue 24 and name HN)          3.350  1.650  2.150  !  1.770e+008     2   8.850e+007        
assign (residue 57 and name HG2#) (residue 57 and name HN)         3.100  1.400  1.400  !  2.380e+009     3   7.933e+008        
assign (residue 54 and name HB1) (residue 53 and name HN)          2.850  1.150  1.150  !  5.520e+008     1   5.520e+008        
assign (residue 31 and name HN) (residue 26 and name HA)           3.350  1.650  2.150  !  4.092e+005     1   4.092e+005        
assign (residue 90 and name HN) (residue 91 and name HN)           2.850  1.150  1.150  !  8.510e+008     1   8.510e+008        
assign (residue 22 and name HA) (residue 22 and name HN)           2.850  1.150  1.150  !  6.180e+008     1   6.180e+008        
assign (residue 23 and name HA2) (residue 24 and name HN)          2.350  0.650  0.650  !  1.810e+009     1   1.810e+009        
assign (residue 94 and name HN) (residue 94 and name HD2#)         3.600  1.900  2.400  !  3.072e+005     3   1.024e+005        
assign (residue 92 and name HA) (residue 92 and name HN)           2.850  1.150  1.150  !  5.900e+008     1   5.900e+008        
assign (residue 77 and name HA1) (residue 77 and name HN)          2.350  0.650  0.650  !  1.370e+009     1   1.370e+009        
assign (residue 9 and name HG2#) (residue 9 and name HN)           3.600  1.900  2.400  !  5.000e+008     3   1.667e+008        
assign (residue 73 and name HN) (residue 75 and name HN)           3.350  1.650  2.150  !  6.110e+008     1   6.110e+008    ed EO    
assign (residue 1 and name HA1) (residue 2 and name HN)            2.850  1.150  1.150  !  8.720e+008     1   8.720e+008        
assign (residue 8 and name HN) (residue 10 and name HN)            2.850  1.150  1.150  !  7.310e+008     1   7.310e+008        
assign (residue 91 and name HA) (residue 92 and name HN)           3.350  1.650  2.150  !  2.270e+008     1   2.270e+008        
assign (residue 58 and name HN) (residue 57 and name HN)           3.350  1.650  2.150  !  2.570e+008     1   2.570e+008        
assign (residue 94 and name HA) (residue 97 and name HN)           2.850  1.150  1.150  !  3.010e+008     1   3.010e+008        
assign (residue 56 and name HN) (residue 55 and name HN)           2.850  1.150  1.150  !  7.420e+008     1   7.420e+008        
assign (residue 95 and name HG2#) (residue 95 and name HN)         3.600  1.900  2.400  !  6.970e+008     3   2.323e+008        
assign (residue 60 and name HE#) (residue 58 and name HN)          3.350  1.650  2.150  !  8.000e+007     2   4.000e+007        
assign (residue 49 and name HG2#) (residue 50 and name HN)         3.600  1.900  2.400  !  5.960e+008     3   1.987e+008        
assign (residue 59 and name HD1) (residue 59 and name HN)          2.850  1.150  1.150  !  3.430e+008     1   3.430e+008        
assign (residue 8 and name HA) (residue 9 and name HN)             2.850  1.150  1.150  !  5.400e+008     1   5.400e+008        
!assign (residue 95 and name HD1#) (residue 62 and name HN)         3.600  1.900  2.400  !  1.040e+008     3   3.467e+007        
assign (residue 18 and name HN) (residue 17 and name HN)           2.350  0.650  0.650  !  1.150e+009     1   1.150e+009        
assign (residue 65 and name HA) (residue 68 and name HN)           3.350  1.650  2.150  !  2.810e+008     1   2.810e+008        
assign (residue 35 and name HN) (residue 34 and name HN)           2.850  1.150  1.150  !  8.500e+008     1   8.500e+008        
assign (residue 32 and name HN) (residue 19 and name HN)           2.850  1.150  1.650  !  5.300e+007     1   5.300e+007        
assign (residue 97 and name HD2) (residue 98 and name HN)          3.350  1.650  2.150  !  1.150e+008     1   1.150e+008        
!assign (residue 11 and name HG1#) (residue 12 and name HE21)       3.600  1.900  2.400  !  3.920e+008     3   1.307e+008        
assign (residue 60 and name HG#) (residue 60 and name HN)          2.850  1.150  1.150  !  1.360e+009     2   6.800e+008        
assign (residue 51 and name HB#) (residue 52 and name HN)          3.100  1.400  1.400  !  1.060e+009     3   3.533e+008        
!assign (residue 60 and name HD1) (residue 60 and name HN)          3.350  1.650  2.150  !  9.530e+008     1   9.530e+008   ed EO     
assign (residue 82 and name HD#) (residue 82 and name HN)          3.350  1.650  2.150  !  2.570e+007     2   1.285e+007        
assign (residue 90 and name HN) (residue 89 and name HN)           2.850  1.150  1.150  !  4.220e+008     1   4.220e+008        
assign (residue 63 and name HB) (residue 63 and name HN)           3.350  1.650  2.150  !  1.630e+008     1   1.630e+008        
assign (residue 70 and name HB1) (residue 70 and name HN)          2.850  1.150  1.150  !  3.210e+008     1   3.210e+008        
assign (residue 60 and name HA) (residue 61 and name HN)           2.850  1.150  1.150  !  3.700e+008     1   3.700e+008        
assign (residue 11 and name HN) (residue 14 and name HN)           3.350  1.650  2.150  !  6.690e+008     1   6.690e+008   ed EO     
assign (residue 10 and name HA) (residue 13 and name HN)           3.350  1.650  2.150  !  2.080e+008     1   2.080e+008        
assign (residue 73 and name HB#) (residue 73 and name HN)          2.350  0.650  0.650  !  2.060e+009     2   1.030e+009        
assign (residue 72 and name HG#) (residue 72 and name HN)          3.350  1.650  1.650  !  6.200e+008     2   3.100e+008 ed EO        
assign (residue 13 and name HN) (residue 14 and name HN)           2.350  0.650  0.650  !  1.920e+009     1   1.920e+009        
assign (residue 26 and name HB1) (residue 27 and name HN)          2.850  1.150  1.150  !  5.920e+008     1   5.920e+008        
assign (residue 47 and name HN) (residue 48 and name HN)           2.850  1.150  1.150  !  7.770e+008     1   7.770e+008        
assign (residue 16 and name HN) (residue 17 and name HN)           2.850  1.150  1.150  !  5.340e+008     1   5.340e+008        
assign (residue 67 and name HB2) (residue 67 and name HN)          2.350  0.650  0.650  !  1.580e+009     1   1.580e+009        
assign (residue 58 and name HG2#) (residue 38 and name HN)         3.600  1.900  2.400  !  4.940e+008     3   1.647e+008        
assign (residue 35 and name HN) (residue 102 and name HA)          3.350  1.650  2.150  !  3.817e+005     1   3.817e+005        
assign (residue 98 and name HN) (residue 96 and name HN)           3.350  1.650  2.150  !  1.320e+008     1   1.320e+008        
assign (residue 79 and name HD#) (residue 79 and name HN)          3.350  1.650  2.150  !  3.550e+007     2   1.775e+007        
assign (residue 12 and name HE22) (residue 12 and name HE21)       2.350  0.650  0.650  !  6.190e+009     1   6.190e+009        
assign (residue 35 and name HG) (residue 36 and name HN)           2.850  1.150  1.150  !  4.790e+008     1   4.790e+008        
assign (residue 9 and name HD1#) (residue 93 and name HN)          3.600  1.900  2.400  !  2.380e+008     3   7.933e+007        
assign (residue 94 and name HN) (residue 9 and name HD1#)          3.600  1.900  2.400  !  4.830e+005     3   1.610e+005        
assign (residue 88 and name HB#) (residue 89 and name HN)          2.850  1.150  1.150  !  1.550e+009     2   7.750e+008        
assign (residue 91 and name HB#) (residue 65 and name HN)          3.350  1.650  2.150  !  1.520e+008     2   7.600e+007        
assign (residue 9 and name HA) (residue 8 and name HN)             3.350  1.650  2.150  !  2.160e+008     1   2.160e+008        
assign (residue 36 and name HD#) (residue 36 and name HN)          3.350  1.650  2.150  !  1.720e+008     2   8.600e+007        
assign (residue 103 and name HB1) (residue 103 and name HD21)      2.850  1.150  1.150  !  3.650e+008     1   3.650e+008        
assign (residue 30 and name HA) (residue 31 and name HN)           2.850  1.150  1.150  !  8.050e+008     1   8.050e+008        
assign (residue 90 and name HA) (residue 93 and name HN)           2.850  1.150  1.150  !  9.770e+008     1   9.770e+008        
assign (residue 67 and name HN) (residue 64 and name HD2#)         3.600  1.900  2.400  !  3.741e+005     3   1.247e+005        
assign (residue 98 and name HN) (residue 95 and name HN)           3.350  1.650  2.150  !  1.170e+009     1   1.170e+009   ed EO     
assign (residue 63 and name HG2#) (residue 63 and name HN)         3.100  1.400  1.400  !  2.410e+009     3   8.033e+008        
assign (residue 72 and name HA) (residue 73 and name HN)           2.850  1.150  1.150  !  3.150e+008     1   3.150e+008        
assign (residue 99 and name HA) (residue 102 and name HN)          2.850  1.150  1.150  !  1.080e+009     1   1.080e+009   ed EO     
assign (residue 26 and name HD2) (residue 46 and name HN)          3.350  1.650  2.150  !  1.500e+008     1   1.500e+008        
assign (residue 53 and name HN) (residue 53 and name HD#)          3.350  1.650  2.150  !  3.025e+005     2   1.512e+005        
assign (residue 13 and name HE#) (residue 13 and name HN)          3.350  1.650  2.150  !  2.230e+008     2   1.115e+008        
assign (residue 48 and name HB1) (residue 49 and name HN)          2.850  1.150  1.150  !  4.040e+008     1   4.040e+008        
assign (residue 58 and name HB) (residue 58 and name HN)           2.350  0.650  0.650  !  1.310e+009     1   1.310e+009        
assign (residue 21 and name HA) (residue 22 and name HN)           2.350  0.650  0.650  !  1.710e+009     1   1.710e+009        
assign (residue 32 and name HB2) (residue 32 and name HN)          3.350  1.650  2.150  !  1.850e+008     1   1.850e+008        
assign (residue 16 and name HN) (residue 16 and name HG#)          3.350  1.650  2.150  !  5.641e+005     2   2.820e+005        
assign (residue 10 and name HB2) (residue 11 and name HN)          2.850  1.150  1.150  !  4.730e+008     1   4.730e+008        
!assign (residue 39 and name HD#) (residue 42 and name HE21)        3.350  1.650  2.150  !  2.650e+008     2   1.325e+008        
assign (residue 66 and name HN) (residue 65 and name HG2)          3.350  1.650  2.150  !  3.784e+005     1   3.784e+005        
assign (residue 18 and name HN) (residue 15 and name HA)           3.350  1.650  2.150  !  2.256e+005     1   2.256e+005        
!assign (residue 18 and name HD2) (residue 32 and name HN)          3.350  1.650  2.150  !  1.750e+008     1   1.750e+008    
assign (residue 93 and name HB#) (residue 93 and name HN)          2.850  1.150  1.150  !  1.990e+009     2   9.950e+008        
assign (residue 64 and name HB#) (residue 65 and name HN)          2.850  1.150  1.150  !  1.790e+009     2   8.950e+008        
assign (residue 2 and name HB2) (residue 2 and name HN)            2.350  0.650  0.650  !  1.110e+009     1   1.110e+009        
assign (residue 66 and name HN) (residue 67 and name HN)           2.350  0.650  0.650  !  1.400e+009     1   1.400e+009        
assign (residue 17 and name HN) (residue 16 and name HB1)          3.350  1.650  2.150  !  3.687e+005     1   3.687e+005        
assign (residue 70 and name HA) (residue 70 and name HN)           2.850  1.150  1.150  !  7.720e+008     1   7.720e+008        
assign (residue 57 and name HA) (residue 56 and name HN)           3.350  1.650  2.150  !  5.100e+008  1   5.100e+008edEO       
!assign (residue 38 and name HN) (residue 59 and name HB2)          3.350  1.650  2.150  !  2.054e+005     1   2.054e+005        
assign (residue 12 and name HN) (residue 13 and name HN)           2.850  1.150  1.150  !  6.680e+008     1   6.680e+008        
assign (residue 40 and name HN) (residue 59 and name HE1)          3.350  1.650  2.150  !  5.690e+008     1   5.690e+008        
assign (residue 62 and name HN) (residue 64 and name HN)           3.350  1.650  2.150  !  8.910e+007     1   8.910e+007        
assign (residue 5 and name HN) (residue 5 and name HE#)            3.350  1.650  2.150  !  4.226e+005     2   2.113e+005        
assign (residue 35 and name HB#) (residue 36 and name HN)          3.350  1.650  2.150  !  4.640e+008     2   2.320e+008        
assign (residue 18 and name HD2) (residue 19 and name HN)          3.350  1.650  2.150  !  7.100e+008     1   7.100e+008        
assign (residue 80 and name HA) (residue 80 and name HN)           2.350  0.650  0.650  !  1.150e+009     1   1.150e+009        
assign (residue 3 and name HG1#) (residue 3 and name HN)           3.100  1.400  1.400  !  2.280e+009     3   7.600e+008        
assign (residue 94 and name HD1#) (residue 11 and name HN)         3.600  1.900  2.400  !  2.190e+008     3   7.300e+007        
assign (residue 68 and name HD1#) (residue 91 and name HN)         3.600  1.900  2.400  !  4.070e+007     3   1.357e+007        
assign (residue 101 and name HN) (residue 104 and name HN)         3.350  1.650  2.150  !  5.740e+007     1   5.740e+007        
assign (residue 103 and name HB2) (residue 103 and name HD21)      2.850  1.150  1.150  !  3.260e+008     1   3.260e+008        
assign (residue 95 and name HG2#) (residue 96 and name HN)         3.600  1.900  2.400  !  6.300e+008     3   2.100e+008        
assign (residue 16 and name HG#) (residue 16 and name HE21)        3.350  1.650  2.150  !  2.340e+008     2   1.170e+008        
assign (residue 74 and name HN) (residue 74 and name HB#)          3.350  1.650  2.150  !  5.692e+005     2   2.846e+005        
!assign (residue 59 and name HE1) (residue 39 and name HN)          3.350  1.650  2.150  !  3.580e+007     1   3.580e+007        
assign (residue 97 and name HN) (residue 98 and name HN)           2.850  1.150  1.150  !  7.040e+008     1   7.040e+008        
assign (residue 95 and name HG2#) (residue 64 and name HN)         3.600  1.900  2.400  !  1.040e+008     3   3.467e+007        
assign (residue 57 and name HD1#) (residue 58 and name HN)         3.600  1.900  2.400  !  3.140e+008     3   1.047e+008        
assign (residue 35 and name HA) (residue 35 and name HN)           2.350  0.650  0.650  !  1.520e+009     1   1.520e+009        
assign (residue 10 and name HN) (residue 8 and name HD#)           3.350  1.650  2.150  !  3.241e+005     2   1.620e+005        
assign (residue 72 and name HB#) (residue 72 and name HN)          2.850  1.150  1.150  !  1.320e+009     2   6.600e+008        
assign (residue 97 and name HB2) (residue 7 and name HN)           2.850  1.150  1.150  !  4.460e+008     1   4.460e+008        
assign (residue 39 and name HB#) (residue 40 and name HN)          2.850  1.150  1.150  !  2.030e+009   2   1.015e+009ed EO      
assign (residue 61 and name HB1) (residue 61 and name HN)          2.350  0.650  0.650  !  1.540e+009     1   1.540e+009        
assign (residue 70 and name HA) (residue 72 and name HN)           2.850  1.150  1.150  !  5.210e+008     1   5.210e+008        
assign (residue 25 and name HE#) (residue 25 and name HN)          3.350  1.650  2.150  !  2.500e+008     2   1.250e+008        
assign (residue 23 and name HN) (residue 24 and name HN)           2.850  1.150  1.150  !  5.940e+008     1   5.940e+008        
assign (residue 37 and name HA2) (residue 38 and name HN)          2.850  1.150  1.150  !  9.300e+008     1   9.300e+008        
assign (residue 7 and name HD#) (residue 7 and name HN)            3.350  1.650  2.150  !  1.200e+009     2   6.000e+008ed EO        
assign (residue 95 and name HD1#) (residue 92 and name HN)         3.600  1.900  2.400  !  1.680e+008     3   5.600e+007        
assign (residue 102 and name HN) (residue 104 and name HN)         2.850  1.150  1.150  !  5.340e+008     1   5.340e+008        
assign (residue 4 and name HN) (residue 3 and name HG1#)           3.600  1.900  2.400  !  1.256e+006     3   4.188e+005        
assign (residue 16 and name HB2) (residue 16 and name HN)          2.850  1.150  1.150  !  9.930e+008     1   9.930e+008        
assign (residue 99 and name HB#) (residue 100 and name HN)         2.350  0.650  0.650  !  2.710e+009     2   1.355e+009        
assign (residue 68 and name HN) (residue 69 and name HN)           2.850  1.150  1.150  !  8.630e+008     1   8.630e+008        
assign (residue 35 and name HB#) (residue 35 and name HN)          2.350  0.650  0.650  !  2.200e+009     2   1.100e+009        
assign (residue 11 and name HN) (residue 13 and name HN)           2.850  1.150  1.150  !  4.680e+008     1   4.680e+008        
assign (residue 12 and name HB#) (residue 12 and name HE22)        3.350  1.650  2.150  !  1.640e+008     2   8.200e+007        
assign (residue 13 and name HN) (residue 13 and name HD#)          3.350  1.650  2.150  !  7.744e+005     2   3.872e+005        
assign (residue 5 and name HB#) (residue 6 and name HN)            2.850  1.150  1.150  !  1.630e+009     2   8.150e+008        
assign (residue 36 and name HA) (residue 36 and name HN)           2.350  0.650  0.650  !  1.070e+009     1   1.070e+009        
assign (residue 69 and name HA) (residue 70 and name HN)           2.850  1.150  1.150  !  8.600e+008     1   8.600e+008        
assign (residue 23 and name HA1) (residue 23 and name HN)          2.850  1.150  1.150  !  3.970e+008     1   3.970e+008        
assign (residue 13 and name HA) (residue 13 and name HN)           2.850  1.150  1.150  !  8.130e+008     1   8.130e+008        
!assign (residue 31 and name HN) (residue 27 and name HN)           3.350  1.650  2.150  !  7.390e+007     1   7.390e+007        
assign (residue 42 and name HN) (residue 42 and name HE21)         3.350  1.650  2.150  !  3.740e+007     1   3.740e+007        
assign (residue 51 and name HN) (residue 50 and name HB#)          2.600  0.900  0.900  !  1.333e+006     2   6.664e+005        
assign (residue 99 and name HG#) (residue 36 and name HN)          3.350  1.650  2.150  !  3.520e+008     2   1.760e+008        
assign (residue 49 and name HN) (residue 49 and name HA)           3.350  1.650  2.150  !  2.949e+005     1   2.949e+005        
assign (residue 46 and name HB2) (residue 46 and name HN)          2.350  0.650  0.650  !  1.220e+009     1   1.220e+009        
assign (residue 57 and name HN) (residue 40 and name HN)           3.350  1.650  2.150  !  1.620e+008     1   1.620e+008        
assign (residue 31 and name HA) (residue 32 and name HN)           2.850  1.150  1.150  !  6.410e+008     1   6.410e+008        
assign (residue 25 and name HN) (residue 24 and name HN)           2.850  1.150  1.150  !  7.380e+008     1   7.380e+008        
assign (residue 35 and name HD2#) (residue 36 and name HN)         3.600  1.900  2.400  !  1.730e+008     3   5.767e+007        
assign (residue 65 and name HN) (residue 63 and name HN)           2.850  1.150  1.150  !  5.300e+008     1   5.300e+008        
assign (residue 71 and name HB1) (residue 70 and name HN)          3.600  1.900  2.400  !  1.990e+008     1   1.990e+008        
assign (residue 81 and name HA) (residue 81 and name HN)           2.850  1.150  1.150  !  3.590e+008     1   3.590e+008        
assign (residue 73 and name HN) (residue 72 and name HB#)          3.350  1.650  2.150  !  4.630e+005     2   2.315e+005        
assign (residue 103 and name HN) (residue 104 and name HN)         2.350  0.650  0.650  !  3.590e+009     1   3.590e+009        
assign (residue 100 and name HN) (residue 101 and name HN)         2.350  0.650  0.650  !  1.160e+009     1   1.160e+009        
assign (residue 70 and name HB1) (residue 73 and name HN)          3.350  1.650  2.150  !  2.040e+008     1   2.040e+008        
assign (residue 19 and name HN) (residue 27 and name HN)           3.350  1.650  2.150  !  9.420e+007     1   9.420e+007        
assign (residue 60 and name HA) (residue 62 and name HN)           3.350  1.650  2.150  !  1.940e+008     1   1.940e+008        
assign (residue 61 and name HA) (residue 63 and name HN)           3.350  1.650  2.150  !  2.920e+008     1   2.920e+008        
assign (residue 92 and name HB#) (residue 92 and name HN)          2.850  1.150  1.150  !  1.350e+009     2   6.750e+008        
assign (residue 38 and name HB#) (residue 37 and name HN)          3.350  1.650  2.150  !  5.790e+008     2   2.895e+008        
assign (residue 53 and name HA) (residue 54 and name HN)           3.350  1.650  2.150  !  2.450e+008     1   2.450e+008        
assign (residue 43 and name HA) (residue 43 and name HN)           2.850  1.150  1.150  !  3.860e+008     1   3.860e+008        
assign (residue 57 and name HB) (residue 58 and name HN)           2.350  0.650  0.650  !  1.640e+009     1   1.640e+009        
assign (residue 2 and name HB1) (residue 3 and name HN)            3.350  1.650  2.150  !  2.590e+008     1   2.590e+008        
assign (residue 90 and name HA) (residue 90 and name HN)           2.350  0.650  0.650  !  1.290e+009     1   1.290e+009        
assign (residue 84 and name HA1) (residue 85 and name HN)          2.350  0.650  0.650  !  1.390e+009     1   1.390e+009        
assign (residue 101 and name HB#) (residue 103 and name HN)        3.600  1.900  2.400  !  1.690e+008     3   5.633e+007        
assign (residue 32 and name HA) (residue 32 and name HN)           2.850  1.150  1.150  !  6.890e+008     1   6.890e+008        
assign (residue 39 and name HN) (residue 38 and name HB#)          3.350  1.650  2.150  !  7.557e+005     2   3.778e+005        
assign (residue 43 and name HB#) (residue 43 and name HN)          3.100  1.400  1.400  !  1.800e+009     3   6.000e+008        
assign (residue 54 and name HB1) (residue 54 and name HD21)        2.850  1.150  1.150  !  6.220e+008     1   6.220e+008        
assign (residue 47 and name HG2#) (residue 48 and name HN)         3.600  1.900  2.400  !  7.210e+008     3   2.403e+008        
assign (residue 4 and name HN) (residue 4 and name HA)             2.600  0.900  0.900  !  1.351e+006     1   1.351e+006        
assign (residue 10 and name HA) (residue 10 and name HN)           2.850  1.150  1.150  !  9.450e+008     1   9.450e+008        
assign (residue 95 and name HA) (residue 95 and name HN)           2.850  1.150  1.150  !  4.240e+008     1   4.240e+008        
assign (residue 98 and name HD1#) (residue 99 and name HN)         3.600  1.900  2.400  !  1.730e+008     3   5.767e+007        
assign (residue 7 and name HA) (residue 7 and name HN)             2.350  0.650  0.650  !  1.120e+009     1   1.120e+009        
assign (residue 60 and name HD2) (residue 61 and name HN)          2.850  1.150  1.150  !  4.080e+008     1   4.080e+008        
assign (residue 55 and name HG#) (residue 55 and name HN)          3.350  1.650  2.150  !  1.170e+009     2   5.850e+008   ed EO     
assign (residue 94 and name HN) (residue 94 and name HB1)          3.350  1.650  2.150  !  3.734e+005     1   3.734e+005        
assign (residue 98 and name HA) (residue 101 and name HN)          3.350  1.650  2.150  !  1.600e+008     1   1.600e+008        
assign (residue 81 and name HG2#) (residue 82 and name HN)         3.100  1.400  1.400  !  1.150e+009     3   3.833e+008        
assign (residue 78 and name HB) (residue 78 and name HN)           2.350  0.650  0.650  !  1.040e+009     1   1.040e+009        
assign (residue 12 and name HG1) (residue 12 and name HN)          2.850  1.150  1.150  !  4.980e+008     1   4.980e+008        
assign (residue 85 and name HB) (residue 87 and name HN)           3.350  1.650  2.150  !  1.750e+008     1   1.750e+008        
assign (residue 27 and name HN) (residue 26 and name HN)           3.350  1.650  2.150  !  1.330e+008     1   1.330e+008        
assign (residue 59 and name HB1) (residue 59 and name HN)          2.850  1.150  1.150  !  6.990e+008     1   6.990e+008        
assign (residue 3 and name HG2#) (residue 97 and name HN)          3.600  1.900  2.400  !  5.020e+008     3   1.673e+008        
assign (residue 92 and name HN) (residue 91 and name HN)           2.850  1.150  1.150  !  9.210e+008     1   9.210e+008        
assign (residue 62 and name HN) (residue 63 and name HG2#)         3.600  1.900  2.400  !  6.396e+005     3   2.132e+005        
assign (residue 19 and name HA) (residue 18 and name HN)           3.350  1.650  2.150  !  3.160e+007     1   3.160e+007        
assign (residue 2 and name HN) (residue 94 and name HN)            3.350  1.650  2.150  !  4.940e+008     1   4.940e+008        
assign (residue 84 and name HA2) (residue 85 and name HN)          2.350  0.650  0.650  !  1.140e+009     1   1.140e+009        
assign (residue 69 and name HN) (residue 84 and name HA1)          3.350  1.650  2.150  !  2.108e+005     1   2.108e+005        
assign (residue 90 and name HG#) (residue 90 and name HN)          2.850  1.150  1.150  !  1.200e+009     2   6.000e+008        
assign (residue 39 and name HN) (residue 58 and name HG2#)         3.600  1.900  2.400  !  4.731e+005     3   1.577e+005        
assign (residue 12 and name HA) (residue 12 and name HN)           2.850  1.150  1.150  !  9.100e+008     1   9.100e+008        
assign (residue 73 and name HA) (residue 70 and name HD21)         2.850  1.150  1.150  !  5.770e+009    1   5.770e+009ed EO        
assign (residue 53 and name HB#) (residue 53 and name HN)          2.350  0.650  0.650  !  2.070e+009     2   1.035e+009        
assign (residue 8 and name HB#) (residue 9 and name HN)            2.850  1.150  1.150  !  1.200e+009     2   6.000e+008        
!assign (residue 16 and name HG#) (residue 18 and name HN)          3.350  1.650  2.150  !  3.950e+007     2   1.975e+007        
assign (residue 100 and name HN) (residue 97 and name HN)          3.350  1.650  2.150  !  1.320e+008     1   1.320e+008        
assign (residue 17 and name HN) (residue 16 and name HG2)          3.350  1.650  2.150  !  4.004e+005     1   4.004e+005        
assign (residue 4 and name HN) (residue 2 and name HN)             3.350  1.650  2.150  !  7.660e+007     1   7.660e+007        
assign (residue 9 and name HG2#) (residue 13 and name HN)          3.600  1.900  2.400  !  3.160e+008     3   1.053e+008        
assign (residue 72 and name HG#) (residue 77 and name HN)          3.350  1.650  2.150  !  3.080e+007     2   1.540e+007        
assign (residue 64 and name HD1#) (residue 65 and name HN)         3.600  1.900  2.400  !  8.710e+008     3   2.903e+008        
assign (residue 65 and name HA) (residue 67 and name HN)           2.850  1.150  1.150  !  5.930e+008     1   5.930e+008        
assign (residue 67 and name HA) (residue 66 and name HN)           3.350  1.650  2.150  !  1.250e+009     1   1.250e+009   ed EO     
assign (residue 53 and name HN) (residue 54 and name HA)           3.350  1.650  2.150  !  3.050e+005     1   3.050e+005        
assign (residue 62 and name HN) (residue 63 and name HN)           2.850  1.150  1.150  !  8.180e+008     1   8.180e+008        
assign (residue 35 and name HG) (residue 35 and name HN)           3.350  1.650  2.150  !  3.320e+009     1  3.320e+009ed EO     
assign (residue 34 and name HN) (residue 36 and name HN)           3.350  1.650  2.150  !  3.420e+008     1   3.420e+008 ed EO       
assign (residue 102 and name HA) (residue 102 and name HN)         2.850  1.150  1.150  !  6.050e+008     1   6.050e+008        
assign (residue 12 and name HN) (residue 9 and name HN)            3.350  1.650  2.150  !  6.230e+008     1   6.230e+008 ed EO    
assign (residue 78 and name HA) (residue 78 and name HN)           2.350  0.650  0.650  !  1.310e+009     1   1.310e+009        
assign (residue 14 and name HB1) (residue 14 and name HN)          2.850  1.150  1.150  !  2.300e+009     1   2.300e+009 ed EO       
assign (residue 12 and name HN) (residue 11 and name HN)           2.850  1.150  1.150  !  7.160e+008     1   7.160e+008        
assign (residue 49 and name HN) (residue 51 and name HN)           3.350  1.650  2.150  !  6.420e+007     1   6.420e+007        
assign (residue 46 and name HN) (residue 45 and name HA2)          3.350  1.650  2.150  !  2.925e+005     1   2.925e+005        
assign (residue 43 and name HN) (residue 42 and name HN)           2.850  1.150  1.150  !  6.250e+008     1   6.250e+008        
assign (residue 85 and name HG2#) (residue 86 and name HN)         3.600  1.900  2.400  !  7.080e+008     3   2.360e+008        
assign (residue 101 and name HA) (residue 102 and name HN)         2.850  1.150  1.150  !  7.700e+008     1   7.700e+008        
assign (residue 49 and name HB) (residue 51 and name HN)           2.350  0.650  0.650  !  1.770e+009     1   1.770e+009        
assign (residue 10 and name HB1) (residue 11 and name HN)          2.850  1.150  1.150  !  5.370e+008     1   5.370e+008        
assign (residue 11 and name HG2#) (residue 11 and name HN)         3.100  1.400  1.400  !  1.800e+009     3   6.000e+008        
assign (residue 11 and name HA) (residue 12 and name HN)           2.850  1.150  1.150  !  6.370e+008     1   6.370e+008        
assign (residue 64 and name HN) (residue 67 and name HN)           3.350  1.650  2.150  !  1.560e+009     1   1.560e+009     ed EO   
assign (residue 85 and name HG2#) (residue 87 and name HN)         3.600  1.900  2.400  !  7.710e+008     3   2.570e+008        
assign (residue 66 and name HN) (residue 66 and name HG1)          3.350  1.650  2.150  !  3.771e+005     1   3.771e+005        
assign (residue 19 and name HG2#) (residue 25 and name HN)         3.100  1.400  1.400  !  1.620e+009     3   5.400e+008        
assign (residue 98 and name HD2#) (residue 98 and name HN)         3.600  1.900  2.400  !  8.800e+008     3   2.933e+008        
assign (residue 42 and name HA) (residue 42 and name HN)           2.850  1.150  1.150  !  5.490e+008     1   5.490e+008        
assign (residue 11 and name HG1#) (residue 11 and name HN)         3.100  1.400  1.400  !  1.660e+009     3   5.533e+008        
assign (residue 94 and name HN) (residue 93 and name HB#)          3.350  1.650  2.150  !  3.815e+005     2   1.907e+005        
assign (residue 69 and name HN) (residue 84 and name HA2)          3.350  1.650  2.150  !  2.874e+005     1   2.874e+005        
assign (residue 10 and name HN) (residue 9 and name HN)            2.850  1.150  1.150  !  5.210e+008     1   5.210e+008        
assign (residue 102 and name HG2#) (residue 101 and name HN)       3.100  1.400  1.900  !  1.180e+009     3   3.933e+008 ed EO       
assign (residue 3 and name HN) (residue 2 and name HA)             2.600  0.900  0.900  !  2.483e+006     1   2.483e+006        
assign (residue 97 and name HD2) (residue 97 and name HN)          3.350  1.650  2.150  !  8.450e+007     1   8.450e+007        
assign (residue 81 and name HA) (residue 82 and name HN)           2.350  0.650  0.650  !  4.250e+009     1   4.250e+009        
assign (residue 98 and name HA) (residue 100 and name HN)          3.350  1.650  2.150  !  1.420e+008     1   1.420e+008        
assign (residue 104 and name HA) (residue 103 and name HN)         3.350  1.650  2.150  !  3.000e+008     1   3.000e+008  ed EO      
assign (residue 63 and name HB) (residue 64 and name HN)           2.850  1.150  1.150  !  3.360e+008     1   3.360e+008        
assign (residue 37 and name HA2) (residue 37 and name HN)          2.350  0.650  0.650  !  1.280e+009     1   1.280e+009        
assign (residue 96 and name HB#) (residue 2 and name HN)           3.600  1.900  2.400  !  2.300e+008     3   7.667e+007        
assign (residue 19 and name HA) (residue 19 and name HN)           3.350  1.650  2.150  !  2.170e+008     1   2.170e+008        
assign (residue 11 and name HG2#) (residue 12 and name HN)         3.100  1.400  1.400  !  2.130e+009     3   7.100e+008        
assign (residue 72 and name HN) (residue 73 and name HN)           2.350  0.650  0.650  !  1.200e+009     1   1.200e+009        
assign (residue 69 and name HG#) (residue 69 and name HN)          2.850  1.150  1.150  !  1.580e+009     2   7.900e+008        
assign (residue 70 and name HN) (residue 71 and name HD1)          3.350  1.650  2.150  !  5.524e+005     1   5.524e+005        
assign (residue 95 and name HA) (residue 99 and name HN)           3.350  1.650  2.150  !  2.950e+008     1   2.950e+008        
!assign (residue 39 and name HD#) (residue 42 and name HE22)        3.350  1.650  2.150  !  1.010e+008     2   5.050e+007        
assign (residue 17 and name HA) (residue 29 and name HN)           3.350  1.650  2.150  !  1.900e+008     1   1.900e+008        
assign (residue 98 and name HB#) (residue 99 and name HN)          3.350  1.650  2.150  !  4.790e+008     2   2.395e+008        
assign (residue 62 and name HG#) (residue 62 and name HN)          2.350  0.650  0.650  !  2.040e+009     2   1.020e+009        
assign (residue 67 and name HB2) (residue 64 and name HN)          3.350  1.650  2.150  !  4.470e+007     1   4.470e+007        
assign (residue 48 and name HA) (residue 49 and name HN)           2.350  0.650  0.650  !  1.150e+009     1   1.150e+009        
assign (residue 54 and name HN) (residue 54 and name HD21)         3.350  1.650  2.150  !  1.720e+008     1   1.720e+008        
assign (residue 70 and name HB2) (residue 73 and name HN)          3.350  1.650  1.650  !  3.550e+008     1   3.550e+008 ed EO       
assign (residue 22 and name HB#) (residue 23 and name HN)          3.350  1.650  2.150  !  9.480e+007     2   4.740e+007        
assign (residue 66 and name HA) (residue 67 and name HN)           2.850  1.150  1.150  !  2.820e+009     1   2.820e+009 ed EO       
assign (residue 53 and name HN) (residue 54 and name HN)           2.350  0.650  0.650  !  1.830e+009     1   1.830e+009        
assign (residue 45 and name HA1) (residue 46 and name HN)          2.850  1.150  1.150  !  9.660e+008     1   9.660e+008        
assign (residue 49 and name HN) (residue 79 and name HN)           3.350  1.650  2.150  !  4.410e+008     1   4.410e+008  ed EO      
assign (residue 59 and name HN) (residue 60 and name HN)           3.350  1.650  2.150  !  2.330e+008     1   2.330e+008        
assign (residue 103 and name HB2) (residue 103 and name HN)        2.850  1.150  1.150  !  9.910e+008     1   9.910e+008        
assign (residue 12 and name HN) (residue 13 and name HB#)          3.350  1.650  2.150  !  2.162e+005     2   1.081e+005        
assign (residue 22 and name HD#) (residue 23 and name HN)          3.350  1.650  2.150  !  1.800e+008     2   9.000e+007        
assign (residue 102 and name HN) (residue 100 and name HN)         2.850  1.150  1.150  !  3.470e+008     1   3.470e+008        
assign (residue 64 and name HN) (residue 63 and name HN)           2.350  0.650  0.650  !  1.260e+009     1   1.260e+009        
assign (residue 40 and name HG2#) (residue 41 and name HN)         3.600  1.900  2.400  !  3.730e+008     3   1.243e+008        
assign (residue 17 and name HB2) (residue 17 and name HN)          2.850  1.150  1.150  !  1.040e+009     1   1.040e+009 ed EO       
assign (residue 22 and name HB#) (residue 104 and name HN)         3.350  1.650  2.150  !  3.430e+008     2   1.715e+008        
assign (residue 63 and name HN) (residue 61 and name HN)           3.350  1.650  2.150  !  8.270e+007     1   8.270e+007        
assign (residue 93 and name HN) (residue 92 and name HB#)          3.350  1.650  2.150  !  6.248e+005     2   3.124e+005        
assign (residue 59 and name HE1) (residue 42 and name HN)          3.350  1.650  2.150  !  8.730e+007     1   8.730e+007        
assign (residue 48 and name HB2) (residue 49 and name HN)          2.850  1.150  1.150  !  7.290e+008     1   7.290e+008        
assign (residue 21 and name HN) (residue 20 and name HN)           2.850  1.150  1.150  !  8.160e+008     1   8.160e+008        
assign (residue 78 and name HG2#) (residue 79 and name HN)         3.600  1.900  2.400  !  6.750e+007     3   2.250e+007        
assign (residue 50 and name HA) (residue 50 and name HN)           2.350  0.650  0.650  !  2.660e+009     1   2.660e+009        
assign (residue 56 and name HA1) (residue 56 and name HN)          2.350  0.650  0.650  !  2.890e+009     1   2.890e+009        
assign (residue 85 and name HD1#) (residue 85 and name HN)         3.600  1.900  2.400  !  9.490e+007     3   3.163e+007        
assign (residue 9 and name HD1#) (residue 6 and name HN)           3.600  1.900  2.400  !  1.820e+008     3   6.067e+007        
assign (residue 12 and name HA) (residue 12 and name HE22)         3.350  1.650  2.150  !  4.490e+008     1   4.490e+008        
assign (residue 5 and name HA) (residue 8 and name HN)             2.350  0.650  0.650  !  1.610e+009     1   1.610e+009        
assign (residue 36 and name HE1) (residue 61 and name HN)          3.350  1.650  2.150  !  3.670e+007     1   3.670e+007        
assign (residue 6 and name HA2) (residue 6 and name HN)            2.850  1.150  1.150  !  4.490e+008     1   4.490e+008        
assign (residue 51 and name HA) (residue 54 and name HN)           2.850  1.150  1.150  !  8.790e+008     1   8.790e+008        
assign (residue 30 and name HB1) (residue 31 and name HN)          3.350  1.650  2.150  !  2.920e+008     1   2.920e+008        
assign (residue 21 and name HB#) (residue 22 and name HN)          2.850  1.150  1.150  !  1.030e+009     2   5.150e+008        
assign (residue 4 and name HN) (residue 3 and name HA)             3.350  1.650  2.150  !  5.535e+005     1   5.535e+005        
assign (residue 66 and name HB1) (residue 67 and name HN)          2.850  1.150  1.150  !  2.900e+009     1   2.900e+009 ed EO       
assign (residue 37 and name HA1) (residue 37 and name HN)          2.350  0.650  0.650  !  1.060e+009     1   1.060e+009        
assign (residue 48 and name HN) (residue 49 and name HN)           3.350  1.650  2.150  !  1.960e+008     1   1.960e+008        
assign (residue 51 and name HN) (residue 51 and name HB#)          2.850  1.150  1.150  !  2.422e+006     3   8.072e+005        
assign (residue 94 and name HB2) (residue 94 and name HN)          2.350  0.650  0.650  !  2.180e+009     1   2.180e+009        
assign (residue 15 and name HA) (residue 16 and name HN)           3.350  1.650  2.150  !  1.970e+008     1   1.970e+008
assign (residue 42 and name HG#) (residue 42 and name HN)          3.350  1.650  2.150  !  6.240e+008     2   3.120e+008 ed EO
assign (residue 78 and name HG2#) (residue 75 and name HN)         3.600  1.900  2.400  !  5.660e+008     3   1.887e+008
assign (residue 39 and name HN) (residue 39 and name HB#)          2.600  0.900  0.900  !  1.426e+006     2   7.131e+005
assign (residue 68 and name HG) (residue 69 and name HN)           3.350  1.650  2.150  !  8.220e+007     1   8.220e+007
assign (residue 24 and name HA2) (residue 25 and name HN)          2.850  1.150  1.150  !  9.470e+008     1   9.470e+008
assign (residue 40 and name HA) (residue 59 and name HE1)          2.850  1.150  1.150  !  1.420e+009     1   1.420e+009 ed EO
assign (residue 69 and name HB#) (residue 69 and name HN)          2.850  1.150  1.150  !  1.150e+009     2   5.750e+008
assign (residue 62 and name HN) (residue 61 and name HN)           3.350  1.650  2.150  !  2.130e+008     1   2.130e+008
assign (residue 36 and name HN) (residue 34 and name HA1)          3.350  1.650  2.150  !  2.838e+005     1   2.838e+005
assign (residue 58 and name HN) (residue 57 and name HG12)         3.350  1.650  2.150  !  3.010e+005     1   3.010e+005
assign (residue 52 and name HB#) (residue 52 and name HN)          2.350  0.650  0.650  !  2.270e+009     2   1.135e+009
assign (residue 68 and name HB#) (residue 68 and name HN)          3.350  1.650  2.150  !  4.360e+008     2   2.180e+008
assign (residue 98 and name HG) (residue 98 and name HN)           2.850  1.150  1.150  !  8.280e+008     1   8.280e+008
assign (residue 104 and name HA) (residue 22 and name HN)          3.350  1.650  2.150  !  1.440e+008     1   1.440e+008
assign (residue 2 and name HN) (residue 2 and name HA)             3.350  1.650  2.150  !  5.186e+005     1   5.186e+005
assign (residue 35 and name HD2#) (residue 35 and name HN)         3.600  1.900  2.400  !  3.200e+008     3   1.067e+008
assign (residue 36 and name HB1) (residue 36 and name HN)          2.850  1.150  1.150  !  1.090e+009     1   1.090e+009 ed EO
assign (residue 15 and name HB#) (residue 16 and name HN)          3.600  1.900  2.400  !  3.750e+008     3   1.250e+008
assign (residue 94 and name HN) (residue 95 and name HN)           2.850  1.150  1.150  !  8.650e+008     1   8.650e+008
assign (residue 53 and name HA) (residue 53 and name HN)           2.850  1.150  1.150  !  7.030e+008     1   7.030e+008
assign (residue 97 and name HB1) (residue 97 and name HN)          2.850  1.150  1.150  !  7.990e+008     1   7.990e+008
assign (residue 13 and name HB#) (residue 13 and name HN)          2.850  1.150  1.150  !  1.720e+009     2   8.600e+008
assign (residue 41 and name HN) (residue 40 and name HN)           3.350  1.650  2.150  !  2.700e+008     1   2.700e+008
assign (residue 15 and name HB#) (residue 15 and name HN)          3.100  1.400  1.400  !  1.550e+009     3   5.167e+008
assign (residue 48 and name HB1) (residue 48 and name HN)          2.850  1.150  1.150  !  7.250e+008     1   7.250e+008
assign (residue 3 and name HA) (residue 6 and name HN)             2.850  1.150  1.150  !  6.320e+008     1   6.320e+008
assign (residue 64 and name HN) (residue 66 and name HN)           3.350  1.650  2.150  !  1.700e+008     1   1.700e+008
assign (residue 54 and name HN) (residue 55 and name HN)           2.850  1.150  1.150  !  9.420e+008     1   9.420e+008
assign (residue 99 and name HG#) (residue 100 and name HN)         3.350  1.650  2.150  !  1.300e+009     2   6.500e+008 ed EO
assign (residue 94 and name HD1#) (residue 94 and name HN)         3.350  1.650  2.150  !  2.220e+009     3   7.400e+008 ed EO
assign (residue 65 and name HN) (residue 65 and name HG2)          2.600  0.900  0.900  !  9.768e+005     1   9.768e+005
assign (residue 40 and name HA) (residue 41 and name HN)           2.850  1.150  1.150  !  9.900e+008     1   9.900e+008
!assign (residue 95 and name HG2#) (residue 62 and name HN)         3.600  1.900  2.400  !  6.500e+007     3   2.167e+007
assign (residue 55 and name HD#) (residue 55 and name HN)          3.350  1.650  2.150  !  1.270e+009     2   6.350e+008 ed EO
!assign (residue 57 and name HD1#) (residue 40 and name HN)         3.600  1.900  2.400  !  4.550e+007     3   1.517e+007
assign (residue 58 and name HG2#) (residue 59 and name HN)         3.600  1.900  2.400  !  8.850e+008     3   2.950e+008
assign (residue 75 and name HG2#) (residue 52 and name HN)         3.600  1.900  2.400  !  4.690e+008     3   1.563e+008
assign (residue 100 and name HB#) (residue 101 and name HN)        2.850  1.150  1.150  !  1.820e+009     2   9.100e+008
assign (residue 99 and name HB#) (residue 99 and name HN)          2.850  1.150  1.150  !  1.470e+009     2   7.350e+008
assign (residue 53 and name HB#) (residue 54 and name HN)          2.850  1.150  1.150  !  1.350e+009     2   6.750e+008
assign (residue 57 and name HA) (residue 58 and name HN)           2.350  0.650  0.650  !  2.230e+009     1   2.230e+009
assign (residue 90 and name HG#) (residue 87 and name HN)          2.850  1.150  1.150  !  7.310e+008     2   3.655e+008
assign (residue 33 and name HN) (residue 34 and name HN)           3.350  1.650  2.150  !  8.900e+007     1   8.900e+007
assign (residue 25 and name HN) (residue 25 and name HA)           2.600  0.900  0.900  !  8.735e+005     1   8.735e+005
assign (residue 52 and name HA) (residue 53 and name HN)           3.350  1.650  2.150  !  2.750e+008     1   2.750e+008
assign (residue 78 and name HN) (residue 52 and name HN)           3.350  1.650  2.150  !  8.820e+007     1   8.820e+007
assign (residue 54 and name HD22) (residue 54 and name HD21)       2.350  0.650  0.650  !  2.820e+009     1   2.820e+009
assign (residue 56 and name HN) (residue 57 and name HN)           2.850  1.150  1.150  !  6.660e+008     1   6.660e+008
assign (residue 103 and name HB2) (residue 104 and name HN)        2.850  1.150  1.150  !  5.200e+008     1   5.200e+008
assign (residue 100 and name HN) (residue 101 and name HB#)        3.600  1.900  2.400  !  3.772e+005     3   1.257e+005
assign (residue 89 and name HN) (residue 90 and name HB#)          3.350  1.650  2.150  !  4.764e+005     2   2.382e+005
assign (residue 12 and name HN) (residue 14 and name HN)           2.850  1.150  1.150  !  4.120e+008     1   4.120e+008
assign (residue 94 and name HD1#) (residue 14 and name HN)         3.600  1.900  2.400  !  6.420e+007     3   2.140e+007
assign (residue 23 and name HN) (residue 23 and name HA2)          3.350  1.650  2.150  !  3.639e+005     1   3.639e+005
assign (residue 63 and name HA) (residue 66 and name HN)           2.850  1.150  1.150  !  5.380e+008     1   5.380e+008
assign (residue 7 and name HA) (residue 8 and name HN)             2.850  1.150  1.150  !  9.900e+008     1   9.900e+008
assign (residue 57 and name HG2#) (residue 56 and name HN)         3.600  1.900  2.400  !  3.190e+008     3   1.063e+008
assign (residue 54 and name HB1) (residue 54 and name HN)          2.350  0.650  0.650  !  1.140e+009     1   1.140e+009
assign (residue 99 and name HE#) (residue 100 and name HN)         3.350  1.650  2.150  !  7.090e+008     2   3.545e+008 ed EO
assign (residue 103 and name HN) (residue 100 and name HN)         3.350  1.650  2.150  !  5.130e+008     1   5.130e+008 ed EO
assign (residue 67 and name HB1) (residue 64 and name HN)          3.350  1.650  2.150  !  2.220e+008     1   2.220e+008
assign (residue 37 and name HA1) (residue 38 and name HN)          2.350  0.650  0.650  !  1.320e+009     1   1.320e+009
assign (residue 12 and name HB#) (residue 12 and name HN)          2.850  1.150  1.150  !  2.610e+009     2   1.305e+009 ed EO
assign (residue 78 and name HG2#) (residue 78 and name HN)         3.100  1.400  1.400  !  2.200e+009     3   7.333e+008
assign (residue 9 and name HG2#) (residue 10 and name HN)          3.600  1.900  2.400  !  4.900e+008     3   1.633e+008
assign (residue 104 and name HN) (residue 103 and name HA)         2.600  0.900  0.900  !  7.564e+005     1   7.564e+005
assign (residue 21 and name HG#) (residue 24 and name HN)          2.850  1.150  1.150  !  6.080e+008     2   3.040e+008
assign (residue 95 and name HG2#) (residue 99 and name HN)         3.600  1.900  2.400  !  8.900e+008     3   2.967e+008
assign (residue 95 and name HB) (residue 97 and name HN)           3.350  1.650  2.150  !  5.550e+008     1   5.550e+008 ed EO
assign (residue 15 and name HB#) (residue 14 and name HN)          3.600  1.900  2.400  !  7.420e+008     3   2.473e+008
assign (residue 8 and name HB#) (residue 8 and name HN)            2.350  0.650  0.650  !  3.520e+009     2   1.760e+009
assign (residue 15 and name HN) (residue 16 and name HN)           2.850  1.150  1.150  !  3.480e+008     1   3.480e+008
assign (residue 7 and name HD#) (residue 8 and name HN)            3.350  1.650  2.150  !  3.440e+008     2   1.720e+008
assign (residue 3 and name HN) (residue 2 and name HN)             2.850  1.150  1.150  !  4.690e+008     1   4.690e+008
assign (residue 48 and name HN) (residue 46 and name HA)           3.350  1.650  2.150  !  3.097e+005     1   3.097e+005
assign (residue 62 and name HA) (residue 63 and name HN)           2.850  1.150  1.150  !  4.680e+008     1   4.680e+008
assign (residue 62 and name HN) (residue 62 and name HB#)          2.600  0.900  0.900  !  2.703e+006     2   1.351e+006
assign (residue 38 and name HA) (residue 38 and name HN)           2.350  0.650  0.650  !  1.080e+009     1   1.080e+009
assign (residue 41 and name HA2) (residue 41 and name HN)          2.850  1.150  1.150  !  4.520e+008     1   4.520e+008
assign (residue 67 and name HB2) (residue 68 and name HN)          3.350  1.650  2.150  !  2.560e+008     1   2.560e+008
assign (residue 70 and name HD22) (residue 70 and name HD21)       2.850  1.150  1.150  !  5.090e+008     1   5.090e+008
assign (residue 60 and name HE#) (residue 62 and name HN)          3.350  1.650  2.150  !  2.960e+008     2   1.480e+008
assign (residue 21 and name HG#) (residue 22 and name HN)          3.350  1.650  2.150  !  4.800e+008     2   2.400e+008
assign (residue 73 and name HN) (residue 72 and name HG#)          3.350  1.650  2.150  !  4.152e+005     2   2.076e+005
assign (residue 57 and name HD1#) (residue 57 and name HN)         3.600  1.900  2.400  !  4.910e+008     3   1.637e+008
!assign (residue 59 and name HE1) (residue 43 and name HN)          3.350  1.650  2.150  !  9.550e+008     1   9.550e+008 ed EO
assign (residue 1 and name HA2) (residue 2 and name HN)            2.850  1.150  1.150  !  4.750e+008     1   4.750e+008
assign (residue 53 and name HN) (residue 51 and name HB#)          3.600  1.900  2.400  !  3.635e+005     3   1.212e+005
assign (residue 56 and name HN) (residue 55 and name HA)           3.350  1.650  2.150  !  2.936e+005     1   2.936e+005
assign (residue 3 and name HA) (residue 3 and name HN)             2.850  1.150  1.150  !  6.340e+008     1   6.340e+008
assign (residue 5 and name HN) (residue 3 and name HN)             3.350  1.650  2.150  !  6.830e+008     1   6.830e+008 ed EO
assign (residue 55 and name HB#) (residue 57 and name HN)          3.350  1.650  2.150  !  5.540e+008     2   2.770e+008
assign (residue 8 and name HD#) (residue 8 and name HN)            3.350  1.650  2.150  !  2.110e+009     2   1.055e+009 ed EO
assign (residue 92 and name HA) (residue 93 and name HN)           3.350  1.650  2.150  !  1.720e+008     1   1.720e+008
assign (residue 12 and name HG2) (residue 12 and name HE22)        3.350  1.650  2.150  !  2.120e+008     1   2.120e+008
assign (residue 19 and name HB) (residue 25 and name HN)           3.350  1.650  2.150  !  1.120e+008     1   1.120e+008
assign (residue 20 and name HN) (residue 20 and name HA)           3.350  1.650  2.150  !  3.465e+005     1   3.465e+005
assign (residue 6 and name HA2) (residue 94 and name HN)           2.850  1.150  1.150  !  3.670e+008     1   3.670e+008
assign (residue 72 and name HE#) (residue 80 and name HN)          3.350  1.650  2.150  !  2.890e+008     2   1.445e+008
assign (residue 75 and name HN) (residue 76 and name HD#)          3.350  1.650  2.150  !  3.738e+005     2   1.869e+005
assign (residue 36 and name HB2) (residue 36 and name HN)          2.350  0.650  0.650  !  1.320e+009     1   1.320e+009
assign (residue 6 and name HA1) (residue 6 and name HN)            2.350  0.650  0.650  !  1.530e+009     1   1.530e+009
assign (residue 8 and name HN) (residue 8 and name HG#)            3.350  1.650  2.150  !  5.252e+005     2   2.626e+005
assign (residue 99 and name HD#) (residue 99 and name HN)          3.350  1.650  2.150  !  3.550e+008     2   1.775e+008
assign (residue 97 and name HB2) (residue 97 and name HN)          2.350  0.650  0.650  !  1.180e+009     1   1.180e+009
assign (residue 78 and name HA) (residue 52 and name HN)           3.350  1.650  2.150  !  1.130e+008     1   1.130e+008
assign (residue 13 and name HN) (residue 15 and name HB#)          3.600  1.900  2.400  !  2.108e+005     3   7.027e+004
assign (residue 59 and name HA) (residue 59 and name HN)           2.850  1.150  1.150  !  5.210e+008     1   5.210e+008
assign (residue 59 and name HB1) (residue 59 and name HE1)         3.350  1.650  2.150  !  2.180e+008     1   2.180e+008
assign (residue 92 and name HA) (residue 95 and name HN)           3.350  1.650  2.150  !  2.260e+008     1   2.260e+008
assign (residue 4 and name HN) (residue 4 and name HG#)            2.600  0.900  0.900  !  1.701e+006     2   8.507e+005
assign (residue 32 and name HN) (residue 33 and name HN)           2.350  0.650  0.650  !  4.860e+009     1   4.860e+009
assign (residue 62 and name HA) (residue 62 and name HN)           2.350  0.650  0.650  !  1.080e+009     1   1.080e+009
assign (residue 16 and name HE22) (residue 16 and name HE21)       2.350  0.650  0.650  !  6.570e+009     1   6.570e+009
assign (residue 9 and name HN) (residue 9 and name HB)             2.600  0.900  0.900  !  7.984e+005     1   7.984e+005
assign (residue 42 and name HA) (residue 43 and name HN)           2.850  1.150  1.150  !  1.800e+009     1   1.800e+009 ed EO
assign (residue 65 and name HA) (residue 66 and name HN)           2.850  1.150  1.150  !  4.460e+008     1   4.460e+008
assign (residue 50 and name HA) (residue 53 and name HN)           2.850  1.150  1.150  !  5.900e+008     1   5.900e+008
assign (residue 34 and name HN) (residue 102 and name HA)          3.350  1.650  2.150  !  4.785e+005     1   4.785e+005
assign (residue 100 and name HA) (residue 100 and name HN)         2.350  0.650  0.650  !  1.460e+009     1   1.460e+009
assign (residue 103 and name HB1) (residue 103 and name HN)        2.850  1.150  1.150  !  1.550e+009     1   1.550e+009 ed EO
assign (residue 72 and name HD#) (residue 72 and name HN)          3.350  1.650  2.150  !  7.110e+008     2   3.555e+008 ed EO
assign (residue 75 and name HD1#) (residue 75 and name HN)         3.100  1.400  1.400  !  1.060e+009     3   3.533e+008
assign (residue 4 and name HN) (residue 4 and name HB#)            2.600  0.900  0.900  !  2.730e+006     2   1.365e+006
assign (residue 103 and name HN) (residue 103 and name HD22)       3.350  1.650  2.150  !  8.610e+007     1   8.610e+007
assign (residue 40 and name HA) (residue 42 and name HN)           3.350  1.650  2.150  !  1.220e+008     1   1.220e+008
assign (residue 14 and name HA) (residue 14 and name HN)           2.850  1.150  1.150  !  5.270e+008     1   5.270e+008
assign (residue 68 and name HN) (residue 69 and name HB#)          3.350  1.650  2.150  !  2.834e+005     2   1.417e+005
assign (residue 36 and name HA) (residue 38 and name HN)           2.850  1.150  1.150  !  1.400e+009     1   1.400e+009 ed EO
assign (residue 95 and name HA) (residue 98 and name HN)           3.350  1.650  2.150  !  1.620e+008     1   1.620e+008
assign (residue 70 and name HB#) (residue 70 and name HD22)        3.350  1.650  2.150  !  4.260e+007     2   2.130e+007
assign (residue 61 and name HA) (residue 64 and name HN)           3.350  1.650  2.150  !  1.130e+008     1   1.130e+008
assign (residue 53 and name HN) (residue 55 and name HN)           2.850  1.150  1.150  !  3.280e+008     1   3.280e+008
assign (residue 42 and name HE22) (residue 42 and name HE21)       2.350  0.650  0.650  !  6.870e+009     1   6.870e+009
assign (residue 58 and name HG2#) (residue 37 and name HN)         3.600  1.900  2.400  !  3.590e+008     3   1.197e+008
assign (residue 40 and name HN) (residue 39 and name HG#)          3.350  1.650  2.150  !  4.592e+005     2   2.296e+005
assign (residue 59 and name HB2) (residue 59 and name HN)          2.350  0.650  0.650  !  1.240e+009     1   1.240e+009
assign (residue 96 and name HA) (residue 99 and name HN)           2.850  1.150  1.150  !  3.380e+008     1   3.380e+008
assign (residue 95 and name HG2#) (residue 65 and name HN)         3.600  1.900  2.400  !  1.880e+008     3   6.267e+007
assign (residue 11 and name HB) (residue 12 and name HN)           2.850  1.150  1.150  !  1.730e+009     1   1.730e+009 ed EO
assign (residue 54 and name HD21) (residue 55 and name HN)         2.850  1.150  1.150  !  4.630e+008     1   4.630e+008
assign (residue 39 and name HN) (residue 39 and name HG#)          3.350  1.650  1.650  !  1.440e+006     2   7.199e+005 ed EO
assign (residue 2 and name HB1) (residue 2 and name HN)            2.850  1.150  1.150  !  5.580e+008     1   5.580e+008
assign (residue 79 and name HN) (residue 80 and name HN)           3.350  1.650  2.150  !  8.160e+007     1   8.160e+007
assign (residue 81 and name HB) (residue 81 and name HN)           2.850  1.150  1.150  !  4.090e+008     1   4.090e+008
assign (residue 34 and name HA1) (residue 34 and name HN)          2.350  0.650  0.650  !  2.610e+009     1   2.610e+009
assign (residue 31 and name HB2) (residue 31 and name HN)          2.850  1.150  1.150  !  1.000e+009     1   1.000e+009 ed EO
assign (residue 8 and name HA) (residue 10 and name HN)            2.850  1.150  1.150  !  4.950e+008     1   4.950e+008
assign (residue 54 and name HB2) (residue 54 and name HD21)        3.350  1.650  2.150  !  2.690e+008     1   2.690e+008
assign (residue 80 and name HA) (residue 81 and name HN)           2.850  1.150  1.150  !  3.890e+008     1   3.890e+008
assign (residue 89 and name HG2#) (residue 93 and name HN)         3.600  1.900  2.400  !  2.120e+008     3   7.067e+007
assign (residue 63 and name HA) (residue 63 and name HN)           2.350  0.650  0.650  !  1.210e+009     1   1.210e+009
assign (residue 22 and name HG#) (residue 23 and name HN)          3.350  1.650  2.150  !  1.340e+008     2   6.700e+007
assign (residue 74 and name HN) (residue 74 and name HA)           2.600  0.900  0.900  !  6.064e+005     1   6.064e+005
assign (residue 85 and name HA) (residue 86 and name HN)           2.850  1.150  1.150  !  8.020e+008     1   8.020e+008
assign (residue 97 and name HA) (residue 97 and name HN)           2.350  0.650  0.650  !  1.490e+009     1   1.490e+009
assign (residue 67 and name HA) (residue 69 and name HN)           2.850  1.150  1.150  !  4.400e+008     1   4.400e+008
assign (residue 22 and name HA) (residue 23 and name HN)           2.850  1.150  1.150  !  7.700e+008     1   7.700e+008
assign (residue 16 and name HB1) (residue 18 and name HN)          3.350  1.650  2.150  !  5.320e+007     1   5.320e+007
assign (residue 20 and name HN) (residue 20 and name HG2#)         3.600  1.900  2.400  !  1.184e+006     3   3.947e+005
assign (residue 49 and name HG2#) (residue 49 and name HN)         3.100  1.400  1.400  !  1.010e+009     3   3.367e+008
assign (residue 100 and name HN) (residue 98 and name HN)          3.350  1.650  2.150  !  1.350e+008     1   1.350e+008
assign (residue 89 and name HG2#) (residue 89 and name HN)         3.100  1.400  1.400  !  9.760e+008     3   3.253e+008
assign (residue 75 and name HD1#) (residue 40 and name HN)         3.600  1.900  2.400  !  1.150e+008     3   3.833e+007
assign (residue 6 and name HN) (residue 8 and name HN)             3.350  1.650  2.150  !  1.910e+008     1   1.910e+008
assign (residue 10 and name HB2) (residue 10 and name HN)          2.350  0.650  0.650  !  1.120e+009     1   1.120e+009
assign (residue 101 and name HA) (residue 104 and name HN)         3.350  1.650  2.150  !  2.050e+008     1   2.050e+008
assign (residue 52 and name HN) (residue 49 and name HN)           3.350  1.650  2.150  !  2.310e+008     1   2.310e+008
assign (residue 103 and name HB1) (residue 103 and name HD22)      2.850  1.150  1.150  !  3.750e+008     1   3.750e+008
assign (residue 24 and name HA1) (residue 25 and name HN)          2.350  0.650  0.650  !  1.750e+009     1   1.750e+009
assign (residue 63 and name HN) (residue 62 and name HG#)          3.350  1.650  2.150  !  3.309e+005     2   1.654e+005
assign (residue 91 and name HA) (residue 94 and name HN)           3.350  1.650  2.150  !  8.420e+007     1   8.420e+007
assign (residue 11 and name HA) (residue 15 and name HN)           2.850  1.150  1.150  !  3.910e+008     1   3.910e+008
assign (residue 64 and name HB#) (residue 68 and name HN)          3.350  1.650  2.150  !  1.190e+008     2   5.950e+007
assign (residue 16 and name HG#) (residue 16 and name HE22)        3.350  1.650  2.150  !  5.770e+008     2   2.885e+008
assign (residue 85 and name HD1#) (residue 86 and name HN)         3.600  1.900  2.400  !  3.080e+007     3   1.027e+007
assign (residue 60 and name HB#) (residue 61 and name HN)          2.850  1.150  1.150  !  7.100e+008     2   3.550e+008
assign (residue 58 and name HA) (residue 59 and name HN)           2.350  0.650  0.650  !  1.500e+009     1   1.500e+009
assign (residue 51 and name HA) (residue 52 and name HN)           2.850  1.150  1.150  !  4.130e+008     1   4.130e+008
assign (residue 9 and name HD1#) (residue 9 and name HN)           3.600  1.900  2.400  !  6.270e+008     3   2.090e+008
assign (residue 93 and name HN) (residue 92 and name HG#)          3.350  1.650  2.150  !  2.604e+005     2   1.302e+005
assign (residue 32 and name HD1#) (residue 32 and name HN)         3.600  1.900  2.400  !  1.200e+008     3   4.000e+007
assign (residue 25 and name HB#) (residue 26 and name HN)          2.850  1.150  1.150  !  1.480e+009     2   7.400e+008
assign (residue 68 and name HN) (residue 67 and name HB1)          3.350  1.650  2.150  !  3.151e+005     1   3.151e+005
assign (residue 99 and name HA) (residue 99 and name HN)           2.850  1.150  1.150  !  6.450e+008     1   6.450e+008
assign (residue 12 and name HA) (residue 13 and name HN)           3.350  1.650  2.150  !  2.700e+008     1   2.700e+008
assign (residue 57 and name HN) (residue 56 and name HA#)          3.350  1.650  2.150  !  5.435e+005     2   2.717e+005
assign (residue 102 and name HN) (residue 103 and name HN)         2.350  0.650  0.650  !  1.770e+009     1   1.770e+009
assign (residue 91 and name HA) (residue 93 and name HN)           3.350  1.650  2.150  !  3.660e+008     1   3.660e+008 ed EO
assign (residue 24 and name HA1) (residue 24 and name HN)          2.350  0.650  0.650  !  1.500e+009     1   1.500e+009
assign (residue 64 and name HD2#) (residue 64 and name HN)         3.600  1.900  2.400  !  5.220e+008     3   1.740e+008
assign (residue 98 and name HA) (residue 98 and name HN)           2.850  1.150  1.150  !  8.370e+008     1   8.370e+008
assign (residue 35 and name HN) (residue 36 and name HN)           2.350  0.650  0.650  !  2.020e+009     1   2.020e+009
assign (residue 98 and name HA) (residue 102 and name HN)          3.350  1.650  2.150  !  2.990e+008     1   2.990e+008
assign (residue 38 and name HD#) (residue 42 and name HN)          3.350  1.650  2.150  !  2.780e+008     2   1.390e+008
assign (residue 37 and name HN) (residue 36 and name HN)           3.350  1.650  2.150  !  2.090e+008     1   2.090e+008
assign (residue 70 and name HN) (residue 72 and name HN)           3.350  1.650  2.150  !  4.190e+007     1   4.190e+007
assign (residue 95 and name HD1#) (residue 66 and name HN)         3.600  1.900  2.400  !  1.660e+008     3   5.533e+007
assign (residue 32 and name HG) (residue 32 and name HN)           2.850  1.150  1.150  !  6.580e+008     1   6.580e+008
assign (residue 34 and name HA2) (residue 34 and name HN)          2.350  0.650  0.650  !  1.170e+009     1   1.170e+009
assign (residue 40 and name HB) (residue 40 and name HN)           2.850  1.150  1.150  !  5.590e+008     1   5.590e+008
assign (residue 73 and name HA) (residue 70 and name HD22)         3.350  1.650  2.150  !  2.390e+008     1   2.390e+008
assign (residue 59 and name HN) (residue 58 and name HN)           3.350  1.650  2.150  !  3.340e+008     1   3.340e+008 ed EO
assign (residue 81 and name HD1#) (residue 81 and name HN)         3.600  1.900  2.400  !  2.410e+008     3   8.033e+007
assign (residue 15 and name HA) (residue 15 and name HN)           2.850  1.150  1.150  !  3.610e+008     1   3.610e+008
assign (residue 103 and name HN) (residue 101 and name HN)         2.850  1.150  1.150  !  3.250e+008     1   3.250e+008
!assign (residue 56 and name HN) (residue 39 and name HG#)          3.350  1.650  2.150  !  2.915e+005     2   1.458e+005
assign (residue 78 and name HA) (residue 79 and name HN)           3.350  1.650  2.150  !  2.740e+008     1   2.740e+008
assign (residue 9 and name HA) (residue 12 and name HN)            2.850  1.150  1.150  !  3.730e+008     1   3.730e+008
assign (residue 63 and name HA) (residue 64 and name HN)           2.850  1.150  1.150  !  4.880e+008     1   4.880e+008
assign (residue 92 and name HA) (residue 94 and name HN)           3.350  1.650  2.150  !  2.970e+008     1   2.970e+008
assign (residue 5 and name HN) (residue 5 and name HA)             2.600  0.900  0.900  !  1.263e+006     1   1.263e+006
assign (residue 91 and name HD#) (residue 91 and name HN)          3.350  1.650  2.150  !  2.280e+008     2   1.140e+008
assign (residue 54 and name HB2) (residue 54 and name HN)          2.850  1.150  1.150  !  2.380e+009     1   2.380e+009 ed EO
assign (residue 93 and name HN) (residue 94 and name HN)           2.350  0.650  0.650  !  6.090e+009     1   6.090e+009
assign (residue 85 and name HN) (residue 70 and name HN)           2.850  1.150  1.150  !  5.220e+008     1   5.220e+008
assign (residue 97 and name HD1) (residue 7 and name HN)           3.350  1.650  2.150  !  9.440e+007     1   9.440e+007
assign (residue 64 and name HD2#) (residue 65 and name HN)         3.600  1.900  2.400  !  3.100e+008     3   1.033e+008
assign (residue 3 and name HG2#) (residue 7 and name HN)           3.600  1.900  1.600  !  9.560e+008     3   3.187e+008 ed EO
assign (residue 78 and name HA) (residue 49 and name HN)           3.350  1.650  2.150  !  2.610e+008     1   2.610e+008
assign (residue 35 and name HN) (residue 32 and name HA)           3.350  1.650  2.150  !  1.836e+005     1   1.836e+005
assign (residue 20 and name HN) (residue 19 and name HG2#)         3.600  1.900  2.400  !  3.914e+005     3   1.305e+005
assign (residue 8 and name HN) (residue 7 and name HN)             2.850  1.150  1.150  !  8.480e+008     1   8.480e+008
assign (residue 25 and name HN) (residue 25 and name HD#)          3.350  1.650  2.150  !  2.244e+005     2   1.122e+005
assign (residue 67 and name HN) (residue 64 and name HA)           2.600  0.900  0.900  !  6.079e+005     1   6.079e+005
assign (residue 26 and name HN) (residue 26 and name HB2)          3.350  1.650  2.150  !  2.555e+005     1   2.555e+005
assign (residue 55 and name HB#) (residue 56 and name HN)          3.350  1.650  2.150  !  6.140e+008     2   3.070e+008 ed EO
assign (residue 96 and name HB#) (residue 95 and name HN)          3.350  1.650  2.150  !  1.450e+009     3   4.833e+008
assign (residue 10 and name HA) (residue 14 and name HN)           2.850  1.150  1.150  !  7.670e+008     1   7.670e+008
assign (residue 39 and name HN) (residue 38 and name HA)           2.600  0.900  0.900  !  2.165e+006     1   2.165e+006
assign (residue 104 and name HG#) (residue 104 and name HN)        2.850  1.150  1.150  !  1.410e+009     2   7.050e+008
!assign (residue 90 and name HN) (residue 94 and name HN)           3.350  1.650  2.150  !  6.140e+008     1   6.140e+008 ed EO
assign (residue 97 and name HB1) (residue 6 and name HN)           3.350  1.650  2.150  !  4.600e+008     1   4.600e+008 ed EO
assign (residue 93 and name HB#) (residue 6 and name HN)           2.850  1.150  1.150  !  8.160e+008     2   4.080e+008
assign (residue 3 and name HB) (residue 3 and name HN)             2.350  0.650  0.650  !  1.500e+009     1   1.500e+009
assign (residue 7 and name HN) (residue 9 and name HN)             3.350  1.650  2.150  !  1.480e+008     1   1.480e+008
assign (residue 22 and name HB#) (residue 22 and name HN)          2.850  1.150  1.150  !  1.260e+009     2   6.300e+008
assign (residue 104 and name HB#) (residue 104 and name HN)        2.850  1.150  1.150  !  1.560e+009     2   7.800e+008
assign (residue 5 and name HB#) (residue 2 and name HN)            3.350  1.650  2.150  !  4.310e+008     2   2.155e+008
assign (residue 59 and name HN) (residue 39 and name HA)           2.850  1.150  1.150  !  6.199e+005     1   6.199e+005 ed EO
assign (residue 60 and name HN) (residue 64 and name HN)           3.350  1.650  2.150  !  1.670e+008     1   1.670e+008
assign (residue 96 and name HA) (residue 96 and name HN)           2.350  0.650  0.650  !  1.290e+009     1   1.290e+009
assign (residue 64 and name HD1#) (residue 64 and name HN)         3.600  1.900  2.400  !  5.530e+008     3   1.843e+008
assign (residue 67 and name HB1) (residue 69 and name HN)          3.350  1.650  2.150  !  2.850e+008     1   2.850e+008
assign (residue 12 and name HG1) (residue 12 and name HE21)        2.850  1.150  1.150  !  3.120e+008     1   3.120e+008
assign (residue 41 and name HA2) (residue 42 and name HN)          3.350  1.650  2.150  !  1.800e+008     1   1.800e+008
assign (residue 31 and name HA) (residue 31 and name HN)           2.850  1.150  1.150  !  3.560e+008     1   3.560e+008
assign (residue 86 and name HN) (residue 87 and name HN)           2.350  0.650  0.650  !  1.350e+009     1   1.350e+009 
assign (residue 89 and name HB) (residue 93 and name HN)           2.850  1.150  1.150  !  7.930e+008     1   7.930e+008
assign (residue 74 and name HN) (residue 73 and name HA)           3.350  1.650  2.150  !  2.893e+005     1   2.893e+005
assign (residue 70 and name HB2) (residue 70 and name HN)          2.850  1.150  1.150  !  1.140e+009     1   1.140e+009 ed EO
!assign (residue 31 and name HA) (residue 25 and name HN)           3.350  1.650  2.150  !  1.660e+008     1   1.660e+008
assign (residue 27 and name HA) (residue 27 and name HN)           2.850  1.150  1.150  !  8.250e+008     1   8.250e+008
assign (residue 95 and name HN) (residue 96 and name HN)           2.850  1.150  1.150  !  7.460e+008     1   7.460e+008
assign (residue 72 and name HE#) (residue 81 and name HN)          3.350  1.650  2.150  !  1.120e+008     2   5.600e+007
assign (residue 68 and name HB#) (residue 70 and name HN)          3.350  1.650  2.150  !  7.510e+007     2   3.755e+007
assign (residue 68 and name HB#) (residue 69 and name HN)          3.350  1.650  2.150  !  3.150e+008     2   1.575e+008
assign (residue 34 and name HA2) (residue 35 and name HN)          2.350  0.650  0.650  !  1.130e+009     1   1.130e+009
assign (residue 36 and name HN) (residue 38 and name HN)           3.350  1.650  2.150  !  6.820e+008     1   6.820e+008 ed EO
assign (residue 36 and name HD#) (residue 61 and name HN)          3.350  1.650  2.150  !  4.910e+007     2   2.455e+007
assign (residue 42 and name HG#) (residue 42 and name HE22)        2.850  1.150  1.150  !  7.820e+008     2   3.910e+008
assign (residue 90 and name HN) (residue 87 and name HN)           3.350  1.650  2.150  !  5.740e+007     1   5.740e+007
assign (residue 50 and name HN) (residue 49 and name HA)           2.600  0.900  0.900  !  1.950e+006     1   1.950e+006
assign (residue 96 and name HB#) (residue 96 and name HN)          3.100  1.400  1.400  !  2.180e+009     3   7.267e+008
assign (residue 91 and name HA) (residue 91 and name HN)           2.850  1.150  1.150  !  8.970e+008     1   8.970e+008
assign (residue 54 and name HA) (residue 54 and name HN)           2.350  0.650  0.650  !  1.110e+009     1   1.110e+009
!assign (residue 46 and name HE1) (residue 48 and name HN)          3.350  1.650  2.150  !  3.300e+008     1   3.300e+008 ed EO
assign (residue 19 and name HB) (residue 19 and name HN)           3.350  1.650  2.150  !  1.090e+008     1   1.090e+008
assign (residue 63 and name HN) (residue 66 and name HN)           3.350  1.650  2.150  !  2.370e+008     1   2.370e+008
assign (residue 12 and name HG1) (residue 12 and name HE22)        2.850  1.150  1.150  !  5.620e+008     1   5.620e+008
assign (residue 13 and name HN) (residue 15 and name HN)           2.850  1.150  1.150  !  5.260e+008     1   5.260e+008
assign (residue 5 and name HN) (residue 5 and name HB#)            3.350  1.650  2.150  !  1.119e+006     2   5.593e+005
assign (residue 32 and name HB2) (residue 20 and name HN)          3.350  1.650  2.150  !  3.740e+007     1   3.740e+007
assign (residue 76 and name HA) (residue 77 and name HN)           2.350  0.650  0.650  !  1.310e+009     1   1.310e+009
assign (residue 74 and name HN) (residue 76 and name HD2)          3.350  1.650  2.150  !  3.233e+005     1   3.233e+005
assign (residue 49 and name HN) (residue 53 and name HN)           3.350  1.650  2.150  !  7.720e+007     1   7.720e+007
assign (residue 67 and name HN) (residue 66 and name HB2)          3.350  1.650  2.150  !  4.315e+005     1   4.315e+005
assign (residue 62 and name HB#) (residue 63 and name HN)          2.850  1.150  1.150  !  1.400e+009     2   7.000e+008
assign (residue 35 and name HD1#) (residue 36 and name HN)         3.600  1.900  2.400  !  9.370e+007     3   3.123e+007
assign (residue 8 and name HN) (residue 8 and name HE#)            3.350  1.650  2.150  !  2.967e+005     2   1.484e+005
assign (residue 46 and name HB2) (residue 31 and name HN)          3.350  1.650  2.150  !  3.030e+008     1   3.030e+008 ed EO
assign (residue 68 and name HG) (residue 68 and name HN)           2.850  1.150  1.150  !  3.460e+008     1   3.460e+008
assign (residue 22 and name HN) (residue 104 and name HN)          3.350  1.650  2.150  !  5.020e+007     1   5.020e+007
assign (residue 57 and name HG2#) (residue 58 and name HN)         3.100  1.400  1.400  !  1.370e+009     3   4.567e+008
assign (residue 57 and name HA) (residue 57 and name HN)           2.850  1.150  1.150  !  9.760e+008     1   9.760e+008
assign (residue 74 and name HB2) (residue 74 and name HN)          2.350  0.650  0.650  !  1.250e+009     1   1.250e+009
assign (residue 40 and name HN) (residue 39 and name HA)           2.600  0.900  0.900  !  1.352e+006     1   1.352e+006
assign (residue 15 and name HB#) (residue 18 and name HN)          3.600  1.900  2.400  !  1.050e+008     3   3.500e+007
assign (residue 43 and name HA) (residue 42 and name HN)           3.350  1.650  2.150  !  1.880e+008     1   1.880e+008
assign (residue 47 and name HB) (residue 47 and name HN)           2.850  1.150  1.150  !  3.860e+008     1   3.860e+008
assign (residue 80 and name HN) (residue 79 and name HA)           3.350  1.650  2.150  !  3.460e+005     1   3.460e+005
assign (residue 50 and name HB#) (residue 50 and name HN)          2.850  1.150  1.150  !  1.200e+009     2   6.000e+008
assign (residue 103 and name HD22) (residue 103 and name HD21)     2.350  0.650  0.650  !  4.610e+009     1   4.610e+009
assign (residue 59 and name HA) (residue 60 and name HN)           2.350  0.650  0.650  !  1.170e+009     1   1.170e+009
assign (residue 14 and name HA) (residue 16 and name HN)           3.350  1.650  2.150  !  1.230e+008     1   1.230e+008
assign (residue 46 and name HA) (residue 47 and name HN)           2.350  0.650  0.650  !  1.030e+009     1   1.030e+009
assign (residue 61 and name HA) (residue 62 and name HN)           2.850  1.150  1.150  !  3.210e+008     1   3.210e+008
assign (residue 89 and name HA) (residue 89 and name HN)           2.350  0.650  0.650  !  2.620e+009     1   2.620e+009
assign (residue 42 and name HB#) (residue 42 and name HE21)        2.850  1.150  1.150  !  6.560e+008     2   3.280e+008
assign (residue 31 and name HN) (residue 32 and name HN)           3.350  1.650  2.150  !  1.000e+008     1   1.000e+008
assign (residue 104 and name HN) (residue 103 and name HB1)        3.350  1.650  2.150  !  3.849e+005     1   3.849e+005
assign (residue 19 and name HB) (residue 24 and name HN)           3.350  1.650  2.150  !  1.090e+008     1   1.090e+008
assign (residue 49 and name HN) (residue 50 and name HN)           3.350  1.650  2.150  !  1.700e+008     1   1.700e+008
assign (residue 13 and name HB#) (residue 14 and name HN)          3.350  1.650  2.150  !  5.810e+008     2   2.905e+008
!assign (residue 50 and name HB#) (residue 52 and name HN)          3.350  1.650  2.150  !  2.200e+008     2   1.100e+008
assign (residue 55 and name HB#) (residue 55 and name HN)          2.850  1.150  1.150  !  2.280e+009     2   1.140e+009 ed EO
assign (residue 60 and name HA) (residue 60 and name HN)           2.850  1.150  1.150  !  9.930e+008     1   9.930e+008
assign (residue 16 and name HB1) (residue 16 and name HN)          2.850  1.150  1.150  !  5.160e+008     1   5.160e+008
assign (residue 31 and name HA) (residue 19 and name HN)           3.350  1.650  2.150  !  1.210e+008     1   1.210e+008
assign (residue 9 and name HN) (residue 11 and name HN)            3.350  1.650  2.150  !  1.810e+008     1   1.810e+008
assign (residue 74 and name HN) (residue 75 and name HN)           3.350  1.650  2.150  !  9.850e+007     1   9.850e+007
assign (residue 49 and name HB) (residue 50 and name HN)           2.350  0.650  0.650  !  1.920e+009     1   1.920e+009
!assign (residue 31 and name HB1) (residue 25 and name HN)          3.350  1.650  2.150  !  1.160e+008     1   1.160e+008
assign (residue 7 and name HE#) (residue 8 and name HN)            3.350  1.650  2.150  !  4.730e+008     2   2.365e+008
assign (residue 72 and name HN) (residue 71 and name HA)           3.350  1.650  2.150  !  2.469e+005     1   2.469e+005
assign (residue 38 and name HG#) (residue 38 and name HN)          2.850  1.150  1.150  !  1.550e+009     2   7.750e+008
assign (residue 38 and name HD#) (residue 38 and name HN)          3.350  1.650  2.150  !  3.590e+008     2   1.795e+008
assign (residue 68 and name HD1#) (residue 95 and name HN)         3.600  1.900  2.400  !  1.040e+008     3   3.467e+007
assign (residue 77 and name HN) (residue 78 and name HN)           2.350  0.650  0.650  !  1.100e+009     1   1.100e+009
assign (residue 59 and name HD1) (residue 59 and name HE1)         2.850  1.150  1.150  !  6.100e+008     1   6.100e+008
assign (residue 11 and name HG1#) (residue 12 and name HE22)       3.600  1.900  2.400  !  6.860e+007     3   2.287e+007
assign (residue 35 and name HD1#) (residue 59 and name HE1)        3.600  1.900  2.400  !  2.180e+008     3   7.267e+007
assign (residue 43 and name HB#) (residue 46 and name HN)          3.600  1.900  2.400  !  3.540e+008     3   1.180e+008
assign (residue 36 and name HB1) (residue 37 and name HN)          2.850  1.150  1.150  !  5.700e+008     1   5.700e+008
assign (residue 73 and name HA) (residue 73 and name HN)           2.850  1.150  1.150  !  7.120e+008     1   7.120e+008
assign (residue 57 and name HD1#) (residue 59 and name HN)         3.600  1.900  2.400  !  7.450e+008     3   2.483e+008
assign (residue 94 and name HD1#) (residue 10 and name HN)         3.600  1.900  2.400  !  8.650e+008     3   2.883e+008
assign (residue 97 and name HN) (residue 99 and name HN)           3.350  1.650  2.150  !  1.490e+008     1   1.490e+008
assign (residue 25 and name HB#) (residue 25 and name HN)          2.850  1.150  1.150  !  2.070e+009     2   1.035e+009
assign (residue 101 and name HA) (residue 103 and name HN)         2.850  1.150  1.150  !  5.210e+008     1   5.210e+008
assign (residue 102 and name HN) (residue 103 and name HB1)        3.350  1.650  2.150  !  3.194e+005     1   3.194e+005
assign (residue 17 and name HB1) (residue 17 and name HN)          2.850  1.150  1.150  !  3.890e+009     1   3.890e+009 ed EO
assign (residue 59 and name HB2) (residue 60 and name HN)          2.850  1.150  1.150  !  2.390e+009     1   2.390e+009ed EO
assign (residue 5 and name HN) (residue 5 and name HD#)            3.350  1.650  2.150  !  1.160e+006     2   5.799e+005
assign (residue 63 and name HG2#) (residue 64 and name HN)         3.100  1.400  1.400  !  1.120e+009     3   3.733e+008
assign (residue 40 and name HG2#) (residue 55 and name HN)         3.600  1.900  2.400  !  3.920e+008     3   1.307e+008
assign (residue 85 and name HD1#) (residue 91 and name HN)         3.600  1.900  2.400  !  2.260e+008     3   7.533e+007
assign (residue 54 and name HB1) (residue 55 and name HN)          2.850  1.150  1.150  !  4.350e+008     1   4.350e+008
assign (residue 12 and name HN) (residue 10 and name HN)           3.350  1.650  2.150  !  2.780e+008     1   2.780e+008
assign (residue 73 and name HN) (residue 74 and name HA)           3.350  1.650  2.150  !  3.286e+005     1   3.286e+005
assign (residue 90 and name HN) (residue 89 and name HB)           3.350  1.650  2.150  !  3.991e+005     1   3.991e+005
assign (residue 34 and name HA1) (residue 35 and name HN)          2.850  1.150  1.150  !  7.210e+008     1   7.210e+008
assign (residue 65 and name HG1) (residue 64 and name HN)          2.850  1.150  1.150  !  6.640e+008     1   6.640e+008
assign (residue 94 and name HA) (residue 94 and name HN)           2.350  0.650  0.650  !  1.760e+009     1   1.760e+009
assign (residue 35 and name HD1#) (residue 33 and name HN)         3.600  1.900  2.400  !  2.460e+008     3   8.200e+007
assign (residue 53 and name HA) (residue 55 and name HN)           2.850  1.150  1.150  !  3.680e+008     1   3.680e+008
assign (residue 100 and name HE#) (residue 100 and name HN)        3.350  1.650  2.150  !  2.070e+008     2   1.035e+008
assign (residue 31 and name HB1) (residue 31 and name HN)          2.850  1.150  1.150  !  5.320e+008     1   5.320e+008
assign (residue 36 and name HA) (residue 37 and name HN)           2.350  0.650  0.650  !  2.040e+009     1   2.040e+009
assign (residue 86 and name HG#) (residue 86 and name HN)          3.350  1.650  2.150  !  4.470e+008     2   2.235e+008
assign (residue 96 and name HA) (residue 97 and name HN)           2.850  1.150  1.150  !  8.130e+008     1   8.130e+008
assign (residue 40 and name HB) (residue 41 and name HN)           2.850  1.150  1.150  !  5.870e+008     1   5.870e+008
assign (residue 66 and name HB1) (residue 66 and name HN)          2.850  1.150  1.150  !  2.790e+009     1   2.790e+009 ed EO
assign (residue 6 and name HA2) (residue 7 and name HN)            2.850  1.150  1.150  !  5.780e+008     1   5.780e+008
assign (residue 66 and name HG2) (residue 66 and name HN)          2.350  0.650  0.650  !  1.190e+009     1   1.190e+009
assign (residue 102 and name HN) (residue 101 and name HN)         2.850  1.150  1.150  !  4.720e+008     1   4.720e+008
assign (residue 102 and name HG2#) (residue 103 and name HN)       3.600  1.900  2.400  !  4.190e+008     3   1.397e+008
assign (residue 46 and name HN) (residue 26 and name HB1)          3.350  1.650  2.150  !  2.715e+005     1   2.715e+005
assign (residue 9 and name HG12) (residue 9 and name HN)           2.850  1.150  1.150  !  8.140e+008     1   8.140e+008
assign (residue 64 and name HA) (residue 68 and name HN)           2.850  1.150  1.150  !  6.130e+008     1   6.130e+008
assign (residue 86 and name HB#) (residue 86 and name HN)          2.850  1.150  1.150  !  8.720e+008     2   4.360e+008
assign (residue 11 and name HG1#) (residue 12 and name HN)         3.600  1.900  2.400  !  4.510e+008     3   1.503e+008
assign (residue 7 and name HB#) (residue 7 and name HN)            2.350  0.650  0.650  !  2.040e+009     2   1.020e+009
assign (residue 95 and name HD1#) (residue 95 and name HN)         3.600  1.900  2.400  !  6.440e+008     3   2.147e+008
assign (residue 104 and name HN) (residue 102 and name HN)         2.850  1.150  1.150  !  4.390e+008     1   4.390e+008
assign (residue 10 and name HB1) (residue 9 and name HN)           3.350  1.650  2.150  !  1.270e+008     1   1.270e+008
assign (residue 64 and name HA) (residue 64 and name HN)           2.850  1.150  1.150  !  4.850e+008     1   4.850e+008
assign (residue 95 and name HB) (residue 96 and name HN)           2.850  1.150  1.150  !  8.640e+008     1   8.640e+008
assign (residue 54 and name HD21) (residue 54 and name HN)         3.350  1.650  2.150  !  1.410e+008     1   1.410e+008
assign (residue 51 and name HN) (residue 50 and name HN)           2.850  1.150  1.150  !  5.210e+008     1   5.210e+008
assign (residue 6 and name HN) (residue 4 and name HA)             3.350  1.650  2.150  !  4.514e+005     1   4.514e+005
assign (residue 19 and name HA) (residue 20 and name HN)           2.850  1.150  1.150  !  8.150e+008     1   8.150e+008
assign (residue 95 and name HB) (residue 95 and name HN)           2.350  0.650  0.650  !  1.460e+009     1   1.460e+009
assign (residue 14 and name HN) (residue 13 and name HN)           2.350  0.650  0.650  !  1.720e+009     1   1.720e+009
assign (residue 20 and name HB) (residue 20 and name HN)           2.850  1.150  1.150  !  3.710e+008     1   3.710e+008
assign (residue 98 and name HB#) (residue 98 and name HN)          2.350  0.650  0.650  !  2.040e+009     2   1.020e+009
assign (residue 16 and name HG1) (residue 15 and name HN)          3.350  1.650  2.150  !  1.840e+008     1   1.840e+008
assign (residue 103 and name HD21) (residue 103 and name HN)       3.350  1.650  2.150  !  8.420e+007     1   8.420e+007
assign (residue 81 and name HB) (residue 82 and name HN)           3.350  1.650  2.150  !  5.750e+007     1   5.750e+007
assign (residue 53 and name HN) (residue 41 and name HA1)          3.350  1.650  2.150  !  2.571e+005     1   2.571e+005
assign (residue 95 and name HN) (residue 93 and name HN)           2.850  1.150  1.150  !  6.830e+008     1   6.830e+008
assign (residue 69 and name HN) (residue 68 and name HA)           3.350  1.650  2.150  !  2.693e+005     1   2.693e+005
assign (residue 39 and name HN) (residue 40 and name HN)           3.350  1.650  2.150  !  3.290e+008     1   3.290e+008 ed EO
assign (residue 57 and name HB) (residue 57 and name HN)           2.850  1.150  1.150  !  5.970e+008     1   5.970e+008
assign (residue 95 and name HD1#) (residue 64 and name HN)         3.600  1.900  2.400  !  5.440e+008     3   1.813e+008
assign (residue 26 and name HB1) (residue 26 and name HN)          2.850  1.150  1.150  !  8.490e+008     1   8.490e+008
assign (residue 75 and name HG2#) (residue 78 and name HN)         3.600  1.900  2.400  !  9.450e+008     3   3.150e+008 ed EO
assign (residue 58 and name HG2#) (residue 58 and name HN)         3.600  1.900  2.400  !  1.670e+008     3   5.567e+007
assign (residue 56 and name HA1) (residue 57 and name HN)          2.850  1.150  1.150  !  9.410e+008     1   9.410e+008
assign (residue 35 and name HB#) (residue 34 and name HN)          3.350  1.650  2.150  !  2.350e+008     2   1.175e+008
assign (residue 80 and name HN) (residue 79 and name HN)           3.350  1.650  2.150  !  1.890e+007     1   1.890e+007
assign (residue 103 and name HB2) (residue 103 and name HD22)      2.850  1.150  1.150  !  3.790e+008     1   3.790e+008
assign (residue 7 and name HN) (residue 8 and name HN)             2.350  0.650  0.650  !  1.070e+009     1   1.070e+009
assign (residue 52 and name HB#) (residue 53 and name HN)          2.850  1.150  1.150  !  1.290e+009     2   6.450e+008
!assign (residue 35 and name HG) (residue 59 and name HN)           3.350  1.650  2.150  !  3.580e+008     1   3.580e+008 ed EO
assign (residue 93 and name HB#) (residue 94 and name HN)          2.850  1.150  1.150  !  1.140e+009     2   5.700e+008
assign (residue 103 and name HD21) (residue 103 and name HD22)     2.350  0.650  0.650  !  5.110e+009     1   5.110e+009
assign (residue 9 and name HB) (residue 10 and name HN)            2.350  0.650  0.650  !  1.130e+009     1   1.130e+009
assign (residue 67 and name HN) (residue 66 and name HN)           2.350  0.650  0.650  !  1.730e+009     1   1.730e+009
assign (residue 94 and name HD1#) (residue 97 and name HN)         3.600  1.900  2.400  !  7.020e+008     3   2.340e+008
assign (residue 86 and name HN) (residue 85 and name HN)           3.350  1.650  2.150  !  6.100e+008     1   6.100e+008
!assign (residue 59 and name HD1) (residue 41 and name HN)          3.350  1.650  2.150  !  5.480e+007     1   5.480e+007
assign (residue 16 and name HE21) (residue 16 and name HE22)       2.350  0.650  0.650  !  6.390e+009     1   6.390e+009
assign (residue 26 and name HN) (residue 25 and name HA)           2.600  0.900  0.900  !  2.698e+006     1   2.698e+006
assign (residue 36 and name HN) (residue 99 and name HG#)          3.350  1.650  2.150  !  2.286e+005     2   1.143e+005
assign (residue 88 and name HN) (residue 87 and name HN)           3.350  1.650  2.150  !  8.360e+007     1   8.360e+007
assign (residue 66 and name HN) (residue 65 and name HN)           2.850  1.150  1.150  !  7.280e+008     1   7.280e+008
assign (residue 94 and name HB2) (residue 93 and name HN)          3.350  1.650  2.150  !  7.060e+008     1   7.060e+008 ed EO
assign (residue 41 and name HA2) (residue 49 and name HN)          3.350  1.650  2.150  !  1.740e+008     1   1.740e+008
assign (residue 77 and name HA2) (residue 77 and name HN)          2.850  1.150  1.150  !  8.930e+008     1   8.930e+008
assign (residue 70 and name HD21) (residue 70 and name HD22)       2.850  1.150  1.150  !  6.130e+008     1   6.130e+008
assign (residue 57 and name HN) (residue 58 and name HN)           3.350  1.650  2.150  !  5.770e+007     1   5.770e+007
assign (residue 69 and name HG#) (residue 70 and name HN)          2.850  1.150  1.150  !  1.510e+009     2   7.550e+008
assign (residue 8 and name HD#) (residue 9 and name HN)            2.850  1.150  1.150  !  1.990e+009     2   9.950e+008
assign (residue 12 and name HG2) (residue 12 and name HE21)        3.350  1.650  2.150  !  1.880e+008     1   1.880e+008
assign (residue 68 and name HD1#) (residue 68 and name HN)         3.600  1.900  2.400  !  5.880e+008     3   1.960e+008
!assign (residue 59 and name HD1) (residue 40 and name HN)          3.350  1.650  2.150  !  9.960e+007     1   9.960e+007
assign (residue 55 and name HN) (residue 75 and name HG2#)         3.600  1.900  2.400  !  3.471e+005     3   1.157e+005
assign (residue 26 and name HN) (residue 25 and name HG#)          3.350  1.650  2.150  !  3.309e+005     2   1.654e+005
assign (residue 24 and name HN) (residue 23 and name HN)           2.850  1.150  1.150  !  3.250e+008     1   3.250e+008
assign (residue 39 and name HN) (residue 38 and name HD#)          3.350  1.650  2.150  !  2.380e+005     2   1.190e+005
assign (residue 97 and name HA) (residue 3 and name HN)            3.350  1.650  2.150  !  1.180e+008     1   1.180e+008
assign (residue 14 and name HA) (residue 15 and name HN)           3.350  1.650  2.150  !  2.600e+008     1   2.600e+008
assign (residue 17 and name HN) (residue 18 and name HN)           2.850  1.150  1.150  !  6.580e+008     1   6.580e+008
assign (residue 41 and name HN) (residue 42 and name HN)           2.850  1.150  1.150  !  5.730e+008     1   5.730e+008
assign (residue 36 and name HN) (residue 102 and name HG2#)        3.600  1.900  2.400  !  3.021e+005     3   1.007e+005
assign (residue 87 and name HG#) (residue 87 and name HN)          2.350  0.650  0.650  !  3.140e+009     2   1.570e+009
assign (residue 46 and name HE1) (residue 47 and name HN)          3.350  1.650  2.150  !  6.060e+007     1   6.060e+007
assign (residue 60 and name HN) (residue 59 and name HN)           3.350  1.650  2.150  !  9.930e+007     1   9.930e+007
assign (residue 10 and name HB1) (residue 10 and name HN)          2.850  1.150  1.150  !  8.130e+008     1   8.130e+008
assign (residue 12 and name HB#) (residue 13 and name HN)          2.850  1.150  1.150  !  9.110e+008     2   4.555e+008
assign (residue 95 and name HN) (residue 94 and name HN)           2.850  1.150  1.150  !  4.580e+008     1   4.580e+008
assign (residue 72 and name HA) (residue 72 and name HN)           2.350  0.650  0.650  !  1.250e+009     1   1.250e+009
assign (residue 75 and name HN) (residue 74 and name HA)           2.600  0.900  0.900  !  6.197e+005     1   6.197e+005
assign (residue 92 and name HN) (residue 65 and name HE#)          3.600  1.900  2.400  !  5.717e+005     3   1.906e+005
assign (residue 85 and name HG2#) (residue 85 and name HN)         3.100  1.400  1.400  !  1.830e+009     3   6.100e+008
assign (residue 52 and name HN) (residue 53 and name HB#)          3.350  1.650  2.150  !  2.500e+005     2   1.250e+005
assign (residue 103 and name HN) (residue 103 and name HA)         2.600  0.900  0.900  !  9.692e+005     1   9.692e+005
assign (residue 79 and name HN) (residue 49 and name HN)           2.850  1.150  1.150  !  5.870e+008     1   5.870e+008
assign (residue 8 and name HN) (residue 11 and name HN)            3.350  1.650  2.150  !  8.050e+007     1   8.050e+007
assign (residue 22 and name HA) (residue 24 and name HN)           2.850  1.150  1.150  !  3.520e+008     1   3.520e+008
assign (residue 13 and name HN) (residue 12 and name HG2)          3.350  1.650  2.150  !  4.039e+005     1   4.039e+005
assign (residue 95 and name HD1#) (residue 65 and name HN)         3.600  1.900  2.400  !  8.770e+008     3   2.923e+008
assign (residue 48 and name HD1) (residue 43 and name HN)          3.350  1.650  2.150  !  1.720e+008     1   1.720e+008
assign (residue 19 and name HG2#) (residue 19 and name HN)         3.600  1.900  2.400  !  2.240e+008     3   7.467e+007
assign (residue 56 and name HN) (residue 40 and name HN)           3.350  1.650  2.150  !  2.270e+008     1   2.270e+008
assign (residue 68 and name HN) (residue 68 and name HD2#)         3.600  1.900  2.400  !  4.691e+005     3   1.564e+005
assign (residue 68 and name HA) (residue 68 and name HN)           2.850  1.150  1.150  !  6.180e+008     1   6.180e+008
!assign (residue 39 and name HB#) (residue 42 and name HE21)        3.350  1.650  2.150  !  2.700e+008     2   1.350e+008
assign (residue 87 and name HA) (residue 87 and name HN)           2.350  0.650  0.650  !  1.290e+009     1   1.290e+009
assign (residue 13 and name HN) (residue 12 and name HN)           2.350  0.650  0.650  !  1.060e+009     1   1.060e+009
assign (residue 90 and name HN) (residue 89 and name HA)           3.350  1.650  2.150  !  4.024e+005     1   4.024e+005
assign (residue 9 and name HG2#) (residue 12 and name HN)          3.600  1.900  2.400  !  1.210e+008     3   4.033e+007
assign (residue 58 and name HA) (residue 57 and name HN)           3.350  1.650  2.150  !  4.230e+008     1   4.230e+008 ed EO
assign (residue 51 and name HA) (residue 51 and name HN)           2.350  0.650  0.650  !  3.200e+009     1   3.200e+009
assign (residue 22 and name HB#) (residue 24 and name HN)          3.350  1.650  2.150  !  7.490e+007     2   3.745e+007
assign (residue 94 and name HN) (residue 9 and name HD1#)          3.600  1.900  2.400  !  5.794e+005     3   1.931e+005
assign (residue 52 and name HD21) (residue 42 and name HN)         3.350  1.650  2.150  !  1.560e+008     1   1.560e+008
assign (residue 59 and name HN) (residue 37 and name HN)           2.850  1.150  1.150  !  5.820e+008     1   5.820e+008
assign (residue 100 and name HB#) (residue 100 and name HN)        2.350  0.650  0.650  !  4.010e+009     2   2.005e+009
!assign (residue 40 and name HN) (residue 58 and name HN)           3.350  1.650  2.150  !  1.620e+008     1   1.620e+008
assign (residue 67 and name HA) (residue 67 and name HN)           2.350  0.650  0.650  !  2.350e+009     1   2.350e+009
assign (residue 5 and name HN) (residue 4 and name HG#)            3.350  1.650  2.150  !  4.261e+005     2   2.131e+005
assign (residue 58 and name HG2#) (residue 39 and name HN)         3.600  1.900  2.400  !  5.370e+008     3   1.790e+008
assign (residue 104 and name HA) (residue 104 and name HN)         2.350  0.650  0.650  !  1.230e+009     1   1.230e+009
assign (residue 71 and name HA) (residue 69 and name HN)           3.350  1.650  2.150  !  2.740e+008     1   2.740e+008
assign (residue 42 and name HG#) (residue 43 and name HN)          3.350  1.650  2.150  !  5.250e+008     2   2.625e+008
assign (residue 6 and name HA2) (residue 9 and name HN)            3.350  1.650  2.150  !  2.730e+008     1   2.730e+008
!assign (residue 53 and name HB#) (residue 49 and name HN)          3.350  1.650  2.150  !  1.910e+008     2   9.550e+007
assign (residue 39 and name HN) (residue 38 and name HB#)          3.350  1.650  2.150  !  7.429e+005     2   3.714e+005
assign (residue 6 and name HA1) (residue 7 and name HN)            2.350  0.650  0.650  !  1.340e+009     1   1.340e+009
assign (residue 52 and name HA) (residue 55 and name HN)           2.850  1.150  1.150  !  1.470e+009     1   1.470e+009 ed EO
assign (residue 74 and name HN) (residue 72 and name HN)           2.850  1.150  1.150  !  1.280e+009     1   1.280e+009  ed EO
assign (residue 46 and name HD#) (residue 46 and name HN)          3.350  1.650  2.150  !  1.030e+009     2   5.150e+008 ed EO
assign (residue 37 and name HN) (residue 38 and name HN)           2.350  0.650  0.650  !  1.810e+009     1   1.810e+009
assign (residue 98 and name HD1#) (residue 98 and name HN)         3.100  1.400  1.400  !  1.200e+009     3   4.000e+008
assign (residue 31 and name HN) (residue 26 and name HN)           3.350  1.650  2.150  !  8.020e+007     1   8.020e+007
assign (residue 96 and name HB#) (residue 97 and name HN)          3.100  1.400  1.400  !  1.060e+009     3   3.533e+008
assign (residue 95 and name HA) (residue 96 and name HN)           2.850  1.150  1.150  !  4.180e+008     1   4.180e+008
assign (residue 40 and name HN) (residue 39 and name HD#)          3.350  1.650  2.150  !  2.881e+005     2   1.440e+005
assign (residue 65 and name HE#) (residue 65 and name HN)          3.600  1.900  2.400  !  2.410e+009     3   8.033e+008
assign (residue 52 and name HN) (residue 51 and name HN)           2.350  0.650  0.650  !  1.700e+009     1   1.700e+009
assign (residue 11 and name HN) (residue 8 and name HN)            3.350  1.650  2.150  !  6.820e+007     1   6.820e+007
assign (residue 87 and name HN) (residue 86 and name HA)           3.350  1.650  2.150  !  5.630e+005     1   5.630e+005
assign (residue 66 and name HN) (residue 64 and name HN)           3.350  1.650  2.150  !  1.500e+008     1   1.500e+008
assign (residue 57 and name HN) (residue 56 and name HN)           2.850  1.150  1.150  !  5.290e+008     1   5.290e+008
assign (residue 97 and name HA) (residue 98 and name HN)           2.850  1.150  1.150  !  9.980e+008     1   9.980e+008
assign (residue 10 and name HE2) (residue 15 and name HN)          3.350  1.650  2.150  !  1.480e+008     1   1.480e+008
assign (residue 9 and name HN) (residue 8 and name HN)             2.850  1.150  1.150  !  9.780e+008     1   9.780e+008
assign (residue 65 and name HN) (residue 62 and name HN)           3.350  1.650  2.150  !  1.390e+008     1   1.390e+008
assign (residue 18 and name HN) (residue 16 and name HN)           3.350  1.650  2.150  !  1.600e+008     1   1.600e+008
assign (residue 40 and name HB) (residue 55 and name HN)           3.350  1.650  2.150  !  7.000e+007     1   7.000e+007
assign (residue 73 and name HG#) (residue 73 and name HN)          3.350  1.650  2.150  !  4.660e+008     2   2.330e+008
!assign (residue 42 and name HN) (residue 42 and name HE22)         3.350  1.650  2.150  !  1.450e+008     1   1.450e+008
assign (residue 25 and name HA) (residue 26 and name HN)           2.350  0.650  0.650  !  1.370e+009     1   1.370e+009
assign (residue 36 and name HN) (residue 36 and name HD2)          2.600  0.900  0.900  !  1.768e+006     1   1.768e+006
assign (residue 33 and name HD2) (residue 22 and name HN)          3.350  1.650  2.150  !  9.970e+007     1   9.970e+007
assign (residue 17 and name HA) (residue 18 and name HN)           2.850  1.150  1.150  !  3.190e+008     1   3.190e+008
assign (residue 53 and name HA) (residue 41 and name HN)           3.350  1.650  2.150  !  1.700e+008     1   1.700e+008
assign (residue 62 and name HA) (residue 65 and name HN)           3.350  1.650  2.150  !  2.310e+008     1   2.310e+008
assign (residue 90 and name HB#) (residue 91 and name HN)          2.850  1.150  1.150  !  1.820e+009     2   9.100e+008
assign (residue 54 and name HB2) (residue 55 and name HN)          2.850  1.150  1.150  !  5.200e+008     1   5.200e+008
assign (residue 85 and name HA) (residue 87 and name HN)           2.850  1.150  1.150  !  6.850e+008     1   6.850e+008
assign (residue 61 and name HN) (residue 62 and name HN)           2.850  1.150  1.150  !  3.410e+008     1   3.410e+008
assign (residue 87 and name HN) (residue 86 and name HB#)          2.600  0.900  0.900  !  1.943e+006     2   9.716e+005
assign (residue 100 and name HN) (residue 100 and name HG#)        3.350  1.650  2.150  !  4.695e+005     2   2.347e+005
assign (residue 89 and name HN) (residue 88 and name HA)           3.350  1.650  2.150  !  4.088e+005     1   4.088e+005
assign (residue 60 and name HN) (residue 58 and name HG2#)         3.600  1.900  2.400  !  3.100e+005     3   1.033e+005
assign (residue 102 and name HG2#) (residue 102 and name HN)       3.100  1.400  1.400  !  1.380e+009     3   4.600e+008
assign (residue 48 and name HB1) (residue 53 and name HN)          2.850  1.150  1.150  !  5.870e+008     1   5.870e+008
assign (residue 90 and name HB#) (residue 90 and name HN)          2.350  0.650  0.650  !  3.050e+009     2   1.525e+009
assign (residue 101 and name HB#) (residue 102 and name HN)        3.600  1.900  2.400  !  7.710e+008     3   2.570e+008
assign (residue 9 and name HN) (residue 7 and name HN)             3.350  1.650  2.150  !  2.510e+008     1   2.510e+008
assign (residue 70 and name HB2) (residue 72 and name HN)          3.350  1.650  2.150  !  1.510e+008     1   1.510e+008
assign (residue 18 and name HN) (residue 19 and name HN)           3.350  1.650  2.150  !  2.860e+008     1   2.860e+008
assign (residue 72 and name HN) (residue 78 and name HG2#)         3.600  1.900  2.400  !  4.633e+005     3   1.544e+005
assign (residue 22 and name HG#) (residue 22 and name HN)          3.350  1.650  2.150  !  8.170e+008     2   4.085e+008 ed EO
assign (residue 29 and name HN) (residue 27 and name HN)           2.850  1.150  1.150  !  3.300e+008     1   3.300e+008
assign (residue 61 and name HA) (residue 61 and name HN)           2.850  1.150  1.150  !  3.130e+008     1   3.130e+008
assign (residue 103 and name HN) (residue 103 and name HD21)       3.350  1.650  2.150  !  1.680e+008     1   1.680e+008
assign (residue 90 and name HN) (residue 88 and name HB#)          3.350  1.650  2.150  !  7.587e+005     2   3.793e+005
assign (residue 101 and name HB#) (residue 101 and name HN)        3.100  1.400  1.400  !  1.990e+009     3   6.633e+008
assign (residue 25 and name HG#) (residue 25 and name HN)          2.850  1.150  1.150  !  1.120e+009     2   5.600e+008
assign (residue 101 and name HN) (residue 102 and name HN)         2.350  0.650  0.650  !  1.130e+009     1   1.130e+009
assign (residue 94 and name HB1) (residue 94 and name HN)          2.350  0.650  0.650  !  1.240e+009     1   1.240e+009
assign (residue 69 and name HA) (residue 69 and name HN)           2.850  1.150  1.150  !  8.190e+008     1   8.190e+008
assign (residue 16 and name HA) (residue 16 and name HN)           2.850  1.150  1.150  !  5.480e+008     1   5.480e+008
assign (residue 51 and name HB#) (residue 78 and name HN)          3.600  1.900  2.400  !  7.440e+008     3   2.480e+008
assign (residue 20 and name HN) (residue 20 and name HG1#)         3.600  1.900  2.400  !  4.072e+005     3   1.357e+005
assign (residue 47 and name HN) (residue 47 and name HA)           3.350  1.650  2.150  !  2.932e+005     1   2.932e+005
assign (residue 46 and name HA) (residue 46 and name HN)           2.350  0.650  0.650  !  1.620e+009     1   1.620e+009
assign (residue 68 and name HN) (residue 67 and name HD2)          3.350  1.650  2.150  !  4.576e+005     1   4.576e+005
assign (residue 72 and name HE#) (residue 72 and name HN)          3.350  1.650  2.150  !  3.620e+008     2   1.810e+008
assign (residue 48 and name HB1) (residue 42 and name HN)          3.350  1.650  2.150  !  1.120e+008     1   1.120e+008
assign (residue 76 and name HD#) (residue 75 and name HN)          2.850  1.150  1.150  !  1.040e+009     2   5.200e+008
assign (residue 64 and name HN) (residue 59 and name HB1)          3.350  1.650  2.150  !  3.647e+005     1   3.647e+005
assign (residue 32 and name HD2#) (residue 33 and name HN)         3.600  1.900  2.400  !  6.680e+009     3   2.227e+009ed EO
assign (residue 15 and name HA) (residue 14 and name HN)           3.350  1.650  2.150  !  6.660e+007     1   6.660e+007
assign (residue 56 and name HN) (residue 54 and name HN)           3.350  1.650  2.150  !  3.970e+008     1   3.970e+008  ed EO
assign (residue 90 and name HN) (residue 89 and name HG2#)         3.600  1.900  2.400  !  2.988e+005     3   9.959e+004
assign (residue 7 and name HA) (residue 10 and name HN)            2.850  1.150  1.150  !  4.460e+008     1   4.460e+008
assign (residue 35 and name HN) (residue 102 and name HG2#)        3.600  1.900  2.400  !  6.144e+005     3   2.048e+005
assign (residue 74 and name HN) (residue 73 and name HN)           2.350  0.650  0.650  !  1.790e+009     1   1.790e+009
assign (residue 48 and name HB2) (residue 48 and name HN)          2.850  1.150  1.150  !  9.620e+008     1   9.620e+008
assign (residue 2 and name HN) (residue 96 and name HN)            3.350  1.650  2.150  !  4.420e+007     1   4.420e+007
assign (residue 59 and name HB2) (residue 59 and name HE1)         3.350  1.650  2.150  !  2.270e+008     1   2.270e+008
assign (residue 49 and name HG2#) (residue 79 and name HN)         3.600  1.900  2.400  !  3.840e+008     3   1.280e+008
assign (residue 47 and name HA) (residue 48 and name HN)           2.350  0.650  0.650  !  2.230e+009     1   2.230e+009
assign (residue 77 and name HA1) (residue 78 and name HN)          2.350  0.650  0.650  !  1.220e+009     1   1.220e+009
assign (residue 40 and name HG2#) (residue 40 and name HN)          2.600  0.900  0.900  !  1.590e+009     1   1.590e+009
assign (residue 82 and name HB2) (residue 82 and name HN)          2.850  1.150  1.150  !  1.940e+009     1   1.940e+009 ed EO
assign (residue 91 and name HN) (residue 85 and name HG2#)         3.600  1.900  2.400  !  5.008e+005     3   1.669e+005
assign (residue 102 and name HA) (residue 103 and name HN)         2.850  1.150  1.150  !  5.510e+008     1   5.510e+008
assign (residue 24 and name HN) (residue 33 and name HE2)          2.350  0.650  0.650  !added EO to get rid of overlap
assign (residue 98 and name HA) (residue 102 and name HG2#)        3.100  1.400  1.400  !  1.470e+007     3   4.899e+006        
assign (residue 97 and name HN) (residue 95 and name HA)           2.850  1.150  1.150  !  4.369e+006     1   4.369e+006        
assign (residue 94 and name HG) (residue 94 and name HB2)          2.850  1.150  1.150  !  7.034e+006     1   7.034e+006        
!assign (residue 70 and name HN) (residue 71 and name HB2)          3.350  1.650  2.150  !  1.907e+006     1   1.907e+006        
assign (residue 75 and name HN) (residue 74 and name HB2)          3.350  1.650  2.150  !  1.475e+006     1   1.475e+006        
!Carbon-resolved NOE distance restraints, same notes as above
assign (residue 13 and name HE#) (residue 13 and name HB#)         3.350  1.650  2.150  !  3.482e+006     4   8.704e+005        
assign (residue 62 and name HA) (residue 63 and name HA)           3.350  1.650  2.150  !  4.814e+006     1   4.814e+006  ed EO     
!assign (residue 59 and name HD1) (residue 57 and name HD1#)        3.600  1.900  2.400  !  6.362e+006     3   2.121e+006        
assign (residue 39 and name HG#) (residue 39 and name HB#)         2.350  0.650  0.650  !  3.299e+007     4   8.247e+006        
assign (residue 74 and name HD#) (residue 71 and name HA)          3.350  1.650  2.150  !  1.791e+006     2   8.955e+005        
assign (residue 62 and name HN) (residue 63 and name HG2#)         3.600  1.900  2.400  !  5.006e+006     3   1.669e+006        
assign (residue 32 and name HB2) (residue 32 and name HA)          2.850  1.150  1.150  !  3.657e+006     1   3.657e+006        
assign (residue 78 and name HG2#) (residue 78 and name HA)         3.600  1.900  2.400  !  3.787e+006     3   1.262e+006        
assign (residue 59 and name HN) (residue 39 and name HA)           2.850  1.150  1.150  !  3.753e+006     1   3.753e+006        
assign (residue 86 and name HN) (residue 85 and name HB)           3.350  1.650  2.150  !  1.986e+006     1   1.986e+006        
assign (residue 94 and name HB2) (residue 91 and name HA)          2.350  0.650  0.650  !  1.006e+007     1   1.006e+007        
assign (residue 54 and name HN) (residue 54 and name HB1)          2.350  0.650  0.650  !  8.135e+006     1   8.135e+006        
assign (residue 40 and name HG2#) (residue 39 and name HA)         3.600  1.900  2.400  !  4.772e+006     3   1.591e+006        
assign (residue 4 and name HG#) (residue 4 and name HA)            2.850  1.150  1.150  !  1.783e+007     2   8.916e+006ed EO        
assign (residue 54 and name HN) (residue 54 and name HB2)          2.850  1.150  1.150  !  4.517e+006     1   4.517e+006        
assign (residue 10 and name HD2) (residue 94 and name HD2#)        3.600  1.900  2.400  !  3.616e+006     3   1.205e+006        
assign (residue 60 and name HD1) (residue 60 and name HG#)         2.850  1.150  1.150  !  9.504e+006     2   4.752e+006        
assign (residue 40 and name HN) (residue 40 and name HA)           2.350  0.650  0.650  !  8.285e+006     1   8.285e+006        
assign (residue 64 and name HA) (residue 64 and name HD2#)         3.100  1.400  1.400  !  2.237e+007     3   7.456e+006        
assign (residue 3 and name HA) (residue 3 and name HB)             2.350  0.650  0.650  !  1.075e+007     1   1.075e+007        
assign (residue 98 and name HD2#) (residue 20 and name HG1#)       3.350  1.650  2.150  !  2.925e+007     9   3.250e+006        
assign (residue 100 and name HD#) (residue 3 and name HG2#)        2.850  1.150  1.150  !  4.798e+007     6   7.997e+006ed EO        
assign (residue 75 and name HN) (residue 78 and name HB)           3.350  1.650  2.150  !  3.100e+006     1   3.100e+006 ed EO       
assign (residue 85 and name HD1#) (residue 85 and name HG2#)       3.350  1.650  2.150  !  4.130e+007     9   4.589e+006        
assign (residue 59 and name HA) (residue 59 and name HB2)          3.350  1.650  2.150  !  2.906e+006     1   2.906e+006        
assign (residue 98 and name HD2#) (residue 98 and name HD1#)       3.350  1.650  2.150  !  4.047e+007     9   4.497e+006        
assign (residue 7 and name HE#) (residue 11 and name HG2#)         3.350  1.650  2.150  !  1.398e+007     6   2.331e+006        
assign (residue 65 and name HB#) (residue 95 and name HD1#)        3.350  1.650  2.150  !  1.601e+007     6   2.669e+006        
assign (residue 20 and name HB) (residue 102 and name HG2#)        2.600  0.900  0.900  !  2.681e+007     3   8.936e+006        
assign (residue 68 and name HD1#) (residue 94 and name HD2#)       3.850  2.150  2.150  !  3.992e+006     9   4.436e+005        
assign (residue 94 and name HA) (residue 94 and name HB1)          2.850  1.150  1.150  !  4.779e+006     1   4.779e+006        
assign (residue 98 and name HN) (residue 95 and name HA)           2.850  1.150  1.150  !  3.142e+006     1   3.142e+006        
assign (residue 21 and name HG#) (residue 21 and name HA)          2.850  1.150  1.150  !  9.514e+006     2   4.757e+006        
assign (residue 88 and name HG#) (residue 65 and name HE#)         2.350  0.650  0.650  !  6.716e+007     6   1.119e+007        
assign (residue 99 and name HN) (residue 99 and name HA)           2.850  1.150  1.150  !  4.603e+006     1   4.603e+006        
assign (residue 48 and name HN) (residue 48 and name HB1)          2.850  1.150  1.150  !  5.632e+006     1   5.632e+006        
assign (residue 32 and name HD2#) (residue 32 and name HB2)        3.600  1.900  2.400  !  2.174e+006     3   7.247e+005        
assign (residue 3 and name HN) (residue 2 and name HB1)            2.850  1.150  1.150  !  4.567e+006     1   4.567e+006        
assign (residue 7 and name HB#) (residue 4 and name HA)            2.850  1.150  1.150  !  3.293e+007    2   1.646e+007ed EO        
assign (residue 10 and name HB1) (residue 10 and name HA)          2.850  1.150  1.150  !  6.262e+006     1   6.262e+006        
assign (residue 50 and name HN) (residue 50 and name HA)           2.350  0.650  0.650  !  1.030e+007     1   1.030e+007        
assign (residue 10 and name HE1) (residue 15 and name HB#)         3.600  1.900  2.400  !  3.993e+006     3   1.331e+006        
assign (residue 71 and name HD1) (residue 71 and name HA)          3.350  1.650  2.150  !  2.192e+006     1   2.192e+006        
!assign (residue 63 and name HG2#) (residue 57 and name HA)         3.600  1.900  2.400  !  5.002e+006     3   1.667e+006        
assign (residue 16 and name HN) (residue 16 and name HG1)          3.350  1.650  2.150  !  2.642e+006     1   2.642e+006        
assign (residue 17 and name HB2) (residue 17 and name HB1)         3.350  1.650  2.150  !  3.002e+006     1   3.002e+006        
assign (residue 72 and name HG#) (residue 73 and name HA)          2.850  1.150  1.150  !  6.170e+006     2   3.085e+006        
assign (residue 58 and name HA) (residue 39 and name HB#)          3.350  1.650  2.150  !  3.210e+006     2   1.605e+006        
assign (residue 92 and name HA) (residue 95 and name HG2#)         3.100  1.400  1.400  !  2.275e+007     3   7.582e+006        
assign (residue 49 and name HB) (residue 51 and name HB#)          3.100  1.400  1.400  !  2.093e+007     3   6.978e+006        
assign (residue 94 and name HB2) (residue 85 and name HD1#)        3.100  1.400  1.400  !  1.889e+007     3   6.298e+006        
assign (residue 7 and name HN) (residue 9 and name HB)             3.350  1.650  2.150  !  5.727e+006     1   5.727e+006  ed EO      
assign (residue 57 and name HD1#) (residue 57 and name HB)         3.600  1.900  2.400  !  6.302e+006     3   2.101e+006        
assign (residue 94 and name HB2) (residue 94 and name HB1)         2.850  1.150  1.150  !  5.813e+006     1   5.813e+006        
assign (residue 49 and name HG2#) (residue 48 and name HB1)        3.600  1.900  2.400  !  1.012e+007     3   3.375e+006ed EO        
assign (residue 98 and name HD1#) (residue 98 and name HD2#)       3.350  1.650  2.150  !  4.543e+007     9   5.048e+006        
assign (residue 94 and name HB1) (residue 85 and name HD1#)        3.100  1.400  1.400  !  4.411e+007     3   1.470e+007        
assign (residue 81 and name HA) (residue 81 and name HD1#)         3.100  1.400  1.400  !  2.198e+007     3   7.327e+006        
assign (residue 68 and name HD2#) (residue 68 and name HD1#)       3.850  2.150  2.150  !  2.099e+007     9   2.332e+006        
!assign (residue 32 and name HN) (residue 35 and name HD1#)         3.600  1.900  2.400  !  4.505e+006     3   1.502e+006        
assign (residue 25 and name HD#) (residue 25 and name HE#)         2.350  0.650  0.650  !  6.738e+007     4   1.685e+007        
assign (residue 94 and name HN) (residue 9 and name HD1#)          3.100  1.400  1.400  !  1.128e+007     3   3.759e+006        
assign (residue 21 and name HN) (residue 21 and name HB#)          3.350  1.650  2.150  !  3.854e+006     2   1.927e+006        
assign (residue 71 and name HB2) (residue 71 and name HB1)         2.850  1.150  1.150  !  6.781e+006     1   6.781e+006        
assign (residue 33 and name HN) (residue 22 and name HA)           3.350  1.650  2.150  !  3.261e+006     1   3.261e+006  ed EO      
assign (residue 74 and name HD1) (residue 74 and name HB1)         3.350  1.650  2.150  !  1.825e+006     1   1.825e+006        
assign (residue 97 and name HD2) (residue 97 and name HB1)         2.850  1.150  1.150  !  5.818e+006     1   5.818e+006        
assign (residue 98 and name HG) (residue 98 and name HD2#)         2.600  0.900  0.900  !  4.369e+007     3   1.456e+007        
assign (residue 6 and name HN) (residue 5 and name HB#)            2.850  1.150  1.150  !  7.633e+006     2   3.816e+006        
assign (residue 35 and name HD1#) (residue 32 and name HD2#)       3.350  1.650  2.150  !  3.021e+007     9   3.356e+006        
assign (residue 67 and name HD1) (residue 67 and name HB2)         3.350  1.650  2.150  !  2.480e+006     1   2.480e+006        
assign (residue 98 and name HB#) (residue 95 and name HA)          3.350  1.650  2.150  !  5.081e+006     2   2.540e+006        
assign (residue 97 and name HD2) (residue 98 and name HD1#)        3.600  1.900  2.400  !  4.094e+006     3   1.365e+006        
assign (residue 3 and name HN) (residue 2 and name HA)             2.350  0.650  0.650  !  1.582e+007     1   1.582e+007        
assign (residue 74 and name HB2) (residue 74 and name HA)          2.850  1.150  1.150  !  6.139e+006     1   6.139e+006        
assign (residue 8 and name HN) (residue 8 and name HB#)            2.350  0.650  0.650  !  1.950e+007     2   9.749e+006        
assign (residue 36 and name HD1) (residue 61 and name HG#)         3.350  1.650  2.150  !  3.643e+006     2   1.822e+006        
assign (residue 65 and name HG1) (residue 95 and name HD1#)        2.600  0.900  0.900  !  2.443e+007     3   8.143e+006        
assign (residue 32 and name HD2#) (residue 98 and name HD2#)       3.850  2.150  2.150  !  3.212e+007     9   3.569e+006 ed EO      
assign (residue 94 and name HG) (residue 68 and name HD2#)         3.100  1.400  1.400  !  1.900e+007     3   6.332e+006        
assign (residue 54 and name HA) (residue 54 and name HB1)          2.850  1.150  1.150  !  5.515e+006     1   5.515e+006        
assign (residue 72 and name HN) (residue 72 and name HA)           2.350  0.650  0.650  !  9.064e+006     1   9.064e+006        
assign (residue 25 and name HG#) (residue 25 and name HA)          2.850  1.150  1.150  !  1.238e+007     2   6.192e+006
assign (residue 93 and name HB#) (residue 96 and name HB#)         3.350  1.650  2.150  !  7.319e+006     6   1.220e+006
assign (residue 98 and name HD1#) (residue 94 and name HA)         3.600  1.900  2.400  !  3.688e+006     3   1.229e+006
assign (residue 78 and name HB) (residue 75 and name HG2#)         3.600  1.900  2.400  !  7.168e+006     3   2.389e+006
assign (residue 91 and name HB#) (residue 95 and name HD1#)        2.850  1.150  1.150  !  2.951e+007     6   4.919e+006
assign (residue 20 and name HG2#) (residue 101 and name HB#)       3.350  1.650  2.150  !  6.642e+007     9   7.380e+006
assign (residue 16 and name HB2) (residue 16 and name HB1)         2.350  0.650  0.650  !  4.888e+007     1   4.888e+007
assign (residue 32 and name HA) (residue 32 and name HD2#)         3.100  1.400  1.400  !  1.376e+007     3   4.586e+006
assign (residue 11 and name HN) (residue 94 and name HD1#)         3.600  1.900  2.400  !  6.887e+006     3   2.296e+006
assign (residue 37 and name HN) (residue 58 and name HG2#)         3.100  1.400  1.400  !  1.159e+007     3   3.862e+006
assign (residue 42 and name HE21) (residue 38 and name HD#)        3.350  1.650  2.150  !  5.923e+006     2   2.962e+006
assign (residue 49 and name HG2#) (residue 49 and name HA)         3.100  1.400  1.400  !  1.837e+007     3   6.122e+006
assign (residue 50 and name HB#) (residue 50 and name HA)          2.350  0.650  0.650  !  2.166e+007     2   1.083e+007
assign (residue 25 and name HN) (residue 25 and name HB#)          2.850  1.150  1.150  !  9.888e+006     2   4.944e+006
assign (residue 98 and name HN) (residue 98 and name HD2#)         3.100  1.400  1.400  !  1.344e+007     3   4.481e+006
assign (residue 100 and name HE#) (residue 3 and name HG2#)        3.350  1.650  2.150  !  1.300e+007     6   2.167e+006
assign (residue 64 and name HA) (residue 59 and name HA)           3.350  1.650  2.150  !  4.218e+006     1   4.218e+006 ed EO
assign (residue 78 and name HA) (residue 49 and name HG2#)         3.600  1.900  2.400  !  9.204e+006     3   3.068e+006
assign (residue 16 and name HA) (residue 16 and name HB2)          2.350  0.650  0.650  !  1.415e+007     1   1.415e+007
assign (residue 77 and name HA2) (residue 77 and name HA1)         2.350  0.650  0.650  !  1.629e+007     1   1.629e+007
assign (residue 9 and name HN) (residue 9 and name HA)             2.850  1.150  1.150  !  4.237e+006     1   4.237e+006
assign (residue 48 and name HB1) (residue 41 and name HA1)         3.350  1.650  2.150  !  2.971e+006     1   2.971e+006
assign (residue 67 and name HD2) (residue 68 and name HA)          2.850  1.150  1.150  !  3.422e+006     1   3.422e+006
assign (residue 25 and name HE#) (residue 19 and name HG2#)        3.350  1.650  2.150  !  5.743e+006     6   9.571e+005
assign (residue 46 and name HB1) (residue 46 and name HA)          2.850  1.150  1.150  !  3.555e+006     1   3.555e+006
assign (residue 58 and name HN) (residue 57 and name HD1#)         3.100  1.400  1.400  !  1.275e+007     3   4.251e+006
assign (residue 57 and name HD1#) (residue 75 and name HD1#)       3.850  2.150  2.150  !  1.842e+006     9   2.047e+005
assign (residue 84 and name HA2) (residue 85 and name HD1#)        3.600  1.900  2.400  !  5.075e+006     3   1.692e+006
assign (residue 58 and name HA) (residue 39 and name HA)           2.850  1.150  1.150  !  5.800e+006     1   5.800e+006
assign (residue 79 and name HA) (residue 78 and name HA)           3.350  1.650  1.650  !  8.308e+006     1   8.308e+006 ed EO
assign (residue 38 and name HN) (residue 35 and name HA)           2.850  1.150  1.150  !  6.502e+006     1   6.502e+006
assign (residue 56 and name HN) (residue 56 and name HA2)          2.850  1.150  1.150  !  6.278e+006     1   6.278e+006
assign (residue 35 and name HA) (residue 35 and name HB#)          3.350  1.650  2.150  !  5.275e+006     2   2.638e+006
assign (residue 102 and name HA) (residue 20 and name HG1#)        3.600  1.900  2.400  !  6.048e+006     3   2.016e+006
assign (residue 94 and name HB1) (residue 94 and name HB2)         2.850  1.150  1.150  !  5.512e+006     1   5.512e+006
assign (residue 79 and name HN) (residue 49 and name HG2#)         3.100  1.400  1.400  !  2.085e+007     3   6.949e+006
assign (residue 15 and name HN) (residue 15 and name HA)           2.850  1.150  1.150  !  6.567e+006     1   6.567e+006
assign (residue 90 and name HN) (residue 90 and name HG#)          2.850  1.150  1.150  !  6.223e+006     2   3.112e+006
assign (residue 35 and name HN) (residue 35 and name HD2#)         3.600  1.900  2.400  !  6.024e+006     3   2.008e+006
assign (residue 79 and name HN) (residue 78 and name HA)           2.850  1.150  1.150  !  5.506e+006     1   5.506e+006
assign (residue 59 and name HB2) (residue 64 and name HD1#)        3.600  1.900  2.400  !  8.723e+006     3   2.908e+006
!assign (residue 60 and name HN) (residue 63 and name HG2#)         3.100  1.400  1.400  !  1.625e+007     3   5.416e+006
assign (residue 12 and name HN) (residue 11 and name HG1#)         3.100  1.400  1.400  !  1.353e+007     3   4.510e+006
assign (residue 75 and name HG2#) (residue 51 and name HB#)        3.350  1.650  2.150  !  5.355e+007     9   5.950e+006
assign (residue 8 and name HA) (residue 8 and name HB#)            2.350  0.650  0.650  !  2.598e+007     2   1.299e+007
assign (residue 100 and name HN) (residue 98 and name HA)          3.350  1.650  2.150  !  2.203e+006     1   2.203e+006
assign (residue 19 and name HB) (residue 31 and name HB2)          2.850  1.150  1.150  !  5.098e+006     1   5.098e+006
assign (residue 96 and name HN) (residue 95 and name HB)           2.850  1.150  1.150  !  3.638e+006     1   3.638e+006
assign (residue 58 and name HN) (residue 58 and name HB)           2.350  0.650  0.650  !  1.289e+007     1   1.289e+007
assign (residue 49 and name HN) (residue 49 and name HG2#)         3.100  1.400  1.400  !  1.696e+007     3   5.654e+006
assign (residue 91 and name HN) (residue 85 and name HD1#)         3.600  1.900  2.400  !  3.168e+006     3   1.056e+006
assign (residue 47 and name HN) (residue 46 and name HA)           2.350  0.650  0.650  !  9.391e+006     1   9.391e+006
assign (residue 64 and name HD2#) (residue 64 and name HB#)        3.350  1.650  2.150  !  4.265e+006     6   7.109e+005
assign (residue 64 and name HG) (residue 64 and name HD1#)         2.600  0.900  0.900  !  3.680e+007     3   1.227e+007
assign (residue 6 and name HA2) (residue 94 and name HA)           2.850  1.150  1.150  !  6.996e+006     1   6.996e+006
assign (residue 73 and name HG#) (residue 73 and name HA)          2.850  1.150  1.150  !  1.526e+007     2   7.631e+006
assign (residue 81 and name HB) (residue 81 and name HG2#)         2.600  0.900  0.900  !  6.886e+007     3   2.295e+007
assign (residue 51 and name HA) (residue 54 and name HB1)          3.350  1.650  2.150  !  3.008e+006     1   3.008e+006
assign (residue 49 and name HN) (residue 78 and name HA)           2.850  1.150  1.150  !  4.130e+006     1   4.130e+006
assign (residue 95 and name HD1#) (residue 65 and name HE#)        3.850  2.150  2.150  !  2.295e+007     9   2.550e+006
!assign (residue 57 and name HG2#) (residue 63 and name HG2#)       3.850  2.150  2.150  !  1.933e+007     9   2.148e+006
assign (residue 39 and name HN) (residue 39 and name HB#)          2.350  0.650  0.650  !  1.807e+007     2   9.034e+006
assign (residue 65 and name HN) (residue 65 and name HE#)          3.600  1.900  2.400  !  2.580e+007     3   8.600e+006
assign (residue 16 and name HG1) (residue 15 and name HB#)         3.600  1.900  2.400  !  7.187e+006     3   2.396e+006
assign (residue 57 and name HG2#) (residue 57 and name HG12)       3.100  1.400  1.400  !  1.357e+007     3   4.524e+006
assign (residue 64 and name HG) (residue 63 and name HB)           3.350  1.650  2.150  !  2.754e+006     1   2.754e+006
assign (residue 79 and name HD#) (residue 79 and name HA)          2.850  1.150  1.150  !  1.381e+007     2   6.907e+006
assign (residue 103 and name HD21) (residue 103 and name HB1)      2.850  1.150  1.150  !  7.909e+006     1   7.909e+006 ed EO
assign (residue 11 and name HN) (residue 7 and name HA)            3.350  1.650  2.150  !  1.298e+006     1   1.298e+006
assign (residue 68 and name HD2#) (residue 68 and name HA)         3.600  1.900  2.400  !  8.096e+006     3   2.699e+006
assign (residue 78 and name HB) (residue 75 and name HD1#)         3.600  1.900  2.400  !  2.804e+006     3   9.347e+005
assign (residue 10 and name HN) (residue 9 and name HA)            3.350  1.650  2.150  !  2.557e+006     1   2.557e+006
assign (residue 26 and name HB2) (residue 26 and name HB1)         2.350  0.650  0.650  !  7.878e+006     1   7.878e+006
assign (residue 32 and name HN) (residue 20 and name HG1#)         3.600  1.900  2.400  !  6.525e+006     3   2.175e+006
assign (residue 99 and name HB#) (residue 99 and name HA)          3.350  1.650  2.150  !  4.349e+006     2   2.174e+006
assign (residue 60 and name HE#) (residue 58 and name HG2#)        3.350  1.650  2.150  !  9.109e+006     6   1.518e+006
assign (residue 42 and name HN) (residue 41 and name HA2)          2.850  1.150  1.150  !  3.344e+006     1   3.344e+006
assign (residue 9 and name HG12) (residue 9 and name HA)           2.850  1.150  1.150  !  6.565e+006     1   6.565e+006
assign (residue 35 and name HN) (residue 36 and name HB2)          3.350  1.650  2.150  !  3.245e+006     1   3.245e+006 ed EO
assign (residue 13 and name HB#) (residue 13 and name HE#)         3.350  1.650  2.150  !  5.090e+007     4   1.272e+007 ed EO
assign (residue 68 and name HA) (residue 68 and name HB#)          2.350  0.650  0.650  !  2.087e+007     2   1.043e+007
assign (residue 9 and name HD1#) (residue 9 and name HG2#)         3.350  1.650  2.150  !  6.145e+007     9   6.828e+006
assign (residue 74 and name HN) (residue 72 and name HA)           3.350  1.650  2.150  !  2.820e+006     1   2.820e+006
assign (residue 87 and name HN) (residue 90 and name HG#)          2.850  1.150  1.150  !  6.769e+006     2   3.385e+006
assign (residue 20 and name HN) (residue 20 and name HG2#)         2.850  1.150  1.150  !  3.622e+007     3   1.207e+007 ed EO
assign (residue 75 and name HD1#) (residue 75 and name HG2#)       3.350  1.650  2.150  !  3.128e+007     9   3.476e+006
assign (residue 5 and name HN) (residue 2 and name HB1)            2.850  1.150  1.150  !  3.973e+006     1   3.973e+006
assign (residue 4 and name HN) (residue 3 and name HA)             2.850  1.150  1.150  !  6.631e+006     1   6.631e+006
!assign (residue 10 and name HB1) (residue 9 and name HG2#)         3.600  1.900  2.400  !  1.011e+007     3   3.369e+006 ed EO
assign (residue 98 and name HA) (residue 98 and name HD2#)         2.600  0.900  0.900  !  3.230e+007     3   1.077e+007
assign (residue 13 and name HE#) (residue 13 and name HA)          3.350  1.650  2.150  !  4.332e+006     2   2.166e+006
assign (residue 35 and name HA) (residue 35 and name HD1#)         3.100  1.400  1.400  !  2.213e+007     3   7.376e+006
assign (residue 12 and name HN) (residue 10 and name HA)           3.350  1.650  2.150  !  2.602e+006     1   2.602e+006
assign (residue 69 and name HB#) (residue 69 and name HG#)         2.850  1.150  1.150  !  2.326e+007     4   5.814e+006
assign (residue 58 and name HG2#) (residue 58 and name HB)         3.100  1.400  1.400  !  1.935e+007     3   6.451e+006
assign (residue 94 and name HB1) (residue 95 and name HA)          2.850  1.150  1.150  !  4.008e+006     1   4.008e+006
assign (residue 5 and name HN) (residue 5 and name HA)             2.350  0.650  0.650  !  1.203e+007     1   1.203e+007
assign (residue 75 and name HG2#) (residue 75 and name HD1#)       3.350  1.650  2.150  !  3.937e+007     9   4.375e+006
assign (residue 12 and name HE21) (residue 12 and name HG1)        2.850  1.150  1.150  !  4.347e+006     1   4.347e+006
assign (residue 45 and name HN) (residue 45 and name HA2)          3.350  1.650  2.150  !  1.441e+006     1   1.441e+006
assign (residue 20 and name HB) (residue 21 and name HA)           3.350  1.650  2.150  !  1.583e+007     1   1.583e+007 ed EO
assign (residue 95 and name HG2#) (residue 95 and name HA)         3.600  1.900  2.400  !  7.230e+006     3   2.410e+006
assign (residue 97 and name HD1) (residue 3 and name HG2#)         3.600  1.900  2.400  !  7.118e+006     3   2.373e+006
assign (residue 68 and name HA) (residue 68 and name HD2#)         3.100  1.400  1.400  !  1.861e+007     3   6.204e+006
assign (residue 3 and name HB) (residue 2 and name HA)             3.350  1.650  2.150  !  5.254e+006     1   5.254e+006
assign (residue 57 and name HG12) (residue 40 and name HG2#)       3.100  1.400  1.400  !  5.031e+007     3   1.677e+007ed EO
assign (residue 90 and name HN) (residue 89 and name HB)           2.850  1.150  1.150  !  7.035e+006     1   7.035e+006
assign (residue 57 and name HD1#) (residue 63 and name HA)         3.600  1.900  2.400  !  2.227e+006     3   7.423e+005
assign (residue 58 and name HG2#) (residue 38 and name HA)         3.600  1.900  2.400  !  4.563e+006     3   1.521e+006
assign (residue 29 and name HN) (residue 30 and name HA)           3.350  1.650  2.150  !  3.434e+006     1   3.434e+006 ed EO
assign (residue 101 and name HN) (residue 101 and name HB#)        2.600  0.900  0.900  !  4.307e+007     3   1.436e+007
assign (residue 15 and name HN) (residue 15 and name HB#)          2.600  0.900  0.900  !  4.452e+007     3   1.484e+007
assign (residue 64 and name HD2#) (residue 35 and name HD1#)       3.850  2.150  2.150  !  6.406e+006     9   7.118e+005
assign (residue 82 and name HN) (residue 81 and name HA)           2.350  0.650  0.650  !  1.073e+007     1   1.073e+007
assign (residue 103 and name HN) (residue 103 and name HB2)        2.350  0.650  0.650  !  1.373e+007     1   1.373e+007
!assign (residue 60 and name HB#) (residue 58 and name HG2#)        3.350  1.650  2.150  !  9.222e+006     6   1.537e+006
assign (residue 93 and name HA) (residue 96 and name HB#)          3.600  1.900  2.400  !  4.381e+006     3   1.460e+006
assign (residue 17 and name HA) (residue 28 and name HA)           3.350  1.650  2.150  !  3.951e+006     1   3.951e+006 ed EO
assign (residue 20 and name HG2#) (residue 19 and name HA)         3.600  1.900  2.400  !  4.902e+006     3   1.634e+006
assign (residue 23 and name HA1) (residue 23 and name HA2)         2.350  0.650  0.650  !  9.213e+006     1   9.213e+006
assign (residue 39 and name HD#) (residue 58 and name HB)          3.350  1.650  2.150  !  3.871e+006     2   1.936e+006
assign (residue 19 and name HN) (residue 20 and name HG1#)         3.600  1.900  2.400  !  2.269e+006     3   7.562e+005
assign (residue 27 and name HE#) (residue 19 and name HG2#)        3.350  1.650  2.150  !  1.163e+007     6   1.939e+006
assign (residue 37 and name HN) (residue 36 and name HA)           2.350  0.650  0.650  !  1.763e+007     1   1.763e+007
assign (residue 95 and name HG12) (residue 68 and name HB#)        3.350  1.650  2.150  !  2.043e+007     2   1.021e+007 ed EO
assign (residue 102 and name HA) (residue 101 and name HB#)        3.600  1.900  2.400  !  7.152e+006     3   2.384e+006
assign (residue 101 and name HA) (residue 102 and name HG2#)       3.600  1.900  2.400  !  1.783e+007     3   5.942e+006
assign (residue 64 and name HN) (residue 64 and name HD1#)         3.600  1.900  2.400  !  8.112e+006     3   2.704e+006
assign (residue 101 and name HN) (residue 98 and name HA)          3.350  1.650  2.150  !  1.743e+006     1   1.743e+006
assign (residue 68 and name HD1#) (residue 94 and name HB1)        3.600  1.900  2.400  !  3.868e+006     3   1.289e+006
assign (residue 3 and name HB) (residue 3 and name HG2#)           2.600  0.900  0.900  !  7.473e+007     3   2.491e+007
assign (residue 65 and name HA) (residue 66 and name HA)           3.350  1.650  2.150  !  2.448e+006     1   2.448e+006
assign (residue 7 and name HB#) (residue 7 and name HA)            2.850  1.150  1.150  !  6.918e+006     2   3.459e+006
assign (residue 36 and name HB2) (residue 36 and name HB1)         2.350  0.650  0.650  !  1.457e+007     1   1.457e+007
assign (residue 77 and name HA1) (residue 77 and name HA2)         2.350  0.650  0.650  !  2.146e+007     1   2.146e+007
assign (residue 97 and name HB1) (residue 96 and name HB#)         3.600  1.900  2.400  !  4.334e+006     3   1.445e+006
assign (residue 104 and name HG#) (residue 101 and name HA)        2.850  1.150  1.150  !  8.638e+006     2   4.319e+006
assign (residue 74 and name HD2) (residue 75 and name HG2#)        3.600  1.900  2.400  !  2.582e+006     3   8.606e+005
assign (residue 6 and name HN) (residue 9 and name HD1#)           3.600  1.900  2.400  !  5.124e+006     3   1.708e+006
assign (residue 42 and name HN) (residue 38 and name HD#)          3.350  1.650  2.150  !  4.763e+006     2   2.381e+006
assign (residue 57 and name HG2#) (residue 57 and name HD1#)       3.350  1.650  2.150  !  6.114e+007     9   6.793e+006
assign (residue 57 and name HD1#) (residue 58 and name HG2#)       3.850  2.150  2.150  !  3.502e+006     9   3.891e+005
assign (residue 96 and name HN) (residue 96 and name HA)           2.350  0.650  0.650  !  8.657e+006     1   8.657e+006
assign (residue 59 and name HB1) (residue 35 and name HD1#)        3.100  1.400  1.400  !  1.685e+007     3   5.617e+006
assign (residue 89 and name HG2#) (residue 89 and name HA)         3.100  1.400  1.400  !  1.428e+007     3   4.758e+006
assign (residue 72 and name HG#) (residue 72 and name HE#)         2.850  1.150  1.150  !  6.791e+007     4   1.698e+007 ed EO
!assign (residue 80 and name HN) (residue 81 and name HG2#)         3.600  1.900  2.400  !  2.888e+006     3   9.627e+005
assign (residue 88 and name HG#) (residue 88 and name HA)          3.350  1.650  2.150  !  5.956e+006     2   2.978e+006
assign (residue 19 and name HA) (residue 19 and name HB)           2.350  0.650  0.650  !  7.734e+006     1   7.734e+006
assign (residue 72 and name HD#) (residue 76 and name HA)          3.350  1.650  2.150  !  8.892e+006     2   4.446e+006 ed EO
assign (residue 31 and name HA) (residue 32 and name HD2#)         3.100  1.400  1.400  !  1.006e+007     3   3.353e+006
assign (residue 37 and name HN) (residue 38 and name HA)           3.350  1.650  2.150  !  2.738e+006     1   2.738e+006
assign (residue 64 and name HN) (residue 62 and name HA)           2.850  1.150  1.150  !  5.123e+006     1   5.123e+006
assign (residue 11 and name HA) (residue 11 and name HB)           2.350  0.650  0.650  !  1.190e+007     1   1.190e+007
assign (residue 13 and name HN) (residue 15 and name HB#)          3.600  1.900  2.400  !  5.202e+006     3   1.734e+006
assign (residue 71 and name HD1) (residue 84 and name HA2)         3.350  1.650  2.150  !  3.039e+006     1   3.039e+006
assign (residue 12 and name HN) (residue 12 and name HG2)          2.350  0.650  0.650  !  7.993e+006     1   7.993e+006
assign (residue 96 and name HB#) (residue 1 and name HA1)          3.600  1.900  2.400  !  4.152e+006     3   1.384e+006
assign (residue 46 and name HB2) (residue 46 and name HB1)         2.850  1.150  1.150  !  5.175e+006     1   5.175e+006
assign (residue 52 and name HD22) (residue 75 and name HG2#)       3.600  1.900  2.400  !  5.500e+006     3   1.833e+006
assign (residue 5 and name HN) (residue 3 and name HG1#)           3.600  1.900  2.400  !  2.344e+007     3   7.814e+006 ed EO
assign (residue 4 and name HA) (residue 3 and name HA)             3.350  1.650  2.150  !  5.135e+006     1   5.135e+006
assign (residue 71 and name HB2) (residue 71 and name HA)          2.850  1.150  1.150  !  4.624e+006     1   4.624e+006
assign (residue 1 and name HA1) (residue 1 and name HA2)           2.350  0.650  0.650  !  1.231e+007     1   1.231e+007
assign (residue 38 and name HA) (residue 38 and name HD#)          3.350  1.650  2.150  !  3.862e+006     2   1.931e+006
assign (residue 22 and name HN) (residue 22 and name HA)           2.850  1.150  1.150  !  4.320e+006     1   4.320e+006
assign (residue 9 and name HG2#) (residue 9 and name HB)           3.100  1.400  1.400  !  1.296e+007     3   4.321e+006
assign (residue 46 and name HB2) (residue 46 and name HA)          2.850  1.150  1.150  !  3.617e+006     1   3.617e+006
assign (residue 53 and name HB#) (residue 54 and name HA)          3.350  1.650  2.150  !  6.380e+006     2   3.190e+006 ed EO
assign (residue 46 and name HB1) (residue 46 and name HB2)         2.850  1.150  1.150  !  7.517e+006     1   7.517e+006
assign (residue 41 and name HN) (residue 75 and name HD1#)         3.600  1.900  2.400  !  2.364e+006     3   7.879e+005
assign (residue 90 and name HG#) (residue 9 and name HD1#)         2.850  1.150  1.150  !  2.885e+007     6   4.808e+006
assign (residue 66 and name HN) (residue 95 and name HD1#)         3.600  1.900  2.400  !  5.486e+006     3   1.829e+006
assign (residue 40 and name HN) (residue 58 and name HG2#)         3.600  1.900  2.400  !  3.060e+006     3   1.020e+006
assign (residue 62 and name HN) (residue 62 and name HA)           2.350  0.650  0.650  !  7.874e+006     1   7.874e+006
assign (residue 13 and name HN) (residue 11 and name HA)           3.350  1.650  2.150  !  2.323e+006     1   2.323e+006
assign (residue 104 and name HN) (residue 103 and name HB1)        2.850  1.150  1.150  !  4.809e+006     1   4.809e+006
assign (residue 100 and name HN) (residue 100 and name HA)         2.350  0.650  0.650  !  1.290e+007     1   1.290e+007
assign (residue 99 and name HD#) (residue 99 and name HA)          3.350  1.650  2.150  !  3.975e+006     2   1.988e+006
assign (residue 94 and name HD2#) (residue 9 and name HB)          3.600  1.900  2.400  !  2.567e+006     3   8.558e+005
assign (residue 22 and name HB#) (residue 22 and name HA)          3.350  1.650  2.150  !  5.890e+006     2   2.945e+006
assign (residue 79 and name HN) (residue 78 and name HG2#)         3.600  1.900  2.400  !  5.922e+006     3   1.974e+006
assign (residue 24 and name HA1) (residue 19 and name HG2#)        3.600  1.900  2.400  !  2.403e+006     3   8.009e+005
assign (residue 21 and name HN) (residue 21 and name HG#)          2.850  1.150  1.150  !  6.823e+006     2   3.412e+006
assign (residue 11 and name HA) (residue 11 and name HG1#)         2.600  0.900  0.900  !  3.773e+007     3   1.258e+007
assign (residue 35 and name HA) (residue 35 and name HD2#)         3.600  1.900  2.400  !  6.925e+006     3   2.308e+006
assign (residue 20 and name HB) (residue 20 and name HG2#)         2.600  0.900  0.900  !  5.340e+007     3   1.780e+007
assign (residue 14 and name HN) (residue 14 and name HB2)          2.850  1.150  1.150  !  5.772e+006     1   5.772e+006
assign (residue 66 and name HN) (residue 62 and name HA)           3.350  1.650  2.150  !  3.215e+006     1   3.215e+006 ed EO
!assign (residue 60 and name HN) (residue 63 and name HA)           3.350  1.650  2.150  !  3.631e+006     1   3.631e+006 ed EO
assign (residue 104 and name HN) (residue 101 and name HB#)        3.600  1.900  2.400  !  3.655e+006     3   1.218e+006
assign (residue 17 and name HA) (residue 28 and name HG2#)         3.600  1.900  2.400  !  4.677e+006     3   1.559e+006
assign (residue 60 and name HN) (residue 57 and name HD1#)         3.600  1.900  2.400  !  6.278e+006     3   2.093e+006
assign (residue 82 and name HD#) (residue 13 and name HA)          3.350  1.650  2.150  !  3.042e+006     2   1.521e+006
assign (residue 64 and name HN) (residue 64 and name HD2#)         3.600  1.900  2.400  !  6.945e+006     3   2.315e+006
assign (residue 70 and name HN) (residue 71 and name HD2)          3.350  1.650  2.150  !  2.473e+006     1   2.473e+006
assign (residue 5 and name HE#) (residue 2 and name HA)            3.350  1.650  2.150  !  1.521e+007     2   7.605e+006 ed EO
assign (residue 68 and name HD1#) (residue 68 and name HD2#)       3.850  2.150  2.150  !  2.660e+007     9   2.956e+006
assign (residue 57 and name HD1#) (residue 63 and name HG2#)       3.850  2.150  2.150  !  2.349e+007     9   2.610e+006
assign (residue 13 and name HA) (residue 13 and name HB#)          3.350  1.650  2.150  !  3.551e+006     2   1.775e+006
assign (residue 10 and name HD2) (residue 10 and name HB2)         2.850  1.150  1.150  !  3.134e+006     1   3.134e+006
!assign (residue 48 and name HB2) (residue 42 and name HA)          3.350  1.650  2.150  !  3.878e+006     1   3.878e+006 ed EO
assign (residue 35 and name HD2#) (residue 64 and name HD2#)       3.850  2.150  2.150  !  2.282e+007     9   2.535e+006
assign (residue 4 and name HB#) (residue 4 and name HA)            2.350  0.650  0.650  !  2.718e+007     2   1.359e+007
assign (residue 37 and name HN) (residue 36 and name HB2)          3.350  1.650  2.150  !  2.186e+006     1   2.186e+006
assign (residue 46 and name HB1) (residue 43 and name HB#)         3.600  1.900  2.400  !  5.890e+006     3   1.963e+006
assign (residue 68 and name HA) (residue 68 and name HD1#)         3.600  1.900  2.400  !  5.181e+006     3   1.727e+006
assign (residue 28 and name HG2#) (residue 28 and name HB)         3.100  1.400  1.400  !  9.950e+006     3   3.317e+006
assign (residue 19 and name HG2#) (residue 19 and name HA)         3.100  1.400  1.400  !  9.322e+006     3   3.107e+006
assign (residue 81 and name HN) (residue 81 and name HB)           2.850  1.150  1.150  !  6.782e+006     1   6.782e+006
assign (residue 98 and name HD2#) (residue 32 and name HB2)        3.600  1.900  2.400  !  2.659e+006     3   8.863e+005
assign (residue 72 and name HD#) (residue 78 and name HG2#)        3.350  1.650  2.150  !  6.475e+006     6   1.079e+006
assign (residue 100 and name HB#) (residue 97 and name HA)         3.350  1.650  2.150  !  4.666e+006     2   2.333e+006
assign (residue 73 and name HE#) (residue 73 and name HA)          3.350  1.650  2.150  !  2.801e+006     2   1.400e+006
assign (residue 41 and name HN) (residue 40 and name HA)           2.350  0.650  0.650  !  1.011e+007     1   1.011e+007
assign (residue 78 and name HN) (residue 49 and name HB)           3.350  1.650  2.150  !  9.283e+006     1   9.283e+006
assign (residue 36 and name HD1) (residue 60 and name HA)          2.850  1.150  1.150  !  4.339e+006     1   4.339e+006
assign (residue 78 and name HG2#) (residue 79 and name HA)         3.600  1.900  2.400  !  2.461e+006     3   8.205e+005
assign (residue 28 and name HA) (residue 28 and name HG2#)         2.600  0.900  0.900  !  6.680e+007     3   2.227e+007
assign (residue 79 and name HN) (residue 79 and name HA)           2.850  1.150  1.150  !  5.152e+006     1   5.152e+006
assign (residue 54 and name HA) (residue 54 and name HB2)          2.850  1.150  1.150  !  7.455e+006     1   7.455e+006
assign (residue 64 and name HD1#) (residue 35 and name HD2#)       3.850  2.150  2.150  !  1.371e+007     9   1.523e+006
assign (residue 78 and name HB) (residue 78 and name HG2#)         3.100  1.400  1.400  !  1.371e+007     3   4.569e+006
assign (residue 52 and name HD22) (residue 75 and name HD1#)       3.100  1.400  1.400  !  1.276e+007     3   4.254e+006
assign (residue 89 and name HB) (residue 89 and name HG2#)         2.600  0.900  0.900  !  7.757e+007     3   2.586e+007
assign (residue 25 and name HB#) (residue 25 and name HA)          2.850  1.150  1.150  !  1.382e+007     2   6.908e+006
assign (residue 57 and name HA) (residue 57 and name HB)           2.350  0.650  0.650  !  8.950e+006     1   8.950e+006
assign (residue 98 and name HA) (residue 98 and name HD1#)         3.600  1.900  2.400  !  5.959e+006     3   1.986e+006
assign (residue 32 and name HN) (residue 32 and name HB2)          3.350  1.650  2.150  !  1.758e+006     1   1.758e+006
assign (residue 33 and name HN) (residue 32 and name HA)           3.350  1.650  2.150  !  2.427e+006     1   2.427e+006
assign (residue 80 and name HN) (residue 79 and name HA)           2.850  1.150  1.150  !  4.286e+006     1   4.286e+006
assign (residue 51 and name HA) (residue 54 and name HB2)          2.850  1.150  1.150  !  3.572e+006     1   3.572e+006
assign (residue 35 and name HD2#) (residue 35 and name HB#)        3.350  1.650  2.150  !  3.442e+006     6   5.736e+005
assign (residue 59 and name HN) (residue 59 and name HA)           2.850  1.150  1.150  !  5.010e+006     1   5.010e+006
assign (residue 64 and name HB#) (residue 68 and name HD1#)        3.350  1.650  2.150  !  4.423e+006     6   7.371e+005
assign (residue 97 and name HD2) (residue 20 and name HG1#)        3.600  1.900  2.400  !  6.057e+006     3   2.019e+006
assign (residue 20 and name HA) (residue 20 and name HG2#)         2.600  0.900  0.900  !  2.851e+007     3   9.502e+006
assign (residue 103 and name HA) (residue 103 and name HB1)        2.350  0.650  0.650  !  3.916e+007     1   3.916e+007
assign (residue 12 and name HA) (residue 12 and name HG1)          2.850  1.150  1.150  !  7.642e+006     1   7.642e+006
assign (residue 20 and name HB) (residue 20 and name HA)           2.350  0.650  0.650  !  9.964e+006     1   9.964e+006
assign (residue 68 and name HB#) (residue 68 and name HD2#)        3.350  1.650  2.150  !  5.448e+006     6   9.080e+005
assign (residue 9 and name HA) (residue 12 and name HG1)           2.850  1.150  1.150  !  4.205e+006     1   4.205e+006
assign (residue 72 and name HD#) (residue 72 and name HA)          2.850  1.150  1.150  !  9.108e+006     2   4.554e+006
assign (residue 57 and name HG2#) (residue 57 and name HB)         3.100  1.400  1.400  !  1.590e+007     3   5.300e+006
assign (residue 90 and name HN) (residue 89 and name HA)           3.350  1.650  2.150  !  2.912e+006     1   2.912e+006
assign (residue 55 and name HN) (residue 54 and name HB1)          2.850  1.150  1.150  !  5.681e+006     1   5.681e+006
assign (residue 57 and name HN) (residue 57 and name HD1#)         3.100  1.400  1.400  !  1.457e+007     3   4.856e+006
assign (residue 102 and name HA) (residue 102 and name HG2#)       2.600  0.900  0.900  !  2.325e+007     3   7.751e+006
assign (residue 67 and name HD1) (residue 74 and name HA)          3.350  1.650  2.150  !  3.720e+006     1   3.720e+006 ed EO
assign (residue 49 and name HB) (residue 49 and name HG2#)         2.600  0.900  0.900  !  2.387e+007     3   7.956e+006
assign (residue 59 and name HD1) (residue 59 and name HA)          3.350  1.650  2.150  !  4.637e+006     1   4.637e+006 ed EO
assign (residue 49 and name HG2#) (residue 78 and name HB)         3.600  1.900  2.400  !  2.576e+006     3   8.585e+005
assign (residue 3 and name HG1#) (residue 2 and name HA)           3.600  1.900  2.400  !  4.276e+006     3   1.425e+006
assign (residue 48 and name HN) (residue 47 and name HB)           3.350  1.650  2.150  !  3.759e+006     1   3.759e+006 ed EO
!assign (residue 67 and name HD1) (residue 40 and name HG2#)        3.600  1.900  2.400  !  4.384e+006     3   1.461e+006
assign (residue 35 and name HG) (residue 35 and name HD2#)         3.100  1.400  1.400  !  1.569e+007     3   5.230e+006
assign (residue 97 and name HB2) (residue 97 and name HB1)         2.850  1.150  1.150  !  6.360e+006     1   6.360e+006
assign (residue 13 and name HG#) (residue 13 and name HA)          2.850  1.150  1.150  !  6.286e+006     2   3.143e+006
assign (residue 68 and name HD1#) (residue 95 and name HD1#)       3.850  2.150  2.150  !  2.164e+007     9   2.405e+006
assign (residue 9 and name HA) (residue 9 and name HG2#)           2.600  0.900  0.900  !  2.686e+007     3   8.955e+006
assign (residue 72 and name HD#) (residue 72 and name HG#)         2.350  0.650  0.650  !  3.907e+007     4   9.768e+006
assign (residue 85 and name HG2#) (residue 85 and name HD1#)       2.850  1.150  1.150  !  7.752e+007     9   8.614e+006
!assign (residue 62 and name HN) (residue 60 and name HG#)          3.350  1.650  2.150  !  2.007e+006     2   1.003e+006
assign (residue 53 and name HN) (residue 53 and name HG#)          2.850  1.150  1.150  !  1.423e+007     2   7.113e+006
assign (residue 68 and name HD1#) (residue 98 and name HD1#)       3.850  2.150  2.150  !  1.139e+007     9   1.266e+006
assign (residue 50 and name HN) (residue 50 and name HA)           2.350  0.650  0.650  !  2.499e+007     1   2.499e+007
assign (residue 62 and name HA) (residue 65 and name HE#)          3.100  1.400  1.400  !  1.454e+007     3   4.848e+006
assign (residue 24 and name HA2) (residue 24 and name HA1)         2.350  0.650  0.650  !  1.120e+007     1   1.120e+007
assign (residue 62 and name HN) (residue 61 and name HB#)          3.350  1.650  2.150  !  5.695e+006     2   2.847e+006
assign (residue 94 and name HD1#) (residue 91 and name HA)         3.600  1.900  2.400  !  7.782e+006     3   2.594e+006
assign (residue 24 and name HA1) (residue 24 and name HA2)         2.350  0.650  0.650  !  1.393e+007     1   1.393e+007
assign (residue 8 and name HB#) (residue 11 and name HG2#)         3.350  1.650  2.150  !  6.913e+006     6   1.152e+006
assign (residue 35 and name HD1#) (residue 35 and name HB#)        3.350  1.650  2.150  !  4.376e+006     6   7.293e+005
assign (residue 67 and name HD2) (residue 68 and name HD2#)        3.600  1.900  2.400  !  2.042e+006     3   6.806e+005
assign (residue 74 and name HN) (residue 74 and name HB1)          3.350  1.650  2.150  !  2.656e+006     1   2.656e+006
assign (residue 23 and name HA2) (residue 23 and name HA1)         2.350  0.650  0.650  !  1.169e+007     1   1.169e+007
assign (residue 11 and name HG2#) (residue 11 and name HG1#)       2.850  1.150  1.150  !  8.072e+007     9   8.969e+006
assign (residue 69 and name HA) (residue 69 and name HG#)          2.850  1.150  1.150  !  1.895e+007     2   9.475e+006 ed EO
assign (residue 102 and name HN) (residue 102 and name HB)         2.850  1.150  1.150  !  4.209e+006     1   4.209e+006
assign (residue 103 and name HD22) (residue 103 and name HB1)      2.850  1.150  1.150  !  1.093e+007     1   1.093e+007 ed EO
assign (residue 2 and name HB1) (residue 2 and name HB2)           2.350  0.650  0.650  !  1.555e+007     1   1.555e+007
assign (residue 81 and name HD1#) (residue 79 and name HA)         3.600  1.900  2.400  !  4.949e+006     3   1.650e+006
!assign (residue 92 and name HG#) (residue 89 and name HB)          3.350  1.650  2.150  !  2.365e+006     2   1.183e+006
assign (residue 95 and name HG2#) (residue 61 and name HG#)        3.350  1.650  2.150  !  9.107e+006     6   1.518e+006
assign (residue 53 and name HB#) (residue 48 and name HB1)         3.350  1.650  2.150  !  2.581e+007     2   1.290e+007 ed EO
assign (residue 35 and name HD2#) (residue 59 and name HB2)        3.600  1.900  2.400  !  1.887e+006     3   6.291e+005
assign (residue 40 and name HB) (residue 40 and name HA)           2.350  0.650  0.650  !  1.324e+007     1   1.324e+007
assign (residue 91 and name HD#) (residue 68 and name HA)          3.350  1.650  2.150  !  2.019e+006     2   1.010e+006
assign (residue 20 and name HN) (residue 20 and name HA)           2.850  1.150  1.150  !  3.839e+006     1   3.839e+006
assign (residue 22 and name HE#) (residue 22 and name HB#)         3.350  1.650  2.150  !  4.546e+006     4   1.136e+006
assign (residue 9 and name HN) (residue 94 and name HD1#)          3.100  1.400  1.400  !  1.367e+007     3   4.557e+006
assign (residue 94 and name HD1#) (residue 94 and name HA)         3.100  1.400  1.400  !  1.014e+007     3   3.379e+006
assign (residue 16 and name HA) (residue 16 and name HB1)          2.350  0.650  0.650  !  1.143e+007     1   1.143e+007
assign (residue 75 and name HG2#) (residue 78 and name HG2#)       3.850  2.150  2.150  !  4.065e+006     9   4.517e+005
assign (residue 48 and name HN) (residue 47 and name HG2#)         3.350  1.650  2.150  !  1.621e+007     3   5.402e+006 ed EO
assign (residue 78 and name HA) (residue 78 and name HG2#)         2.600  0.900  0.900  !  2.525e+007     3   8.416e+006
assign (residue 94 and name HD2#) (residue 68 and name HD1#)       3.850  2.150  2.150  !  2.578e+007     9   2.864e+006
assign (residue 32 and name HD1#) (residue 64 and name HD1#)       3.850  2.150  2.150  !  8.138e+006     9   9.042e+005
assign (residue 98 and name HG) (residue 98 and name HD1#)         2.600  0.900  0.900  !  2.350e+007     3   7.834e+006
assign (residue 82 and name HN) (residue 81 and name HD1#)         3.600  1.900  2.400  !  6.938e+006     3   2.313e+006
assign (residue 85 and name HA) (residue 85 and name HD1#)         3.100  1.400  1.400  !  9.669e+006     3   3.223e+006
assign (residue 19 and name HA) (residue 20 and name HG1#)         3.600  1.900  2.400  !  4.529e+006     3   1.510e+006
assign (residue 19 and name HB) (residue 21 and name HB#)          3.350  1.650  2.150  !  3.800e+006     2   1.900e+006
assign (residue 48 and name HA) (residue 48 and name HB2)          3.350  1.650  2.150  !  2.780e+006     1   2.780e+006
assign (residue 59 and name HN) (residue 58 and name HG2#)         3.100  1.400  1.400  !  2.200e+007     3   7.332e+006
assign (residue 57 and name HD1#) (residue 40 and name HG2#)        2.600  0.900  0.900  !  2.939e+007     3   9.796e+006
assign (residue 85 and name HD1#) (residue 9 and name HD1#)        3.850  2.150  2.150  !  6.454e+006     9   7.171e+005
assign (residue 7 and name HN) (residue 8 and name HB#)            3.350  1.650  2.150  !  9.451e+006     2   4.725e+006
assign (residue 72 and name HN) (residue 72 and name HG#)          3.350  1.650  1.650  !  7.725e+006     2   3.863e+006 ed EO
assign (residue 7 and name HA) (residue 7 and name HG#)            2.850  1.150  1.150  !  7.537e+006     2   3.768e+006
assign (residue 36 and name HD#) (residue 64 and name HD1#)        3.350  1.650  2.150  !  1.132e+007     6   1.886e+006
assign (residue 19 and name HA) (residue 19 and name HG2#)         2.600  0.900  0.900  !  2.475e+007     3   8.251e+006
assign (residue 3 and name HA) (residue 3 and name HG2#)           2.600  0.900  0.900  !  3.997e+007     3   1.332e+007
assign (residue 85 and name HG2#) (residue 85 and name HB)         3.100  1.400  1.400  !  1.358e+007     3   4.525e+006
assign (residue 95 and name HD1#) (residue 68 and name HD2#)       3.850  2.150  2.150  !  1.183e+007     9   1.315e+006
assign (residue 94 and name HG) (residue 68 and name HD1#)         2.600  0.900  0.900  !  2.337e+007     3   7.789e+006
assign (residue 37 and name HA2) (residue 58 and name HG2#)        3.100  1.400  1.400  !  2.280e+007     3   7.599e+006
assign (residue 95 and name HN) (residue 95 and name HG2#)         3.100  1.400  1.400  !  9.383e+006     3   3.128e+006
assign (residue 64 and name HA) (residue 64 and name HD1#)         3.600  1.900  2.400  !  6.163e+006     3   2.054e+006
assign (residue 64 and name HD1#) (residue 95 and name HD1#)       3.850  2.150  2.150  !  1.311e+007     9   1.457e+006
assign (residue 62 and name HG#) (residue 62 and name HA)          2.850  1.150  1.150  !  1.959e+007     2   9.793e+006 ed EO
assign (residue 78 and name HG2#) (residue 72 and name HB#)        3.350  1.650  2.150  !  5.470e+006     6   9.117e+005
assign (residue 2 and name HN) (residue 1 and name HA1)            2.850  1.150  1.150  !  6.330e+006     1   6.330e+006
assign (residue 31 and name HN) (residue 30 and name HA)           2.350  0.650  0.650  !  7.830e+006     1   7.830e+006
assign (residue 68 and name HD1#) (residue 94 and name HA)         3.600  1.900  2.400  !  9.268e+006     3   3.089e+006 ed EO
assign (residue 82 and name HN) (residue 82 and name HA)           3.350  1.650  2.150  !  2.209e+006     1   2.209e+006
assign (residue 97 and name HB1) (residue 94 and name HD1#)        3.100  1.400  1.400  !  1.734e+007     3   5.781e+006
assign (residue 22 and name HA) (residue 22 and name HB#)          3.350  1.650  2.150  !  5.221e+006     2   2.610e+006
assign (residue 94 and name HD1#) (residue 14 and name HB2)        3.600  1.900  2.400  !  3.417e+006     3   1.139e+006
assign (residue 81 and name HG2#) (residue 82 and name HA)         3.600  1.900  2.400  !  4.016e+006     3   1.339e+006
assign (residue 21 and name HA) (residue 21 and name HB#)          2.850  1.150  1.150  !  1.382e+007     2   6.910e+006
assign (residue 99 and name HN) (residue 96 and name HA)           2.850  1.150  1.150  !  3.459e+006     1   3.459e+006
assign (residue 11 and name HG2#) (residue 12 and name HA)         3.100  1.400  1.400  !  1.551e+007     3   5.172e+006
assign (residue 49 and name HN) (residue 48 and name HB1)          2.850  1.150  1.150  !  4.464e+006     1   4.464e+006
assign (residue 66 and name HN) (residue 63 and name HA)           2.850  1.150  1.150  !  4.122e+006     1   4.122e+006
assign (residue 10 and name HD1) (residue 15 and name HA)          3.350  1.650  2.150  !  2.718e+006     1   2.718e+006
assign (residue 19 and name HG2#) (residue 19 and name HB)         3.100  1.400  1.400  !  1.321e+007     3   4.403e+006
assign (residue 63 and name HN) (residue 63 and name HG2#)         2.600  0.900  0.900  !  2.419e+007     3   8.062e+006
assign (residue 16 and name HN) (residue 12 and name HA)           3.350  1.650  2.150  !  1.121e+006     1   1.121e+006
assign (residue 52 and name HN) (residue 51 and name HB#)          3.100  1.400  1.400  !  1.932e+007     3   6.441e+006
assign (residue 2 and name HA) (residue 3 and name HG1#)           3.100  1.400  1.400  !  1.670e+007     3   5.565e+006
assign (residue 11 and name HN) (residue 11 and name HG2#)         2.600  0.900  0.900  !  4.282e+007     3   1.427e+007
assign (residue 16 and name HN) (residue 16 and name HA)           2.350  0.650  0.650  !  9.988e+006     1   9.988e+006
assign (residue 95 and name HN) (residue 98 and name HD1#)         3.600  1.900  2.400  !  3.070e+006     3   1.023e+006
assign (residue 95 and name HN) (residue 94 and name HB2)          2.850  1.150  1.150  !  3.393e+006     1   3.393e+006
assign (residue 82 and name HA) (residue 81 and name HG2#)         3.600  1.900  2.400  !  5.341e+006     3   1.780e+006
assign (residue 69 and name HN) (residue 69 and name HG#)          2.850  1.150  1.150  !  1.277e+007     2   6.387e+006
assign (residue 64 and name HG) (residue 64 and name HB#)          2.850  1.150  1.150  !  1.072e+007     2   5.360e+006
assign (residue 10 and name HA) (residue 15 and name HB#)          3.600  1.900  2.400  !  5.840e+006     3   1.947e+006
assign (residue 16 and name HN) (residue 16 and name HG2)          2.850  1.150  1.150  !  3.960e+006     1   3.960e+006
assign (residue 39 and name HD#) (residue 56 and name HA2)         3.350  1.650  2.150  !  2.049e+006     2   1.024e+006
assign (residue 32 and name HA) (residue 31 and name HA)           3.350  1.650  2.150  !  5.653e+006     1   5.653e+006 ed EO
assign (residue 97 and name HD1) (residue 7 and name HA)           3.350  1.650  2.150  !  2.994e+006     1   2.994e+006
assign (residue 9 and name HA) (residue 9 and name HD1#)           3.100  1.400  1.400  !  1.871e+007     3   6.237e+006
assign (residue 81 and name HN) (residue 81 and name HG2#)         3.600  1.900  2.400  !  8.878e+006     3   2.959e+006
!assign (residue 26 and name HB1) (residue 30 and name HA)          3.350  1.650  2.150  !  1.053e+007     1   1.053e+007 ed EO
assign (residue 98 and name HA) (residue 98 and name HB#)          3.350  1.650  2.150  !  2.499e+006     2   1.249e+006
assign (residue 49 and name HN) (residue 48 and name HB2)          2.850  1.150  1.150  !  3.134e+006     1   3.134e+006
assign (residue 1 and name HA2) (residue 2 and name HA)            3.350  1.650  2.150  !  5.746e+006     1   5.746e+006 ed EO
assign (residue 103 and name HB1) (residue 103 and name HA)        2.350  0.650  0.650  !  1.073e+007     1   1.073e+007
assign (residue 81 and name HA) (residue 82 and name HA)           3.350  1.650  2.150  !  2.587e+006     1   2.587e+006
assign (residue 11 and name HN) (residue 10 and name HA)           2.850  1.150  1.150  !  3.545e+006     1   3.545e+006
assign (residue 98 and name HA) (residue 101 and name HB#)         3.100  1.400  1.400  !  1.226e+007     3   4.085e+006
assign (residue 78 and name HA) (residue 49 and name HA)           3.350  1.650  2.150  !  3.010e+006     1   3.010e+006
assign (residue 100 and name HN) (residue 97 and name HA)          2.850  1.150  1.150  !  5.847e+006     1   5.847e+006
assign (residue 78 and name HA) (residue 51 and name HB#)          3.600  1.900  2.400  !  6.420e+006     3   2.140e+006
assign (residue 68 and name HD2#) (residue 85 and name HD1#)       3.850  2.150  2.150  !  7.749e+006     9   8.610e+005
assign (residue 10 and name HA) (residue 14 and name HA)           3.350  1.650  2.150  !  3.281e+006     1   3.281e+006 ed EO
assign (residue 74 and name HB1) (residue 74 and name HA)          2.850  1.150  1.150  !  7.327e+006     1   7.327e+006
assign (residue 94 and name HD1#) (residue 10 and name HB2)        3.600  1.900  2.400  !  3.837e+006     3   1.279e+006
assign (residue 58 and name HA) (residue 58 and name HG2#)         2.600  0.900  0.900  !  2.771e+007     3   9.235e+006
assign (residue 38 and name HB#) (residue 38 and name HD#)         2.850  1.150  1.150  !  1.347e+007     4   3.367e+006
assign (residue 4 and name HN) (residue 2 and name HA)             2.350  0.650  0.650  !  1.003e+007     1   1.003e+007
assign (residue 12 and name HG1) (residue 12 and name HG2)         2.350  0.650  0.650  !  5.968e+007     1   5.968e+007
assign (residue 10 and name HD2) (residue 10 and name HA)          2.850  1.150  1.150  !  3.390e+006     1   3.390e+006
assign (residue 72 and name HN) (residue 71 and name HB2)          3.350  1.650  2.150  !  2.409e+006     1   2.409e+006
assign (residue 12 and name HG2) (residue 12 and name HG1)         2.350  0.650  0.650  !  5.065e+007     1   5.065e+007
assign (residue 20 and name HN) (residue 19 and name HA)           2.850  1.150  1.150  !  1.137e+007     1   1.137e+007 ed EO
assign (residue 12 and name HN) (residue 12 and name HG1)          2.350  0.650  0.650  !  8.908e+006     1   8.908e+006
assign (residue 5 and name HB#) (residue 2 and name HB2)           2.850  1.150  1.150  !  7.110e+006     2   3.555e+006
assign (residue 76 and name HB#) (residue 76 and name HA)          2.850  1.150  1.150  !  7.699e+006     2   3.849e+006
assign (residue 55 and name HA) (residue 54 and name HA)           3.350  1.650  2.150  !  3.102e+005     1   3.102e+005
assign (residue 13 and name HN) (residue 12 and name HA)           2.850  1.150  1.150  !  5.922e+006     1   5.922e+006
assign (residue 68 and name HD2#) (residue 94 and name HD2#)       3.850  2.150  2.150  !  6.148e+006     9   6.831e+005
assign (residue 95 and name HA) (residue 95 and name HG2#)         3.100  1.400  1.400  !  1.271e+007     3   4.237e+006
assign (residue 94 and name HD2#) (residue 91 and name HA)         3.600  1.900  2.400  !  5.328e+006     3   1.776e+006
assign (residue 96 and name HB#) (residue 97 and name HB1)         3.600  1.900  2.400  !  3.712e+006     3   1.237e+006
assign (residue 27 and name HN) (residue 26 and name HA)           2.850  1.150  1.150  !  6.406e+006     1   6.406e+006
assign (residue 78 and name HA) (residue 79 and name HA)           3.350  1.650  1.650  !  3.959e+006     1   3.959e+006 ed EO
assign (residue 76 and name HD1) (residue 76 and name HD2)         2.350  0.650  0.650  !  2.476e+007     1   2.476e+007
assign (residue 85 and name HA) (residue 85 and name HG2#)         3.100  1.400  1.400  !  2.265e+007     3   7.551e+006
assign (residue 72 and name HE#) (residue 72 and name HA)          2.850  1.150  1.150  !  9.269e+006     2   4.634e+006
assign (residue 92 and name HB#) (residue 1 and name HA1)          3.350  1.650  2.150  !  2.678e+006     2   1.339e+006
assign (residue 14 and name HN) (residue 11 and name HA)           3.350  1.650  2.150  !  3.668e+006     1   3.668e+006 ed EO
assign (residue 72 and name HG#) (residue 72 and name HA)          2.850  1.150  1.150  !  6.692e+006     2   3.346e+006
assign (residue 9 and name HN) (residue 9 and name HG2#)           3.600  1.900  2.400  !  9.024e+006     3   3.008e+006
assign (residue 42 and name HN) (residue 42 and name HA)           2.850  1.150  1.150  !  5.752e+006     1   5.752e+006
assign (residue 64 and name HD2#) (residue 64 and name HD1#)       3.350  1.650  2.150  !  3.546e+007     9   3.940e+006
assign (residue 57 and name HN) (residue 75 and name HD1#)         3.600  1.900  2.400  !  1.111e+007     3   3.703e+006 ed EO
assign (residue 72 and name HE#) (residue 72 and name HG#)         2.850  1.150  1.150  !  1.669e+007     4   4.173e+006
assign (residue 94 and name HG) (residue 94 and name HB1)          2.850  1.150  1.150  !  7.312e+006     1   7.312e+006
assign (residue 96 and name HB#) (residue 97 and name HB2)         3.600  1.900  2.400  !  3.468e+006     3   1.156e+006
assign (residue 79 and name HN) (residue 78 and name HB)           3.350  1.650  2.150  !  1.164e+006     1   1.164e+006
assign (residue 91 and name HA) (residue 68 and name HD1#)         3.600  1.900  2.400  !  5.564e+006     3   1.855e+006
assign (residue 49 and name HA) (residue 49 and name HG2#)         2.600  0.900  0.900  !  2.435e+007     3   8.117e+006
assign (residue 74 and name HD1) (residue 74 and name HA)          2.350  0.650  0.650  !  1.317e+007     1   1.317e+007
assign (residue 9 and name HN) (residue 9 and name HD1#)           3.100  1.400  1.400  !  1.275e+007     3   4.249e+006
assign (residue 92 and name HA) (residue 65 and name HE#)          2.600  0.900  0.900  !  4.035e+007     3   1.345e+007
assign (residue 35 and name HD2#) (residue 32 and name HD2#)       3.850  2.150  2.150  !  1.941e+007     9   2.156e+006
assign (residue 81 and name HG2#) (residue 81 and name HA)         3.100  1.400  1.400  !  9.266e+006     3   3.089e+006
assign (residue 99 and name HE#) (residue 99 and name HA)          3.350  1.650  2.150  !  4.191e+006     2   2.095e+006
assign (residue 87 and name HN) (residue 85 and name HG2#)         3.100  1.400  1.400  !  1.649e+007     3   5.496e+006
assign (residue 22 and name HG#) (residue 22 and name HB#)         2.850  1.150  1.150  !  1.893e+007     4   4.732e+006
assign (residue 6 and name HA1) (residue 6 and name HA2)           3.350  1.650  2.150  !  3.047e+006     1   3.047e+006
assign (residue 35 and name HD2#) (residue 98 and name HD2#)       3.850  2.150  2.150  !  1.524e+007     9   1.693e+006
assign (residue 16 and name HA) (residue 16 and name HG1)          2.850  1.150  1.150  !  6.442e+006     1   6.442e+006
assign (residue 59 and name HE1) (residue 40 and name HG2#)        3.600  1.900  2.400  !  5.201e+006     3   1.734e+006
assign (residue 48 and name HB1) (residue 49 and name HG2#)        3.600  1.900  2.400  !  1.176e+007     3   3.921e+006 ed EO
assign (residue 35 and name HD2#) (residue 98 and name HD1#)       3.850  2.150  2.150  !  1.768e+007     9   1.965e+006
assign (residue 92 and name HB#) (residue 92 and name HA)          3.350  1.650  2.150  !  5.480e+006     2   2.740e+006
!assign (residue 20 and name HG2#) (residue 19 and name HG2#)       3.850  2.150  2.150  !  1.464e+007     9   1.627e+006
assign (residue 32 and name HB2) (residue 20 and name HA)          2.850  1.150  1.150  !  5.170e+006     1   5.170e+006
assign (residue 47 and name HN) (residue 47 and name HA)           2.850  1.150  1.150  !  6.758e+006     1   6.758e+006
assign (residue 60 and name HA) (residue 60 and name HD1)          3.350  1.650  2.150  !  3.591e+006     1   3.591e+006 ed EO
assign (residue 68 and name HD2#) (residue 68 and name HG)         3.600  1.900  2.400  !  2.487e+006     3   8.290e+005
assign (residue 68 and name HD1#) (residue 94 and name HD1#)       3.850  2.150  2.150  !  6.768e+006     9   7.520e+005
assign (residue 45 and name HA1) (residue 45 and name HA2)         2.350  0.650  0.650  !  1.748e+007     1   1.748e+007
assign (residue 68 and name HD2#) (residue 64 and name HD2#)       3.850  2.150  2.150  !  2.919e+006     9   3.244e+005
assign (residue 103 and name HB2) (residue 103 and name HA)        2.350  0.650  0.650  !  1.113e+007     1   1.113e+007
!assign (residue 74 and name HD1) (residue 57 and name HD1#)        3.600  1.900  2.400  !  8.120e+006     3   2.707e+006
assign (residue 54 and name HN) (residue 50 and name HA)           2.850  1.150  1.150  !  5.894e+006     1   5.894e+006
assign (residue 12 and name HN) (residue 11 and name HB)           2.850  1.150  1.150  !  5.481e+006     1   5.481e+006
assign (residue 102 and name HA) (residue 20 and name HG2#)        3.350  1.650  2.150  !  1.050e+007     3   3.500e+006 ed EO
assign (residue 50 and name HB#) (residue 51 and name HB#)         3.850  2.150  2.150  !  7.367e+006     6   1.228e+006 ed EO
assign (residue 9 and name HB) (residue 94 and name HD1#)          2.600  0.900  0.900  !  4.065e+007     3   1.355e+007
assign (residue 68 and name HN) (residue 64 and name HD2#)         3.600  1.900  2.400  !  7.259e+006     3   2.420e+006
assign (residue 19 and name HB) (residue 20 and name HG2#)         3.600  1.900  2.400  !  6.979e+006     3   2.326e+006
assign (residue 68 and name HD1#) (residue 68 and name HG)         3.600  1.900  2.400  !  3.364e+006     3   1.121e+006
assign (residue 94 and name HD1#) (residue 10 and name HA)         3.600  1.900  2.400  !  5.674e+006     3   1.891e+006
assign (residue 31 and name HN) (residue 32 and name HD2#)         3.600  1.900  2.400  !  3.965e+006     3   1.322e+006
assign (residue 101 and name HN) (residue 101 and name HA)         2.350  0.650  0.650  !  7.806e+006     1   7.806e+006
assign (residue 26 and name HN) (residue 19 and name HG2#)         3.600  1.900  2.400  !  1.830e+007     3   6.101e+006 ed EO
assign (residue 81 and name HG12) (residue 81 and name HD1#)       2.600  0.900  0.900  !  6.953e+007     3   2.318e+007
assign (residue 57 and name HB) (residue 57 and name HG12)         3.350  1.650  2.150  !  1.678e+006     1   1.678e+006
assign (residue 16 and name HN) (residue 15 and name HB#)          3.600  1.900  2.400  !  7.099e+006     3   2.366e+006
assign (residue 24 and name HA1) (residue 21 and name HG#)         3.350  1.650  2.150  !  3.642e+006     2   1.821e+006
assign (residue 19 and name HB) (residue 19 and name HG2#)         2.600  0.900  0.900  !  2.709e+007     3   9.028e+006
assign (residue 26 and name HA) (residue 26 and name HB2)          2.850  1.150  1.150  !  3.380e+006     1   3.380e+006
assign (residue 74 and name HB1) (residue 74 and name HB2)         3.350  1.650  2.150  !  2.988e+006     1   2.988e+006
assign (residue 96 and name HB#) (residue 95 and name HB)          3.600  1.900  2.400  !  7.159e+006     3   2.386e+006
assign (residue 54 and name HD21) (residue 54 and name HA)         3.350  1.650  2.150  !  2.968e+006     1   2.968e+006
assign (residue 95 and name HN) (residue 94 and name HB1)          3.350  1.650  2.150  !  2.465e+006     1   2.465e+006
assign (residue 57 and name HN) (residue 57 and name HA)           2.850  1.150  1.150  !  6.032e+006     1   6.032e+006
assign (residue 61 and name HB#) (residue 61 and name HG#)         2.350  0.650  0.650  !  5.802e+007     4   1.450e+007
assign (residue 69 and name HN) (residue 68 and name HD2#)         3.600  1.900  2.400  !  2.399e+006     3   7.997e+005
assign (residue 103 and name HN) (residue 103 and name HA)         2.350  0.650  0.650  !  7.857e+006     1   7.857e+006
assign (residue 70 and name HB2) (residue 71 and name HD1)         3.350  1.650  2.150  !  4.974e+006     1   4.974e+006 ed EO
assign (residue 84 and name HA1) (residue 84 and name HA2)         2.850  1.150  1.150  !  3.651e+006     1   3.651e+006
assign (residue 55 and name HB#) (residue 55 and name HA)          2.350  0.650  0.650  !  3.365e+007     2   1.683e+007
assign (residue 58 and name HN) (residue 40 and name HG2#)          3.600  1.900  2.400  !  7.163e+006     1   7.163e+006 ed EO
assign (residue 76 and name HG#) (residue 76 and name HD2)         2.850  1.150  1.150  !  9.703e+006     2   4.852e+006
assign (residue 59 and name HN) (residue 57 and name HD1#)         3.600  1.900  2.400  !  3.967e+006     3   1.322e+006
assign (residue 9 and name HB) (residue 10 and name HA)            3.350  1.650  2.150  !  4.527e+006     1   4.527e+006 ed EO
!assign (residue 59 and name HD1) (residue 40 and name HB)          3.350  1.650  2.150  !  4.749e+006     1   4.749e+006 ed EO
assign (residue 10 and name HD1) (residue 11 and name HG1#)        3.600  1.900  2.400  !  3.073e+006     3   1.024e+006
assign (residue 46 and name HA) (residue 46 and name HB2)          2.850  1.150  1.150  !  5.868e+006     1   5.868e+006
assign (residue 35 and name HG) (residue 35 and name HA)           2.350  0.650  0.650  !  9.562e+006     1   9.562e+006
assign (residue 72 and name HN) (residue 72 and name HB#)          2.850  1.150  1.150  !  1.080e+007     2   5.401e+006
assign (residue 13 and name HB#) (residue 9 and name HG2#)         2.850  1.150  1.150  !  5.657e+007     6   9.429e+006 ed EO
assign (residue 31 and name HB2) (residue 31 and name HB1)         2.350  0.650  0.650  !  7.550e+007     1   7.550e+007
assign (residue 68 and name HB#) (residue 68 and name HG)          3.350  1.650  2.150  !  3.454e+006     2   1.727e+006
assign (residue 90 and name HN) (residue 9 and name HD1#)          3.600  1.900  2.400  !  2.980e+006     3   9.934e+005
assign (residue 98 and name HN) (residue 97 and name HA)           2.850  1.150  1.150  !  2.490e+007     1   2.490e+007 ed EO
assign (residue 39 and name HE#) (residue 39 and name HA)          3.350  1.650  2.150  !  3.502e+006     2   1.751e+006
assign (residue 67 and name HB2) (residue 64 and name HD2#)        3.600  1.900  2.400  !  4.962e+006     3   1.654e+006
assign (residue 97 and name HB1) (residue 101 and name HB#)        3.600  1.900  2.400  !  5.110e+006     3   1.703e+006
assign (residue 92 and name HN) (residue 88 and name HA)           2.850  1.150  1.150  !  7.100e+006     1   7.100e+006
assign (residue 88 and name HN) (residue 88 and name HA)           3.350  1.650  2.150  !  1.919e+006     1   1.919e+006
assign (residue 32 and name HN) (residue 31 and name HA)           2.850  1.150  1.150  !  7.115e+006     1   7.115e+006
assign (residue 11 and name HB) (residue 11 and name HG1#)         2.600  0.900  0.900  !  8.130e+007     3   2.710e+007
!assign (residue 60 and name HB#) (residue 63 and name HG2#)        3.600  1.900  2.400  !  1.686e+007     6   2.811e+006
assign (residue 77 and name HA1) (residue 76 and name HA)          3.350  1.650  2.150  !  3.270e+006     1   3.270e+006 ed EO
assign (residue 96 and name HN) (residue 97 and name HB1)          3.350  1.650  2.150  !  3.164e+006     1   3.164e+006 ed EO
assign (residue 68 and name HD1#) (residue 95 and name HG2#)       3.850  2.150  2.150  !  6.022e+006     9   6.691e+005
assign (residue 97 and name HB1) (residue 94 and name HA)          2.850  1.150  1.150  !  5.607e+006     1   5.607e+006
assign (residue 96 and name HN) (residue 96 and name HB#)          2.600  0.900  0.900  !  3.479e+007     3   1.160e+007
assign (residue 42 and name HN) (residue 43 and name HB#)          3.100  1.400  1.400  !  2.109e+007     3   7.028e+006
assign (residue 71 and name HA) (residue 72 and name HA)           3.350  1.650  2.150  !  2.522e+006     1   2.522e+006
assign (residue 72 and name HG#) (residue 78 and name HG2#)        3.350  1.650  2.150  !  1.177e+007     6   1.961e+006
assign (residue 10 and name HD1) (residue 10 and name HB1)         3.350  1.650  2.150  !  2.899e+006     1   2.899e+006
assign (residue 68 and name HD2#) (residue 95 and name HD1#)       3.850  2.150  2.150  !  2.818e+006     9   3.131e+005
assign (residue 55 and name HN) (residue 56 and name HA2)          3.350  1.650  2.150  !  3.784e+006     1   3.784e+006 ed EO
assign (residue 94 and name HN) (residue 91 and name HA)           2.850  1.150  1.150  !  3.430e+006     1   3.430e+006
assign (residue 12 and name HE21) (residue 12 and name HG2)        2.850  1.150  1.150  !  3.450e+006     1   3.450e+006
assign (residue 64 and name HG) (residue 64 and name HD2#)         2.600  0.900  0.900  !  2.870e+007     3   9.568e+006
assign (residue 64 and name HN) (residue 63 and name HG2#)         3.100  1.400  1.400  !  1.012e+007     3   3.375e+006
assign (residue 57 and name HB) (residue 57 and name HG2#)         2.600  0.900  0.900  !  3.734e+007     3   1.245e+007
assign (residue 63 and name HG2#) (residue 63 and name HB)         3.600  1.900  2.400  !  7.395e+006     3   2.465e+006
assign (residue 81 and name HG2#) (residue 81 and name HB)         3.100  1.400  1.400  !  1.427e+007     3   4.756e+006
assign (residue 94 and name HD2#) (residue 94 and name HD1#)       3.350  1.650  2.150  !  4.908e+007     9   5.453e+006
assign (residue 35 and name HG) (residue 64 and name HD1#)         3.100  1.400  1.400  !  1.638e+007     3   5.459e+006
assign (residue 102 and name HG2#) (residue 102 and name HB)       3.600  1.900  2.400  !  5.464e+006     3   1.821e+006
assign (residue 29 and name HN) (residue 28 and name HB)           2.850  1.150  1.150  !  6.857e+006     1   6.857e+006
assign (residue 95 and name HA) (residue 98 and name HD1#)         3.600  1.900  2.400  !  8.924e+006     3   2.975e+006
assign (residue 94 and name HN) (residue 94 and name HD1#)         3.350  1.650  2.150  !  1.034e+007     3   3.447e+006 ed EO
assign (residue 50 and name HN) (residue 49 and name HG2#)         3.600  1.900  2.400  !  8.213e+006     3   2.738e+006
assign (residue 58 and name HN) (residue 57 and name HG2#)         3.100  1.400  1.400  !  1.161e+007     3   3.870e+006
assign (residue 16 and name HN) (residue 16 and name HB1)          2.850  1.150  1.150  !  6.890e+006     1   6.890e+006
assign (residue 36 and name HA) (residue 36 and name HB1)          2.850  1.150  1.150  !  3.920e+006     1   3.920e+006
assign (residue 68 and name HB1) (residue 65 and name HA)          2.850  1.150  1.150  !  6.140e+006     1   6.140e+006
assign (residue 92 and name HG#) (residue 92 and name HA)          3.350  1.650  2.150  !  4.471e+006     2   2.236e+006
assign (residue 22 and name HN) (residue 21 and name HB#)          2.850  1.150  1.150  !  7.415e+006     2   3.708e+006
assign (residue 31 and name HB1) (residue 31 and name HB2)         2.350  0.650  0.650  !  6.991e+007     1   6.991e+007
assign (residue 12 and name HN) (residue 12 and name HA)           2.350  0.650  0.650  !  1.060e+007     1   1.060e+007
assign (residue 10 and name HN) (residue 9 and name HB)            2.350  0.650  0.650  !  1.043e+007     1   1.043e+007
assign (residue 53 and name HN) (residue 48 and name HB1)          2.850  1.150  1.150  !  3.417e+006     1   3.417e+006
assign (residue 97 and name HB2) (residue 97 and name HA)          2.350  0.650  0.650  !  9.332e+006     1   9.332e+006
assign (residue 40 and name HN) (residue 40 and name HB)           2.850  1.150  1.150  !  3.078e+006     1   3.078e+006
assign (residue 20 and name HB) (residue 101 and name HB#)         3.100  1.400  1.400  !  1.598e+007     3   5.327e+006
assign (residue 65 and name HG1) (residue 65 and name HA)          2.850  1.150  1.150  !  1.427e+007     1   1.427e+007 ed EO
assign (residue 68 and name HD1#) (residue 85 and name HD1#)       3.850  2.150  2.150  !  1.065e+007     9   1.183e+006
assign (residue 64 and name HB#) (residue 59 and name HA)          3.600  1.900  2.400  !  6.334e+006     2   3.167e+006 ed EO
assign (residue 85 and name HG2#) (residue 90 and name HG#)        3.350  1.650  2.150  !  7.227e+006     6   1.204e+006
!assign (residue 57 and name HB) (residue 63 and name HA)           2.850  1.150  1.150  !  5.704e+006     1   5.704e+006
assign (residue 21 and name HN) (residue 19 and name HB)           2.850  1.150  1.150  !  3.259e+006     1   3.259e+006
assign (residue 72 and name HA) (residue 73 and name HA)           3.350  1.650  2.150  !  3.419e+006     1   3.419e+006 ed EO
assign (residue 31 and name HA) (residue 19 and name HG2#)         3.600  1.900  2.400  !  1.609e+007     3   5.364e+006
assign (residue 47 and name HG2#) (residue 47 and name HA)         3.600  1.900  2.400  !  8.384e+006     3   2.795e+006
assign (residue 64 and name HG) (residue 35 and name HD2#)         2.600  0.900  0.900  !  3.336e+007     3   1.112e+007
assign (residue 2 and name HN) (residue 1 and name HA2)            2.850  1.150  1.150  !  4.426e+006     1   4.426e+006
assign (residue 88 and name HE#) (residue 65 and name HE#)         2.850  1.150  1.150  !  4.629e+007     6   7.715e+006
!assign (residue 52 and name HN) (residue 49 and name HG2#)         3.600  1.900  2.400  !  8.704e+006     3   2.901e+006
assign (residue 75 and name HG2#) (residue 78 and name HB)         3.600  1.900  2.400  !  3.798e+006     3   1.266e+006
assign (residue 48 and name HA) (residue 48 and name HB1)          2.850  1.150  1.150  !  4.792e+006     1   4.792e+006
assign (residue 53 and name HA) (residue 41 and name HA1)          2.850  1.150  1.150  !  4.635e+006     1   4.635e+006
assign (residue 10 and name HN) (residue 12 and name HG2)          2.850  1.150  1.150  !  5.535e+006     1   5.535e+006
assign (residue 94 and name HB1) (residue 94 and name HD2#)        3.100  1.400  1.400  !  1.634e+007     3   5.445e+006
assign (residue 67 and name HD2) (residue 68 and name HB#)         3.350  1.650  2.150  !  5.107e+006     2   2.553e+006
assign (residue 73 and name HB#) (residue 73 and name HA)          2.350  0.650  0.650  !  1.550e+007     2   7.748e+006
assign (residue 48 and name HN) (residue 47 and name HA)           2.350  0.650  0.650  !  1.910e+007     1   1.910e+007
assign (residue 7 and name HN) (residue 4 and name HA)             2.850  1.150  1.150  !  7.063e+006     1   7.063e+006
assign (residue 58 and name HB) (residue 58 and name HG2#)         2.600  0.900  0.900  !  5.247e+007     3   1.749e+007
assign (residue 20 and name HN) (residue 20 and name HG1#)         3.100  1.400  1.400  !  1.529e+007     3   5.097e+006
assign (residue 11 and name HN) (residue 11 and name HG1#)         3.100  1.400  1.400  !  1.660e+007     3   5.533e+006
assign (residue 62 and name HN) (residue 61 and name HG#)          3.350  1.650  2.150  !  6.555e+006     2   3.278e+006 ed EO
assign (residue 7 and name HN) (residue 6 and name HA2)            2.850  1.150  1.150  !  4.384e+006     1   4.384e+006
assign (residue 6 and name HN) (residue 6 and name HA2)            2.850  1.150  1.150  !  3.609e+006     1   3.609e+006
assign (residue 68 and name HN) (residue 68 and name HD2#)         3.600  1.900  2.400  !  6.973e+006     3   2.324e+006
assign (residue 49 and name HB) (residue 50 and name HB#)          3.350  1.650  2.150  !  6.404e+006     2   3.202e+006 ed EO
assign (residue 12 and name HB#) (residue 12 and name HG1)         2.350  0.650  0.650  !  1.727e+007     2   8.636e+006
assign (residue 95 and name HD1#) (residue 68 and name HB#)        3.350  1.650  2.150  !  1.090e+007     6   1.817e+006
assign (residue 102 and name HG2#) (residue 32 and name HD2#)      3.850  2.150  2.150  !  3.411e+008     9   3.790e+007 ed EO
assign (residue 49 and name HN) (residue 49 and name HB)           2.850  1.150  1.150  !  3.346e+006     1   3.346e+006
assign (residue 13 and name HN) (residue 12 and name HG1)          3.350  1.650  2.150  !  2.972e+006     1   2.972e+006
assign (residue 77 and name HN) (residue 76 and name HA)           2.350  0.650  0.650  !  1.134e+007     1   1.134e+007
assign (residue 20 and name HG1#) (residue 98 and name HA)         3.600  1.900  2.400  !  7.905e+006     3   2.635e+006
assign (residue 74 and name HB1) (residue 75 and name HD1#)        3.600  1.900  2.400  !  5.192e+006     3   1.731e+006
assign (residue 10 and name HE2) (residue 20 and name HG2#)        3.600  1.900  2.400  !  4.353e+006     3   1.451e+006
assign (residue 37 and name HA1) (residue 37 and name HA2)         2.350  0.650  0.650  !  1.771e+007     1   1.771e+007
assign (residue 17 and name HA) (residue 16 and name HA)           3.350  1.650  2.150  !  8.259e+006     1   8.259e+006 ed EO
!assign (residue 10 and name HB1) (residue 94 and name HD2#)        3.600  1.900  2.400  !  4.926e+006     3   1.642e+006
assign (residue 15 and name HB#) (residue 11 and name HA)          2.600  0.900  0.900  !  2.428e+007     3   8.094e+006
assign (residue 96 and name HA) (residue 95 and name HG2#)         3.100  1.400  1.400  !  1.192e+007     3   3.974e+006
assign (residue 65 and name HA) (residue 65 and name HE#)          3.850  1.150  1.150  !  2.755e+007     3   9.183e+006 ed EO
assign (residue 104 and name HN) (residue 103 and name HB2)        2.350  0.650  0.650  !  8.614e+006     1   8.614e+006
assign (residue 102 and name HN) (residue 101 and name HB#)        3.100  1.400  1.400  !  1.291e+007     3   4.303e+006
assign (residue 94 and name HD2#) (residue 9 and name HG2#)        3.350  1.650  2.150  !  4.172e+007     9   4.636e+006
assign (residue 73 and name HN) (residue 72 and name HG#)          3.350  1.650  2.150  !  2.745e+006     2   1.372e+006
assign (residue 22 and name HN) (residue 22 and name HB#)          2.850  1.150  1.150  !  6.529e+006     2   3.264e+006
assign (residue 53 and name HN) (residue 48 and name HB2)          3.350  1.650  2.150  !  3.632e+006     1   3.632e+006 ed EO
assign (residue 50 and name HN) (residue 51 and name HB#)          3.600  1.900  2.400  !  8.353e+006     3   2.784e+006
assign (residue 21 and name HB#) (residue 21 and name HG#)         2.350  0.650  0.650  !  4.535e+007     4   1.134e+007
assign (residue 95 and name HN) (residue 94 and name HA)           2.850  1.150  1.150  !  6.802e+006     1   6.802e+006
assign (residue 8 and name HN) (residue 5 and name HA)             2.350  0.650  0.650  !  8.359e+006     1   8.359e+006
assign (residue 89 and name HG2#) (residue 89 and name HB)         2.600  0.900  0.900  !  2.890e+007     3   9.634e+006
assign (residue 103 and name HD21) (residue 103 and name HB2)      2.350  0.650  0.650  !  8.845e+006     1   8.845e+006
assign (residue 60 and name HB#) (residue 60 and name HA)          2.850  1.150  1.150  !  1.054e+007     2   5.268e+006
assign (residue 48 and name HA) (residue 47 and name HG2#)         3.600  1.900  2.400  !  5.475e+006     3   1.825e+006
assign (residue 6 and name HA2) (residue 9 and name HD1#)          3.100  1.400  1.400  !  1.290e+007     3   4.302e+006
assign (residue 32 and name HD2#) (residue 20 and name HA)         3.600  1.900  2.400  !  3.236e+006     3   1.079e+006
assign (residue 57 and name HB) (residue 57 and name HD1#)         2.600  0.900  0.900  !  2.512e+007     3   8.372e+006
assign (residue 53 and name HD#) (residue 50 and name HB#)         3.350  1.650  2.150  !  4.168e+006     4   1.042e+006
assign (residue 59 and name HB1) (residue 59 and name HB2)         3.350  1.650  2.150  !  2.004e+006     1   2.004e+006
assign (residue 52 and name HA) (residue 52 and name HB#)          2.850  1.150  1.150  !  6.325e+006     2   3.163e+006
assign (residue 45 and name HA1) (residue 43 and name HB#)         3.600  1.900  2.400  !  1.368e+007     3   4.559e+006 ed EO
assign (residue 74 and name HD1) (residue 73 and name HE#)         3.350  1.650  2.150  !  4.665e+006     2   2.333e+006
assign (residue 64 and name HD2#) (residue 68 and name HA)         3.600  1.900  2.400  !  2.159e+006     3   7.198e+005
assign (residue 76 and name HD1) (residue 73 and name HA)          2.850  1.150  1.150  !  4.077e+006     1   4.077e+006
assign (residue 42 and name HE22) (residue 38 and name HD#)        3.350  1.650  2.150  !  2.599e+006     2   1.300e+006
assign (residue 88 and name HE#) (residue 89 and name HG2#)        3.350  1.650  2.150  !  1.245e+007     6   2.075e+006
assign (residue 75 and name HN) (residue 74 and name HB1)          3.350  1.650  2.150  !  1.852e+006     1   1.852e+006
assign (residue 58 and name HN) (residue 58 and name HG2#)         3.100  1.400  1.400  !  1.902e+007     3   6.342e+006
assign (residue 1 and name HA2) (residue 1 and name HA1)           2.350  0.650  0.650  !  1.600e+007     1   1.600e+007
assign (residue 43 and name HN) (residue 43 and name HB#)          2.600  0.900  0.900  !  2.712e+007     3   9.042e+006
assign (residue 103 and name HD22) (residue 103 and name HB2)      2.850  1.150  1.150  !  1.365e+007     1   1.365e+007 ed EO
assign (residue 68 and name HG) (residue 68 and name HA)           2.850  1.150  1.150  !  4.197e+006     1   4.197e+006
assign (residue 55 and name HN) (residue 54 and name HB2)          2.850  1.150  1.150  !  4.377e+006     1   4.377e+006
assign (residue 64 and name HD1#) (residue 95 and name HB)         3.600  1.900  2.400  !  1.985e+006     3   6.617e+005
assign (residue 97 and name HN) (residue 95 and name HG2#)         3.600  1.900  2.400  !  9.186e+006     3   3.062e+006
assign (residue 50 and name HN) (residue 50 and name HB#)          2.850  1.150  1.150  !  1.357e+007     2   6.787e+006
assign (residue 16 and name HB1) (residue 16 and name HB2)         2.350  0.650  0.650  !  4.800e+007     1   4.800e+007
assign (residue 67 and name HD2) (residue 64 and name HD2#)        3.600  1.900  2.400  !  8.974e+006     3   2.991e+006
assign (residue 14 and name HA) (residue 14 and name HB2)          2.850  1.150  1.150  !  3.989e+006     1   3.989e+006
assign (residue 14 and name HB1) (residue 20 and name HG1#)        3.100  1.400  1.400  !  1.430e+007     3   4.768e+006
assign (residue 67 and name HD2) (residue 64 and name HD1#)        3.600  1.900  2.400  !  2.807e+006     3   9.356e+005
assign (residue 70 and name HN) (residue 71 and name HD1)          2.850  1.150  1.150  !  3.079e+006     1   3.079e+006
assign (residue 39 and name HA) (residue 57 and name HD1#)         3.600  1.900  2.400  !  2.811e+007     3   9.370e+006 ed EO
assign (residue 98 and name HD1#) (residue 94 and name HB1)        3.600  1.900  2.400  !  7.959e+006     3   2.653e+006
assign (residue 99 and name HN) (residue 101 and name HB#)         3.600  1.900  2.400  !  5.637e+006     3   1.879e+006
assign (residue 95 and name HN) (residue 68 and name HD1#)         3.600  1.900  2.400  !  2.768e+006     3   9.226e+005
assign (residue 36 and name HE2) (residue 102 and name HB)         2.850  1.150  1.150  !  3.640e+006     1   3.640e+006
assign (residue 81 and name HG12) (residue 81 and name HG2#)       2.600  0.900  0.900  !  5.675e+007     3   1.892e+007
assign (residue 9 and name HN) (residue 9 and name HG12)           2.850  1.150  1.150  !  3.346e+006     1   3.346e+006
assign (residue 29 and name HA#) (residue 28 and name HG2#)        3.600  1.900  2.400  !  3.900e+007     6   6.499e+006 ed EO
assign (residue 98 and name HA) (residue 97 and name HA)           3.350  1.650  2.150  !  7.727e+006     1   7.727e+006 ed EO
assign (residue 9 and name HG2#) (residue 9 and name HD1#)         3.350  1.650  2.150  !  5.323e+007     9   5.914e+006
assign (residue 80 and name HN) (residue 78 and name HG2#)         3.600  1.900  2.400  !  7.805e+006     3   2.602e+006
assign (residue 4 and name HN) (residue 5 and name HB#)            3.350  1.650  2.150  !  9.986e+006     2   4.993e+006 ed EO
assign (residue 35 and name HB#) (residue 35 and name HD2#)        3.350  1.650  2.150  !  1.322e+007     6   2.203e+006
assign (residue 36 and name HE2) (residue 35 and name HD2#)        3.600  1.900  2.400  !  2.745e+006     3   9.150e+005
assign (residue 6 and name HA2) (residue 3 and name HA)            3.350  1.650  2.150  !  7.180e+006     1   7.180e+006 ed EO
assign (residue 64 and name HD1#) (residue 99 and name HG#)        3.350  1.650  2.150  !  3.864e+006     6   6.440e+005
assign (residue 95 and name HG2#) (residue 96 and name HB#)        3.850  2.150  2.150  !  2.046e+007     9   2.273e+006
assign (residue 41 and name HN) (residue 40 and name HG2#)         3.600  1.900  2.400  !  6.108e+006     3   2.036e+006
assign (residue 19 and name HB) (residue 20 and name HG1#)         3.600  1.900  2.400  !  5.823e+006     3   1.941e+006 ed EO
assign (residue 14 and name HB1) (residue 14 and name HA)          2.350  0.650  0.650  !  1.090e+007     1   1.090e+007
assign (residue 8 and name HD#) (residue 9 and name HG2#)          3.600  1.900  2.400  !  4.488e+007     6   7.481e+006 ed EO
assign (residue 64 and name HD2#) (residue 35 and name HD2#)       3.850  2.150  2.150  !  1.274e+007     9   1.415e+006
assign (residue 16 and name HA) (residue 16 and name HG2)          2.850  1.150  1.150  !  4.815e+006     1   4.815e+006
assign (residue 53 and name HG#) (residue 54 and name HA)          3.350  1.650  2.150  !  5.511e+006     2   2.756e+006
assign (residue 65 and name HN) (residue 63 and name HA)           3.350  1.650  2.150  !  4.535e+006     1   4.535e+006 ed EO
assign (residue 96 and name HA) (residue 96 and name HB#)          2.600  0.900  0.900  !  4.521e+007     3   1.507e+007
assign (residue 11 and name HA) (residue 15 and name HB#)          2.600  0.900  0.900  !  4.248e+007     3   1.416e+007
assign (residue 62 and name HB#) (residue 62 and name HA)          2.350  0.650  0.650  !  3.171e+007     2   1.586e+007
assign (residue 30 and name HB1) (residue 30 and name HA)          2.350  0.650  0.650  !  1.336e+007     1   1.336e+007
assign (residue 20 and name HG2#) (residue 21 and name HB#)        3.350  1.650  2.150  !  9.924e+006     6   1.654e+006
assign (residue 88 and name HB#) (residue 89 and name HG2#)        3.350  1.650  2.150  !  2.506e+007     6   4.176e+006 ed EO
assign (residue 95 and name HA) (residue 95 and name HB)           3.350  1.650  2.150  !  3.036e+006     1   3.036e+006
assign (residue 100 and name HN) (residue 101 and name HA)         3.350  1.650  2.150  !  2.525e+006     1   2.525e+006
assign (residue 17 and name HB1) (residue 28 and name HB)          2.850  1.150  1.150  !  4.581e+006     1   4.581e+006
assign (residue 89 and name HN) (residue 89 and name HB)           2.850  1.150  1.150  !  8.594e+006     1   8.594e+006 ed EO
assign (residue 57 and name HD1#) (residue 57 and name HG12)       3.100  1.400  1.400  !  9.430e+006     3   3.143e+006
assign (residue 92 and name HA) (residue 91 and name HA)           3.350  1.650  2.150  !  4.099e+006     1   4.099e+006 ed EO
assign (residue 10 and name HN) (residue 10 and name HB1)          2.850  1.150  1.150  !  5.589e+006     1   5.589e+006
assign (residue 36 and name HD1) (residue 36 and name HB2)         2.850  1.150  1.150  !  3.111e+006     1   3.111e+006
assign (residue 16 and name HN) (residue 16 and name HB2)          2.850  1.150  1.150  !  7.399e+006     1   7.399e+006
assign (residue 67 and name HD2) (residue 67 and name HB2)         3.350  1.650  2.150  !  2.803e+006     1   2.803e+006
assign (residue 57 and name HG12) (residue 57 and name HG2#)       2.600  0.900  0.900  !  4.161e+007     3   1.387e+007
assign (residue 26 and name HD2) (residue 45 and name HA2)         3.350  1.650  2.150  !  2.498e+006     1   2.498e+006
assign (residue 57 and name HN) (residue 57 and name HG12)         2.850  1.150  1.150  !  3.896e+006     1   3.896e+006
assign (residue 12 and name HN) (residue 11 and name HG2#)         3.100  1.400  1.400  !  1.042e+007     3   3.475e+006
assign (residue 32 and name HN) (residue 20 and name HA)           2.850  1.150  1.150  !  4.747e+006     1   4.747e+006
assign (residue 23 and name HN) (residue 22 and name HA)           2.850  1.150  1.150  !  4.343e+006     1   4.343e+006
assign (residue 96 and name HN) (residue 3 and name HA)            3.350  1.650  2.150  !  4.120e+006     1   4.120e+006 ed EO
assign (residue 18 and name HN) (residue 15 and name HA)           2.850  1.150  1.150  !  3.448e+006     1   3.448e+006
assign (residue 21 and name HN) (residue 20 and name HA)           2.850  1.150  1.150  !  3.650e+006     1   3.650e+006
assign (residue 95 and name HB) (residue 95 and name HG2#)         2.600  0.900  0.900  !  3.398e+007     3   1.133e+007
assign (residue 54 and name HD22) (residue 54 and name HA)         3.350  1.650  2.150  !  6.126e+006     1   6.126e+006 ed EO
assign (residue 37 and name HA1) (residue 58 and name HG2#)        3.100  1.400  1.400  !  1.937e+007     3   6.455e+006
assign (residue 102 and name HN) (residue 98 and name HD2#)        3.600  1.900  2.400  !  6.616e+006     3   2.205e+006
assign (residue 1 and name HA2) (residue 96 and name HB#)          3.100  1.400  1.400  !  1.060e+007     3   3.532e+006
assign (residue 3 and name HN) (residue 3 and name HB)             2.350  0.650  0.650  !  1.469e+007     1   1.469e+007
assign (residue 11 and name HG1#) (residue 15 and name HB#)        3.850  2.150  2.150  !  1.639e+007     9   1.821e+006
assign (residue 64 and name HD1#) (residue 64 and name HD2#)       3.350  1.650  2.150  !  5.607e+007     9   6.230e+006
assign (residue 93 and name HN) (residue 93 and name HA)           2.350  0.650  0.650  !  1.805e+007     1   1.805e+007
assign (residue 63 and name HA) (residue 63 and name HG2#)         2.600  0.900  0.900  !  4.360e+007     3   1.453e+007
assign (residue 85 and name HN) (residue 85 and name HB)           3.350  1.650  2.150  !  1.967e+006     1   1.967e+006
assign (residue 57 and name HN) (residue 40 and name HG2#)          2.600  0.900  0.900  !  1.859e+007     1   1.859e+007
assign (residue 82 and name HN) (residue 81 and name HG2#)         3.100  1.400  1.400  !  1.447e+007     3   4.823e+006
assign (residue 59 and name HD1) (residue 58 and name HG2#)        3.600  1.900  2.400  !  3.189e+006     3   1.063e+006
assign (residue 2 and name HB2) (residue 2 and name HB1)           2.350  0.650  0.650  !  1.646e+007     1   1.646e+007
assign (residue 40 and name HA) (residue 40 and name HG2#)          2.600  0.900  0.900  !  2.065e+007     1   2.065e+007
assign (residue 94 and name HN) (residue 94 and name HD2#)         3.600  1.900  2.400  !  6.804e+006     3   2.268e+006
assign (residue 99 and name HD#) (residue 96 and name HA)          3.350  1.650  2.150  !  3.208e+006     2   1.604e+006
!assign (residue 26 and name HB2) (residue 31 and name HA)          3.350  1.650  2.150  !  2.262e+006     1   2.262e+006
assign (residue 13 and name HB#) (residue 13 and name HA)          2.350  0.650  0.650  !  2.870e+007     2   1.435e+007
assign (residue 98 and name HG) (residue 68 and name HD1#)         3.600  1.900  2.400  !  1.619e+007     3   5.396e+006 ed EO
assign (residue 14 and name HN) (residue 14 and name HA)           2.350  0.650  0.650  !  8.275e+006     1   8.275e+006
assign (residue 20 and name HG1#) (residue 20 and name HA)         3.100  1.400  1.400  !  1.470e+007     3   4.899e+006
assign (residue 88 and name HN) (residue 89 and name HG2#)         3.600  1.900  2.400  !  3.074e+006     3   1.025e+006
assign (residue 29 and name HN) (residue 28 and name HA)           2.850  1.150  1.150  !  5.079e+006     1   5.079e+006
assign (residue 82 and name HD#) (residue 82 and name HA)          3.350  1.650  2.150  !  2.302e+006     2   1.151e+006
assign (residue 100 and name HA) (residue 100 and name HB#)        2.350  0.650  0.650  !  1.853e+007     2   9.266e+006
assign (residue 103 and name HN) (residue 101 and name HB#)        3.100  1.400  1.400  !  9.660e+006     3   3.220e+006
assign (residue 95 and name HA) (residue 98 and name HB#)          3.350  1.650  2.150  !  3.960e+006     2   1.980e+006
assign (residue 65 and name HA) (residue 68 and name HD1#)         3.600  1.900  2.400  !  3.612e+006     3   1.204e+006
assign (residue 96 and name HN) (residue 93 and name HA)           2.850  1.150  1.150  !  6.255e+006     1   6.255e+006
!assign (residue 9 and name HD1#) (residue 8 and name HB#)          3.600  1.900  2.400  !  5.611e+006     6   9.352e+005 ed EO
assign (residue 91 and name HN) (residue 9 and name HD1#)          3.600  1.900  2.400  !  2.196e+006     3   7.321e+005
assign (residue 38 and name HD#) (residue 38 and name HA)          3.350  1.650  2.150  !  5.965e+006     2   2.983e+006
assign (residue 24 and name HA2) (residue 25 and name HA)          3.350  1.650  2.150  !  5.982e+006     1   5.982e+006 ed EO
assign (residue 8 and name HN) (residue 11 and name HG2#)          3.600  1.900  2.400  !  6.034e+006     3   2.011e+006
assign (residue 59 and name HD1) (residue 35 and name HD1#)        3.600  1.900  2.400  !  3.441e+006     3   1.147e+006
assign (residue 40 and name HA) (residue 40 and name HB)           2.350  0.650  0.650  !  9.518e+006     1   9.518e+006
assign (residue 97 and name HD1) (residue 97 and name HA)          3.350  1.650  2.150  !  2.774e+006     1   2.774e+006
assign (residue 32 and name HB2) (residue 35 and name HB#)         3.350  1.650  2.150  !  3.862e+006     2   1.931e+006
assign (residue 95 and name HD1#) (residue 95 and name HA)         3.600  1.900  2.400  !  5.744e+006     3   1.915e+006
assign (residue 97 and name HB1) (residue 97 and name HA)          2.350  0.650  0.650  !  8.261e+006     1   8.261e+006
assign (residue 64 and name HA) (residue 64 and name HB#)          3.350  1.650  2.150  !  1.779e+006     2   8.894e+005
assign (residue 3 and name HG2#) (residue 3 and name HB)           2.600  0.900  0.900  !  3.275e+007     3   1.092e+007
assign (residue 59 and name HE1) (residue 40 and name HB)          3.350  1.650  2.150  !  2.038e+006     1   2.038e+006
assign (residue 95 and name HD1#) (residue 65 and name HA)         3.100  1.400  1.400  !  1.816e+007     3   6.054e+006
assign (residue 94 and name HN) (residue 9 and name HG2#)          3.600  1.900  2.400  !  7.352e+006     3   2.451e+006
assign (residue 67 and name HA) (residue 67 and name HB2)          3.350  1.650  2.150  !  2.372e+006     1   2.372e+006
assign (residue 81 and name HB) (residue 81 and name HD1#)         2.600  0.900  0.900  !  2.728e+007     3   9.092e+006
assign (residue 8 and name HN) (residue 11 and name HG1#)          3.600  1.900  2.400  !  3.437e+006     3   1.146e+006
assign (residue 53 and name HB#) (residue 50 and name HA)          2.350  0.650  0.650  !  2.042e+007     2   1.021e+007
assign (residue 98 and name HD2#) (residue 20 and name HG2#)       3.350  1.650  2.150  !  3.621e+007     9   4.023e+006
assign (residue 72 and name HB#) (residue 72 and name HE#)         3.350  1.650  2.150  !  5.958e+006     4   1.489e+006
assign (residue 77 and name HN) (residue 77 and name HA2)          2.850  1.150  1.150  !  5.895e+006     1   5.895e+006
assign (residue 41 and name HA2) (residue 40 and name HA)          3.350  1.650  2.150  !  7.766e+006     1   7.766e+006 ed EO
assign (residue 67 and name HD2) (residue 68 and name HD1#)        3.600  1.900  2.400  !  3.346e+006     3   1.115e+006
assign (residue 81 and name HA) (residue 81 and name HG2#)         2.600  0.900  0.900  !  3.319e+007     3   1.106e+007
assign (residue 100 and name HN) (residue 101 and name HB#)        3.600  1.900  2.400  !  1.001e+007     3   3.337e+006 ed EO
assign (residue 47 and name HB) (residue 47 and name HA)           2.350  0.650  0.650  !  9.546e+006     1   9.546e+006
assign (residue 40 and name HG2#) (residue 75 and name HD1#)       3.850  2.150  2.150  !  1.727e+007     9   1.919e+006
assign (residue 15 and name HA) (residue 15 and name HB#)          2.600  0.900  0.900  !  3.974e+007     3   1.325e+007
assign (residue 10 and name HN) (residue 10 and name HA)           2.850  1.150  1.150  !  7.217e+006     1   7.217e+006
assign (residue 9 and name HN) (residue 8 and name HB#)            2.850  1.150  1.150  !  8.699e+006     2   4.349e+006
assign (residue 101 and name HB#) (residue 20 and name HG2#)       3.350  1.650  2.150  !  5.691e+007     9   6.324e+006
assign (residue 90 and name HN) (residue 85 and name HG2#)         3.350  1.650  2.150  !  9.697e+006     3   3.232e+006
assign (residue 31 and name HB1) (residue 31 and name HA)          2.850  1.150  1.150  !  4.358e+006     1   4.358e+006
assign (residue 94 and name HA) (residue 94 and name HD1#)         3.100  1.400  1.400  !  2.154e+007     3   7.180e+006
assign (residue 71 and name HG2) (residue 84 and name HA2)         2.850  1.150  1.150  !  3.982e+006     1   3.982e+006
assign (residue 91 and name HA) (residue 94 and name HD1#)         3.600  1.900  2.400  !  1.755e+007     3   5.851e+006 ed EO
!assign (residue 52 and name HN) (residue 49 and name HB)           3.350  1.650  2.150  !  8.218e+006     1   8.218e+006 ed EO
assign (residue 89 and name HB) (residue 90 and name HG#)          3.350  1.650  2.150  !  1.238e+007     2   6.191e+006 ed EO
assign (residue 101 and name HA) (residue 101 and name HB#)        2.600  0.900  0.900  !  5.489e+007     3   1.830e+007
assign (residue 45 and name HN) (residue 45 and name HA1)          3.350  1.650  2.150  !  2.227e+006     1   2.227e+006
assign (residue 97 and name HD2) (residue 7 and name HA)           3.350  1.650  2.150  !  2.127e+006     1   2.127e+006
assign (residue 99 and name HG#) (residue 95 and name HG2#)        3.600  1.900  2.400  !  6.028e+007     6   1.005e+007 ed EO
assign (residue 23 and name HA1) (residue 22 and name HA)          3.350  1.650  2.150  !  2.291e+006     1   2.291e+006
assign (residue 27 and name HN) (residue 19 and name HG2#)         3.600  1.900  2.400  !  1.882e+006     3   6.275e+005
assign (residue 79 and name HA) (residue 78 and name HG2#)         3.350  1.650  2.150  !  2.230e+007     3   7.434e+006 ed EO
!assign (residue 78 and name HG2#) (residue 75 and name HD1#)       3.850  2.150  2.150  !  1.789e+007     9   1.988e+006
assign (residue 20 and name HN) (residue 21 and name HG#)          3.350  1.650  2.150  !  5.752e+006     2   2.876e+006
assign (residue 44 and name HD#) (residue 43 and name HB#)         3.350  1.650  2.150  !  1.117e+007     6   1.861e+006
assign (residue 8 and name HD#) (residue 9 and name HD1#)          3.350  1.650  2.150  !  7.644e+007     6   1.274e+007 ed EO
assign (residue 95 and name HD1#) (residue 61 and name HG#)        3.350  1.650  2.150  !  3.420e+006     6   5.700e+005
assign (residue 36 and name HA) (residue 36 and name HB2)          2.850  1.150  1.150  !  4.186e+006     1   4.186e+006
assign (residue 51 and name HA) (residue 75 and name HG2#)         3.100  1.400  1.400  !  1.352e+007     3   4.507e+006
assign (residue 47 and name HB) (residue 47 and name HG2#)         2.600  0.900  0.900  !  5.770e+007     3   1.923e+007
assign (residue 78 and name HN) (residue 75 and name HG2#)         3.600  1.900  2.400  !  7.595e+006     3   2.532e+006
assign (residue 90 and name HG#) (residue 9 and name HG2#)         3.600  1.900  2.400  !  1.281e+007     6   2.134e+006 ed EO
assign (residue 64 and name HD1#) (residue 64 and name HB#)        3.350  1.650  2.150  !  5.800e+006     6   9.667e+005
assign (residue 12 and name HN) (residue 9 and name HA)            2.850  1.150  1.150  !  3.732e+006     1   3.732e+006
assign (residue 12 and name HA) (residue 12 and name HG2)          2.850  1.150  1.150  !  1.243e+007     1   1.243e+007 ed EO
assign (residue 5 and name HN) (residue 2 and name HB2)            2.850  1.150  1.150  !  4.828e+006     1   4.828e+006
assign (residue 63 and name HB) (residue 63 and name HG2#)         2.600  0.900  0.900  !  4.627e+007     3   1.542e+007
assign (residue 92 and name HN) (residue 91 and name HA)           3.350  1.650  2.150  !  2.064e+006     1   2.064e+006
assign (residue 85 and name HD1#) (residue 90 and name HG#)        3.350  1.650  2.150  !  2.645e+006     6   4.409e+005
assign (residue 22 and name HN) (residue 21 and name HA)           2.350  0.650  0.650  !  1.596e+007     1   1.596e+007
assign (residue 103 and name HN) (residue 99 and name HA)          3.350  1.650  2.150  !  2.967e+006     1   2.967e+006
assign (residue 21 and name HN) (residue 19 and name HG2#)         3.600  1.900  2.400  !  4.018e+006     3   1.339e+006
assign (residue 31 and name HA) (residue 19 and name HB)           3.350  1.650  2.150  !  2.246e+006     1   2.246e+006
assign (residue 65 and name HA) (residue 95 and name HD1#)         2.600  0.900  0.900  !  3.045e+007     3   1.015e+007
assign (residue 51 and name HN) (residue 51 and name HB#)          2.600  0.900  0.900  !  3.524e+007     3   1.175e+007
assign (residue 25 and name HG#) (residue 24 and name HA1)         3.350  1.650  2.150  !  3.505e+006     2   1.752e+006
assign (residue 91 and name HA) (residue 85 and name HD1#)         3.600  1.900  2.400  !  6.925e+006     3   2.308e+006
assign (residue 47 and name HA) (residue 47 and name HG2#)         2.600  0.900  0.900  !  3.959e+007     3   1.320e+007
assign (residue 99 and name HA) (residue 95 and name HG2#)         3.600  1.900  2.400  !  1.756e+007     3   5.854e+006 ed EO
assign (residue 64 and name HG) (residue 67 and name HB2)          3.350  1.650  2.150  !  3.019e+006     1   3.019e+006
assign (residue 78 and name HB) (residue 72 and name HA)           3.350  1.650  2.150  !  3.137e+006     1   3.137e+006 ed EO
assign (residue 58 and name HG2#) (residue 39 and name HB#)        3.600  1.900  2.400  !  3.447e+006     6   5.746e+005 ed EO
assign (residue 7 and name HE#) (residue 7 and name HG#)           3.350  1.650  2.150  !  5.792e+006     4   1.448e+006
assign (residue 72 and name HA) (residue 72 and name HG#)          2.850  1.150  1.150  !  8.419e+006     2   4.209e+006
assign (residue 78 and name HB) (residue 51 and name HB#)          3.600  1.900  2.400  !  2.929e+006     3   9.764e+005
assign (residue 29 and name HN) (residue 28 and name HG2#)         3.600  1.900  2.400  !  5.597e+006     3   1.866e+006
assign (residue 36 and name HD1) (residue 95 and name HG2#)        3.100  1.400  1.400  !  1.786e+007     3   5.954e+006
assign (residue 78 and name HA) (residue 78 and name HB)           2.850  1.150  1.150  !  3.654e+006     1   3.654e+006
assign (residue 95 and name HN) (residue 95 and name HA)           2.850  1.150  1.150  !  3.483e+006     1   3.483e+006
assign (residue 45 and name HA2) (residue 45 and name HA1)         2.350  0.650  0.650  !  1.606e+007     1   1.606e+007
assign (residue 65 and name HN) (residue 65 and name HA)           2.850  1.150  1.150  !  4.930e+006     1   4.930e+006
assign (residue 10 and name HD1) (residue 15 and name HB#)         3.600  1.900  2.400  !  7.978e+006     3   2.659e+006
assign (residue 9 and name HA) (residue 9 and name HG12)           2.850  1.150  1.150  !  5.663e+006     1   5.663e+006
assign (residue 84 and name HN) (residue 84 and name HA2)          2.850  1.150  1.150  !  6.780e+006     1   6.780e+006
assign (residue 36 and name HD2) (residue 35 and name HD2#)        3.600  1.900  2.400  !  3.933e+006     3   1.311e+006
assign (residue 39 and name HN) (residue 39 and name HA)           2.850  1.150  1.150  !  3.805e+006     1   3.805e+006
assign (residue 36 and name HD#) (residue 99 and name HA)          3.350  1.650  2.150  !  3.108e+006     2   1.554e+006
assign (residue 71 and name HD1) (residue 71 and name HD2)         2.850  1.150  1.150  !  6.623e+006     1   6.623e+006
assign (residue 32 and name HB2) (residue 20 and name HG1#)        3.100  1.400  1.400  !  1.461e+007     3   4.870e+006
assign (residue 91 and name HN) (residue 65 and name HE#)          3.600  1.900  2.400  !  6.131e+006     3   2.044e+006
assign (residue 56 and name HA2) (residue 57 and name HG2#)        3.600  1.900  2.400  !  6.684e+006     3   2.228e+006
assign (residue 97 and name HD2) (residue 7 and name HG#)          3.350  1.650  2.150  !  2.329e+006     2   1.164e+006
assign (residue 41 and name HN) (residue 41 and name HA1)          2.850  1.150  1.150  !  4.417e+006     1   4.417e+006
assign (residue 6 and name HN) (residue 4 and name HA)             2.850  1.150  1.150  !  5.596e+006     1   5.596e+006
assign (residue 38 and name HG#) (residue 38 and name HD#)         2.850  1.150  1.150  !  1.485e+007     4   3.712e+006
assign (residue 57 and name HN) (residue 57 and name HG2#)         3.100  1.400  1.400  !  1.733e+007     3   5.777e+006
assign (residue 89 and name HN) (residue 89 and name HG2#)         2.600  0.900  0.900  !  3.426e+007     3   1.142e+007
assign (residue 36 and name HN) (residue 35 and name HD2#)         3.600  1.900  2.400  !  2.671e+006     3   8.902e+005
assign (residue 67 and name HB1) (residue 64 and name HD2#)        3.600  1.900  2.400  !  4.981e+006     3   1.660e+006
assign (residue 78 and name HN) (residue 49 and name HG2#)         3.600  1.900  2.400  !  4.760e+006     3   1.587e+006
assign (residue 54 and name HB1) (residue 51 and name HA)          2.850  1.150  1.150  !  3.920e+006     1   3.920e+006
assign (residue 78 and name HB) (residue 78 and name HA)           2.850  1.150  1.150  !  4.220e+006     1   4.220e+006
assign (residue 51 and name HB#) (residue 51 and name HA)          2.600  0.900  0.900  !  2.779e+007     3   9.264e+006
assign (residue 97 and name HB2) (residue 96 and name HB#)         3.350  1.650  2.150  !  1.412e+007     3   4.706e+006 ed EO
assign (residue 72 and name HA) (residue 72 and name HB#)          2.850  1.150  1.150  !  7.505e+006     2   3.752e+006
assign (residue 60 and name HE#) (residue 63 and name HG2#)        3.600  1.900  2.400  !  3.027e+007     6   5.045e+006 ed EO
assign (residue 35 and name HD2#) (residue 35 and name HD1#)       3.350  1.650  2.150  !  2.824e+007     9   3.138e+006
assign (residue 98 and name HD1#) (residue 68 and name HD2#)       3.850  2.150  2.150  !  1.303e+007     9   1.448e+006
assign (residue 17 and name HA) (residue 28 and name HB)           2.850  1.150  1.150  !  4.782e+006     1   4.782e+006
assign (residue 98 and name HG) (residue 98 and name HB#)          2.850  1.150  1.150  !  1.112e+007     2   5.559e+006
assign (residue 78 and name HB) (residue 76 and name HA)           3.350  1.650  2.150  !  1.779e+006     1   1.779e+006
assign (residue 6 and name HN) (residue 5 and name HA)             2.850  1.150  1.150  !  7.772e+006     1   7.772e+006 ed EO
assign (residue 71 and name HD2) (residue 71 and name HD1)         2.350  0.650  0.650  !  1.082e+007     1   1.082e+007
assign (residue 29 and name HN) (residue 17 and name HA)           3.350  1.650  2.150  !  2.875e+006     1   2.875e+006
assign (residue 69 and name HN) (residue 68 and name HB1)          3.350  1.650  2.150  !  2.950e+006     1   2.950e+006
assign (residue 94 and name HA) (residue 94 and name HB2)          3.350  1.650  2.150  !  2.802e+006     1   2.802e+006
assign (residue 93 and name HB#) (residue 9 and name HD1#)         2.850  1.150  1.150  !  1.934e+007     6   3.224e+006
assign (residue 98 and name HA) (residue 20 and name HG1#)         3.600  1.900  2.400  !  8.270e+006     3   2.757e+006
assign (residue 65 and name HA) (residue 68 and name HA)           3.350  1.650  2.150  !  2.175e+006     1   2.175e+006
assign (residue 96 and name HB#) (residue 3 and name HA)           3.600  1.900  2.400  !  4.142e+006     3   1.381e+006
assign (residue 47 and name HN) (residue 47 and name HB)           2.350  0.650  0.650  !  8.414e+006     1   8.414e+006
assign (residue 65 and name HG2) (residue 65 and name HA)          2.350  0.650  0.650  !  1.290e+007     1   1.290e+007
assign (residue 38 and name HG#) (residue 38 and name HA)          2.350  0.650  0.650  !  1.882e+007     2   9.410e+006
assign (residue 59 and name HN) (residue 58 and name HB)           3.350  1.650  2.150  !  2.646e+006     1   2.646e+006
assign (residue 64 and name HB#) (residue 95 and name HD1#)        2.850  1.150  1.150  !  3.193e+007     6   5.322e+006
assign (residue 75 and name HN) (residue 78 and name HG2#)         3.100  1.400  1.400  !  1.004e+007     3   3.347e+006
assign (residue 85 and name HN) (residue 85 and name HD1#)         3.600  1.900  2.400  !  7.139e+006     3   2.380e+006
assign (residue 85 and name HD1#) (residue 68 and name HD2#)       3.850  2.150  2.150  !  1.472e+007     9   1.635e+006
assign (residue 48 and name HD1) (residue 48 and name HB1)         3.350  1.650  2.150  !  2.356e+006     1   2.356e+006
assign (residue 81 and name HB) (residue 81 and name HA)           3.350  1.650  2.150  !  2.385e+006     1   2.385e+006
assign (residue 49 and name HG2#) (residue 78 and name HA)         3.600  1.900  2.400  !  4.504e+006     3   1.501e+006
assign (residue 27 and name HN) (residue 30 and name HA)           3.350  1.650  2.150  !  8.457e+006     1   8.457e+006 ed EO
assign (residue 68 and name HD1#) (residue 95 and name HA)         3.600  1.900  2.400  !  3.060e+006     3   1.020e+006
assign (residue 102 and name HG2#) (residue 101 and name HA)       3.600  1.900  2.400  !  5.268e+006     3   1.756e+006
assign (residue 24 and name HA2) (residue 21 and name HG#)         3.350  1.650  2.150  !  4.654e+006     2   2.327e+006
assign (residue 22 and name HG#) (residue 22 and name HA)          2.850  1.150  1.150  !  7.715e+006     2   3.858e+006
assign (residue 98 and name HA) (residue 94 and name HD1#)         3.600  1.900  2.400  !  2.134e+007     3   7.112e+006 ed EO
assign (residue 8 and name HE#) (residue 8 and name HB#)           3.350  1.650  2.150  !  1.070e+007     4   2.675e+006
assign (residue 33 and name HD2) (residue 21 and name HA)          3.350  1.650  2.150  !  4.591e+006     1   4.591e+006 ed EO
assign (residue 36 and name HN) (residue 35 and name HB#)          3.350  1.650  2.150  !  2.568e+006     2   1.284e+006
assign (residue 68 and name HD2#) (residue 91 and name HA)         3.600  1.900  2.400  !  3.626e+006     3   1.209e+006
assign (residue 95 and name HN) (residue 95 and name HD1#)         3.100  1.400  1.400  !  1.284e+007     3   4.280e+006
!assign (residue 67 and name HB2) (residue 68 and name HD2#)        3.600  1.900  2.400  !  2.911e+006     3   9.704e+005
assign (residue 19 and name HA) (residue 20 and name HG2#)         3.600  1.900  2.400  !  8.135e+006     3   2.712e+006
assign (residue 74 and name HD1) (residue 74 and name HB2)         3.350  1.650  2.150  !  1.124e+006     1   1.124e+006
assign (residue 101 and name HA) (residue 102 and name HA)         3.350  1.650  2.150  !  1.827e+006     1   1.827e+006
assign (residue 3 and name HN) (residue 3 and name HA)             2.850  1.150  1.150  !  4.529e+006     1   4.529e+006
!assign (residue 48 and name HB2) (residue 50 and name HA)          3.350  1.650  2.150  !  3.314e+006     1   3.314e+006 ed EO
assign (residue 73 and name HA) (residue 73 and name HE#)          3.350  1.650  2.150  !  1.101e+007     2   5.503e+006 ed EO
assign (residue 8 and name HA) (residue 11 and name HG2#)          2.600  0.900  0.900  !  3.379e+007     3   1.126e+007
assign (residue 92 and name HA) (residue 89 and name HA)           3.350  1.650  2.150  !  7.043e+006     1   7.043e+006 ed EO
assign (residue 9 and name HD1#) (residue 9 and name HB)           3.100  1.400  1.400  !  1.304e+007     3   4.348e+006
assign (residue 20 and name HN) (residue 19 and name HB)           2.350  0.650  0.650  !  8.658e+006     1   8.658e+006
assign (residue 68 and name HN) (residue 68 and name HD1#)         3.600  1.900  2.400  !  6.219e+006     3   2.073e+006
assign (residue 85 and name HD1#) (residue 9 and name HB)          3.600  1.900  2.400  !  2.690e+006     3   8.967e+005
!assign (residue 90 and name HN) (residue 85 and name HD1#)         3.100  1.400  1.400  !  1.840e+007     3   6.133e+006
assign (residue 28 and name HB) (residue 17 and name HA)           2.850  1.150  1.150  !  4.369e+006     1   4.369e+006
assign (residue 63 and name HN) (residue 60 and name HG#)          3.350  1.650  2.150  !  1.863e+006     2   9.313e+005
assign (residue 26 and name HN) (residue 26 and name HA)           2.850  1.150  1.150  !  3.150e+006     1   3.150e+006
assign (residue 10 and name HN) (residue 11 and name HG1#)         3.600  1.900  2.400  !  7.630e+006     3   2.543e+006
assign (residue 3 and name HN) (residue 3 and name HG1#)           2.600  0.900  0.900  !  5.109e+007     3   1.703e+007
assign (residue 57 and name HG2#) (residue 57 and name HA)         3.100  1.400  1.400  !  1.489e+007     3   4.964e+006
assign (residue 51 and name HN) (residue 51 and name HA)           2.350  0.650  0.650  !  1.149e+007     1   1.149e+007
assign (residue 44 and name HG#) (residue 43 and name HB#)         3.600  1.900  2.400  !  1.416e+007     6   2.361e+006 ed EO
assign (residue 95 and name HG2#) (residue 95 and name HD1#)       3.350  1.650  2.150  !  4.940e+007     9   5.489e+006
assign (residue 12 and name HB#) (residue 9 and name HA)           3.350  1.650  2.150  !  4.758e+006     2   2.379e+006
assign (residue 11 and name HG1#) (residue 7 and name HA)          3.600  1.900  2.400  !  6.850e+006     3   2.283e+006
assign (residue 40 and name HG2#) (residue 40 and name HB)         3.100  1.400  1.400  !  1.015e+007     3   3.383e+006
assign (residue 21 and name HG#) (residue 19 and name HG2#)        3.350  1.650  2.150  !  1.358e+007     6   2.264e+006
assign (residue 60 and name HN) (residue 60 and name HA)           2.850  1.150  1.150  !  5.009e+006     1   5.009e+006
assign (residue 74 and name HB2) (residue 74 and name HB1)         3.350  1.650  2.150  !  1.732e+006     1   1.732e+006
assign (residue 96 and name HB#) (residue 96 and name HA)          2.600  0.900  0.900  !  2.492e+007     3   8.307e+006
assign (residue 50 and name HN) (residue 49 and name HB)           2.350  0.650  0.650  !  8.317e+006     1   8.317e+006
assign (residue 65 and name HG2) (residue 95 and name HG2#)        3.600  1.900  2.400  !  2.491e+007     3   8.305e+006 ed EO
assign (residue 57 and name HA) (residue 57 and name HG2#)         2.600  0.900  0.900  !  3.786e+007     3   1.262e+007
assign (residue 72 and name HN) (residue 71 and name HA)           3.350  1.650  2.150  !  1.604e+006     1   1.604e+006
assign (residue 95 and name HN) (residue 94 and name HD1#)         3.350  1.650  2.150  !  1.878e+007     3   6.261e+006 ed EO
assign (residue 11 and name HG2#) (residue 11 and name HA)         3.100  1.400  1.400  !  1.544e+007     3   5.147e+006
assign (residue 102 and name HG2#) (residue 20 and name HA)        3.600  1.900  2.400  !  2.414e+006     3   8.046e+005
assign (residue 98 and name HD1#) (residue 98 and name HB#)        3.350  1.650  2.150  !  4.298e+006     6   7.163e+005
assign (residue 52 and name HD21) (residue 41 and name HA1)        3.350  1.650  2.150  !  2.328e+006     1   2.328e+006
assign (residue 21 and name HN) (residue 20 and name HG2#)         3.100  1.400  1.400  !  1.285e+007     3   4.283e+006
assign (residue 31 and name HN) (residue 31 and name HB1)          2.850  1.150  1.150  !  3.847e+006     1   3.847e+006
assign (residue 37 and name HA2) (residue 37 and name HA1)         2.350  0.650  0.650  !  1.673e+007     1   1.673e+007
assign (residue 35 and name HN) (residue 32 and name HB2)          3.350  1.650  2.150  !  1.678e+006     1   1.678e+006
assign (residue 74 and name HN) (residue 76 and name HD1)          2.850  1.150  1.150  !  3.394e+006     1   3.394e+006
assign (residue 68 and name HB1) (residue 68 and name HA)          3.350  1.650  2.150  !  2.717e+006     1   2.717e+006
assign (residue 94 and name HN) (residue 90 and name HA)           2.850  1.150  1.150  !  6.389e+006     1   6.389e+006
assign (residue 11 and name HN) (residue 11 and name HB)           2.850  1.150  1.150  !  1.239e+007     1   1.239e+007 ed EO
assign (residue 71 and name HB1) (residue 71 and name HB2)         2.850  1.150  1.150  !  4.793e+006     1   4.793e+006
assign (residue 11 and name HB) (residue 11 and name HG2#)         2.600  0.900  0.900  !  6.610e+007     3   2.203e+007
assign (residue 101 and name HB#) (residue 101 and name HA)        2.600  0.900  0.900  !  2.482e+007     3   8.275e+006
assign (residue 78 and name HN) (residue 78 and name HG2#)         3.100  1.400  1.400  !  2.113e+007     3   7.045e+006
assign (residue 35 and name HG) (residue 35 and name HB#)          2.850  1.150  1.150  !  8.899e+006     2   4.450e+006
assign (residue 98 and name HD1#) (residue 20 and name HG1#)       3.850  2.150  2.150  !  2.596e+007     9   2.885e+006
assign (residue 50 and name HN) (residue 51 and name HA)           3.350  1.650  2.150  !  4.312e+006     1   4.312e+006 ed EO
assign (residue 7 and name HD#) (residue 7 and name HA)            3.350  1.650  2.150  !  6.340e+006     2   3.170e+006 ed EO
assign (residue 11 and name HN) (residue 9 and name HA)            3.350  1.650  2.150  !  2.094e+006     1   2.094e+006
assign (residue 35 and name HD1#) (residue 32 and name HA)         3.600  1.900  2.400  !  1.893e+006     3   6.311e+005
assign (residue 33 and name HD2) (residue 102 and name HA)         2.850  1.150  1.150  !  3.730e+006     1   3.730e+006
assign (residue 10 and name HN) (residue 9 and name HG2#)          3.100  1.400  1.400  !  1.184e+007     3   3.946e+006
assign (residue 32 and name HD1#) (residue 64 and name HD2#)       3.850  2.150  2.150  !  7.995e+006     9   8.883e+005
!assign (residue 100 and name HD#) (residue 101 and name HB#)       3.600  1.900  2.400  !  1.406e+007     6   2.343e+006 ed EO
assign (residue 9 and name HG2#) (residue 9 and name HG12)         3.600  1.900  2.400  !  6.558e+006     3   2.186e+006
assign (residue 94 and name HD2#) (residue 68 and name HB#)        3.350  1.650  2.150  !  6.969e+006     6   1.161e+006
assign (residue 90 and name HN) (residue 89 and name HG2#)         3.350  1.650  2.150  !  1.026e+007     3   3.422e+006 ed EO
assign (residue 61 and name HA) (residue 61 and name HB#)          2.850  1.150  1.150  !  8.277e+006     2   4.138e+006
assign (residue 98 and name HN) (residue 98 and name HA)           2.850  1.150  1.150  !  4.741e+006     1   4.741e+006
assign (residue 49 and name HN) (residue 49 and name HA)           2.350  0.650  0.650  !  1.154e+007     1   1.154e+007
assign (residue 71 and name HA) (residue 70 and name HA)           3.350  1.650  2.150  !  3.315e+006     1   3.315e+006
assign (residue 25 and name HN) (residue 25 and name HA)           2.350  0.650  0.650  !  1.555e+007     1   1.555e+007
assign (residue 64 and name HD2#) (residue 95 and name HA)         3.600  1.900  2.400  !  2.899e+006     3   9.664e+005
assign (residue 64 and name HD1#) (residue 95 and name HG2#)       3.850  2.150  2.150  !  1.482e+007     9   1.647e+006
assign (residue 78 and name HG2#) (residue 75 and name HG2#)       3.850  2.150  2.150  !  2.469e+007     9   2.743e+006
assign (residue 22 and name HD#) (residue 22 and name HA)          2.850  1.150  1.150  !  8.223e+006     2   4.111e+006
assign (residue 103 and name HD22) (residue 34 and name HA2)       2.850  1.150  1.150  !  3.659e+006     1   3.659e+006
assign (residue 13 and name HB#) (residue 13 and name HA)          2.350  0.650  0.650  !  1.791e+007     2   8.954e+006
assign (residue 53 and name HA) (residue 52 and name HB#)          3.350  1.650  2.150  !  4.284e+006     2   2.142e+006
assign (residue 25 and name HA) (residue 25 and name HB#)          2.850  1.150  1.150  !  1.179e+007     2   5.893e+006
assign (residue 101 and name HN) (residue 100 and name HB#)        2.850  1.150  1.150  !  1.368e+007     2   6.838e+006
assign (residue 97 and name HN) (residue 97 and name HA)           2.350  0.650  0.650  !  1.086e+007     1   1.086e+007
assign (residue 47 and name HN) (residue 47 and name HG2#)         3.600  1.900  2.400  !  7.293e+006     3   2.431e+006
assign (residue 21 and name HA) (residue 21 and name HG#)          2.850  1.150  1.150  !  9.031e+006     2   4.516e+006
assign (residue 73 and name HN) (residue 72 and name HB#)          3.350  1.650  2.150  !  2.552e+006     2   1.276e+006
assign (residue 12 and name HN) (residue 11 and name HA)           2.850  1.150  1.150  !  4.727e+006     1   4.727e+006
assign (residue 95 and name HD1#) (residue 95 and name HG2#)       3.350  1.650  2.150  !  4.822e+007     9   5.358e+006
assign (residue 11 and name HN) (residue 8 and name HA)            3.350  1.650  2.150  !  2.476e+006     1   2.476e+006
assign (residue 95 and name HN) (residue 94 and name HA)           2.850  1.150  1.150  !  7.180e+006     1   7.180e+006
assign (residue 78 and name HG2#) (residue 81 and name HD1#)       3.850  2.150  2.150  !  5.036e+006     9   5.596e+005
assign (residue 94 and name HB1) (residue 94 and name HD1#)        2.600  0.900  0.900  !  2.516e+007     3   8.388e+006
assign (residue 57 and name HA) (residue 57 and name HD1#)         3.350  1.650  2.150  !  3.042e+007     3   1.014e+007 ed EO
assign (residue 16 and name HE21) (residue 16 and name HG2)        3.350  1.650  2.150  !  2.255e+006     1   2.255e+006
assign (residue 53 and name HA) (residue 53 and name HG#)          2.850  1.150  1.150  !  1.691e+007     2   8.456e+006 ed EO
assign (residue 81 and name HN) (residue 81 and name HD1#)         3.100  1.400  1.400  !  1.033e+007     3   3.444e+006
assign (residue 31 and name HN) (residue 43 and name HB#)          3.600  1.900  2.400  !  3.960e+006     3   1.320e+006
assign (residue 88 and name HB#) (residue 88 and name HA)          2.850  1.150  1.150  !  1.396e+007     2   6.980e+006
assign (residue 83 and name HB#) (residue 13 and name HE#)         3.350  1.650  2.150  !  6.810e+006     6   1.135e+006
assign (residue 102 and name HA) (residue 103 and name HA)         3.350  1.650  2.150  !  4.417e+006     1   4.417e+006 ed EO
assign (residue 58 and name HN) (residue 60 and name HG#)          3.350  1.650  2.150  !  1.934e+006     2   9.672e+005
assign (residue 43 and name HA) (residue 42 and name HA)           3.350  1.650  2.150  !  7.748e+006     1   7.748e+006 ed EO
!assign (residue 101 and name HA) (residue 103 and name HB1)        3.350  1.650  2.150  !  5.834e+006     1   5.834e+006 ed EO
assign (residue 90 and name HA) (residue 9 and name HD1#)          2.600  0.900  0.900  !  2.698e+007     3   8.994e+006
assign (residue 41 and name HA2) (residue 41 and name HA1)         2.350  0.650  0.650  !  8.885e+006     1   8.885e+006
assign (residue 98 and name HD2#) (residue 98 and name HB#)        3.350  1.650  2.150  !  3.872e+006     6   6.454e+005
assign (residue 11 and name HN) (residue 15 and name HB#)          3.600  1.900  2.400  !  7.396e+006     3   2.465e+006
assign (residue 57 and name HD1#) (residue 59 and name HA)         3.600  1.900  2.400  !  2.793e+006     3   9.309e+005
!assign (residue 74 and name HB2) (residue 75 and name HD1#)        3.600  1.900  2.400  !  5.408e+006     3   1.803e+006
assign (residue 66 and name HN) (residue 65 and name HA)           2.850  1.150  1.150  !  5.682e+006     1   5.682e+006
assign (residue 28 and name HN) (residue 28 and name HA)           3.350  1.650  2.150  !  2.638e+006     1   2.638e+006
assign (residue 17 and name HN) (residue 16 and name HB1)          2.850  1.150  1.150  !  4.797e+006     1   4.797e+006
assign (residue 24 and name HN) (residue 24 and name HA1)          2.350  0.650  0.650  !  8.782e+006     1   8.782e+006
assign (residue 51 and name HA) (residue 51 and name HB#)          2.600  0.900  0.900  !  4.785e+007     3   1.595e+007
assign (residue 103 and name HN) (residue 103 and name HB1)        2.850  1.150  1.150  !  1.657e+007     1   1.657e+007 ed EO
assign (residue 20 and name HG1#) (residue 32 and name HD2#)       3.600  1.900  2.400  !  3.250e+007     9   3.611e+006 ed EO
assign (residue 95 and name HA) (residue 95 and name HD1#)         3.100  1.400  1.400  !  9.863e+006     3   3.288e+006
assign (residue 10 and name HD2) (residue 20 and name HG1#)        3.600  1.900  2.400  !  8.749e+006     3   2.916e+006
assign (residue 58 and name HA) (residue 58 and name HB)           2.850  1.150  1.150  !  7.276e+006     1   7.276e+006
assign (residue 71 and name HD2) (residue 71 and name HB1)         3.350  1.650  2.150  !  1.963e+006     1   1.963e+006
!assign (residue 63 and name HG2#) (residue 58 and name HG2#)       3.600  1.900  2.400  !  2.880e+007     9   3.200e+006 ed EO
assign (residue 14 and name HB1) (residue 14 and name HB2)         2.850  1.150  1.150  !  4.873e+006     1   4.873e+006
assign (residue 61 and name HA) (residue 61 and name HG#)          2.850  1.150  1.150  !  6.168e+006     2   3.084e+006
assign (residue 63 and name HB) (residue 60 and name HG#)          3.350  1.650  2.150  !  4.169e+006     2   2.084e+006
assign (residue 100 and name HE#) (residue 100 and name HB#)       3.350  1.650  2.150  !  5.365e+006     4   1.341e+006
assign (residue 21 and name HN) (residue 21 and name HA)           2.850  1.150  1.150  !  4.306e+006     1   4.306e+006
assign (residue 40 and name HN) (residue 40 and name HG2#)          2.600  0.900  0.900  !  3.405e+007     1   3.405e+007
assign (residue 11 and name HN) (residue 11 and name HA)           2.850  1.150  1.150  !  4.404e+006     1   4.404e+006
assign (residue 42 and name HA) (residue 41 and name HA2)          3.350  1.650  2.150  !  4.473e+006     1   4.473e+006 ed EO
assign (residue 61 and name HN) (residue 60 and name HA)           2.850  1.150  1.150  !  6.558e+006     1   6.558e+006
assign (residue 19 and name HN) (residue 19 and name HG2#)         3.100  1.400  1.400  !  1.005e+007     3   3.352e+006
assign (residue 68 and name HD2#) (residue 98 and name HD1#)       3.850  2.150  2.150  !  3.794e+006     9   4.216e+005
assign (residue 76 and name HD2) (residue 76 and name HD1)         2.350  0.650  0.650  !  2.526e+007     1   2.526e+007
assign (residue 47 and name HA) (residue 47 and name HB)           2.350  0.650  0.650  !  9.349e+006     1   9.349e+006
assign (residue 70 and name HB2) (residue 71 and name HD2)         3.350  1.650  2.150  !  5.538e+006     1   5.538e+006 ed EO
assign (residue 64 and name HD1#) (residue 35 and name HD1#)       3.850  2.150  2.150  !  5.827e+006     9   6.474e+005
assign (residue 41 and name HN) (residue 40 and name HB)           2.850  1.150  1.150  !  3.253e+006     1   3.253e+006
assign (residue 99 and name HG#) (residue 99 and name HA)          2.850  1.150  1.150  !  8.995e+006     2   4.497e+006
assign (residue 50 and name HA) (residue 50 and name HB#)          2.350  0.650  0.650  !  2.052e+007     2   1.026e+007
assign (residue 56 and name HN) (residue 57 and name HG2#)         3.600  1.900  2.400  !  3.239e+006     3   1.080e+006
assign (residue 46 and name HA) (residue 46 and name HB1)          2.850  1.150  1.150  !  5.978e+006     1   5.978e+006
assign (residue 76 and name HB#) (residue 76 and name HD1)         2.850  1.150  1.150  !  1.314e+007     2   6.569e+006
assign (residue 102 and name HN) (residue 98 and name HA)          2.850  1.150  1.150  !  4.804e+006     1   4.804e+006
assign (residue 93 and name HA) (residue 2 and name HB2)           3.350  1.650  2.150  !  3.035e+006     1   3.035e+006
!Pseudo-NOE to keep axis system in place on the FE of HEC (used for PCS restraints)
assign (resid 105 and name FE  ) (resid 500 and name OO  )   0.01  0.01  0.00
!Water NOEs to both amide and methyl resonances
assign (residue 200 and name H#) (residue 95 and name HD1#)     3.100  1.400  1.400
assign (residue 200 and name H#) (residue 98 and name HD2#)     3.100  1.400  1.400
assign (residue 200 and name H#) (residue 35 and name HD2#)     3.100  1.400  1.400
assign (residue 201 and name H#) (residue 75 and name HD1#)     3.100  1.400  1.400
assign (residue 201 and name H#) (residue 57 and name HD1#)     3.100  1.400  1.400
assign (residue 201 and name H#) (residue 63 and name HG2#)     3.100  1.400  1.400
assign (residue 202 and name H#) (residue 43 and name HB#)      3.100  1.400  1.400
assign (residue 202 and name H#) (residue 43 and name HN)        2.850  1.150  1.150
assign (residue 202 and name H#) (residue 31 and name HN)        2.850  1.150  1.150
assign (residue 202 and name H#) (residue 32 and name HN)        2.850  1.150  1.150
assign (residue 202 and name H#) (residue 32 and name HD2#)     3.100  1.400  1.400
assign (residue 203 and name H#) (residue 19 and name HN)        2.850  1.150  1.150
assign (residue 203 and name H#) (residue 20 and name HN)        2.850  1.150  1.150
assign (residue 203 and name H#) (residue 26 and name HN)        2.850  1.150  1.150
assign (residue 203 and name H#) (residue 32 and name HN)        2.850  1.150  1.150
!Heme NOEs to both backbone and side chain peaks
assign (residue 105 and name HMC#) (residue 16 and name HB2)       3.600  1.900  2.400
assign (residue 105 and name HBA#) (residue 41 and name HA2)       3.350  1.650  2.150
assign (residue 105 and name HB) (residue 32 and name HD2#)        3.350  1.650  2.150
assign (residue 105 and name HD) (residue 28 and name HG2#)        3.350  1.650  2.150
assign (residue 105 and name HBB#) (residue 68 and name HB#)       3.600  1.900  2.400
assign (residue 105 and name HAA2) (residue 32 and name HD2#)      3.600  1.900  2.400
assign (residue 105 and name HMB#) (residue 98 and name HD1#)      2.850  1.150  1.150
assign (residue 105 and name HMA#) (residue 64 and name HD2#)      3.350  1.650  2.150
assign (residue 105 and name HMB#) (residue 68 and name HD1#)      3.600  1.900  2.400
assign (residue 105 and name HMB#) (residue 68 and name HD1#)      3.600  1.900  2.400
assign (residue 105 and name HMD#) (residue 28 and name HG2#)      3.600  1.900  2.400
assign (residue 105 and name HMB#) (residue 98 and name HD2#)      2.850  1.150  1.150
assign (residue 105 and name HBD1) (residue 49 and name HG2#)      3.600  1.900  2.400
assign (residue 105 and name HBA#) (residue 32 and name HD2#)      3.350  1.650  2.150
assign (residue 105 and name HBB#) (residue 9 and name HG2#)       3.600  1.900  2.400
assign (residue 105 and name HMB#) (residue 94 and name HD1#)      3.600  1.900  2.400
assign (residue 105 and name HMA#) (residue 35 and name HD2#)      2.850  1.150  1.150
assign (residue 105 and name HMB#) (residue 94 and name HD2#)      2.850  1.150  1.150
assign (residue 105 and name HMB#) (residue 64 and name HD2#)      3.600  1.900  2.400
assign (residue 105 and name HBB#) (residue 85 and name HD1#)      3.600  1.900  2.400
assign (residue 105 and name HB) (residue 35 and name HD1#)        3.600  1.900  2.400
assign (residue 105 and name HBA#) (residue 43 and name HB#)       3.600  1.900  2.400
assign (residue 105 and name HBB#) (residue 68 and name HD1#)      3.350  1.650  2.150
assign (residue 105 and name HAA#) (residue 35 and name HD1#)      3.600  1.900  2.400
assign (residue 105 and name HMA#) (residue 35 and name HD1#)      2.850  1.150  1.150
assign (residue 105 and name HBB#) (residue 68 and name HD2#)      3.350  1.650  2.150
assign (residue 105 and name HMB#) (residue 68 and name HD2#)      3.850  2.150  2.150
assign (residue 105 and name HBA1) (residue 59 and name HE1)       3.350  1.650  2.150
assign (residue 105 and name HMD#) (residue 80 and name HN)        3.600  1.900  2.400
assign (residue 105 and name HAA2) (residue 59 and name HE1)       3.350  1.650  2.150
assign (residue 105 and name HBA#) (residue 41 and name HN)        3.600  1.900  2.400
assign (residue 105 and name HAB) (residue 15 and name HN)         3.350  1.650  2.150
assign (residue 105 and name HBA2) (residue 59 and name HE1)       3.350  1.650  2.150
assign (residue 105 and name HMC#) (residue 17 and name HN)        3.600  1.900  2.400
assign (residue 105 and name HBD1) (residue 80 and name HN)        3.350  1.650  2.150

!Secondary structure H-bonds
assign (residue 2 and name O) (residue 6 and name HN) 2.00 0.1 0.3
assign (residue 3 and name O) (residue 7 and name HN) 2.00 0.1 0.3
assign (residue 4 and name O) (residue 8 and name HN) 2.00 0.1 0.3
assign (residue 5 and name O) (residue 9 and name HN) 2.00 0.1 0.3
assign (residue 6 and name O) (residue 10 and name HN) 2.00 0.1 0.3
assign (residue 7 and name O) (residue 11 and name HN) 2.00 0.1 0.3
assign (residue 8 and name O) (residue 12 and name HN) 2.00 0.1 0.3
assign (residue 9 and name O) (residue 13 and name HN) 2.00 0.1 0.3
assign (residue 10 and name O) (residue 14 and name HN) 2.00 0.1 0.3
assign (residue 10 and name O) (residue 15 and name HN) 2.00 0.1 0.3
assign (residue 98 and name O) (residue 102 and name HN) 2.00 0.1 0.3
assign (residue 97 and name O) (residue 101 and name HN) 2.00 0.1 0.3
assign (residue 96 and name O) (residue 100 and name HN) 2.00 0.1 0.3
assign (residue 95 and name O) (residue 99 and name HN) 2.00 0.1 0.3
assign (residue 94 and name O) (residue 98 and name HN) 2.00 0.1 0.3
assign (residue 93 and name O) (residue 97 and name HN) 2.00 0.1 0.3
assign (residue 92 and name O) (residue 96 and name HN) 2.00 0.1 0.3
assign (residue 91 and name O) (residue 95 and name HN) 2.00 0.1 0.3
assign (residue 90 and name O) (residue 94 and name HN) 2.00 0.1 0.3
assign (residue 89 and name O) (residue 93 and name HN) 2.00 0.1 0.3
assign (residue 88 and name O) (residue 92 and name HN) 2.00 0.1 0.3
assign (residue 64 and name O) (residue 68 and name HN) 2.00 0.1 0.3
assign (residue 63 and name O) (residue 67 and name HN) 2.00 0.1 0.3
assign (residue 62 and name O) (residue 66 and name HN) 2.00 0.1 0.3
assign (residue 61 and name O) (residue 65 and name HN) 2.00 0.1 0.3
assign (residue 49 and name O) (residue 53 and name HN) 2.00 0.1 0.3
assign (residue 14 and name O) (residue 17 and name HN) 2.00 0.2 0.6
assign (residue 18 and name HN) (residue 15 and name O) 2.00 0.2 0.6
assign (residue 24 and name HN) (residue 21 and name O) 2.00 0.2 0.6
assign (residue 35 and name HN) (residue 32 and name O) 2.00 0.2 0.6
assign (residue 37 and name HN) (residue 59 and name O) 2.00 0.2 0.6
!assign (residue 39 and name O) (residue 35 and name HN) 2.00 0.2 0.6
assign (residue 40 and name HN) (residue 57 and name O) 2.00 0.2 0.6
assign (residue 53 and name HN) (residue 49 and name O) 2.00 0.2 0.6
assign (residue 54 and name HN) (residue 50 and name O) 2.00 0.2 0.6
assign (residue 55 and name HN) (residue 52 and name O) 2.00 0.2 0.6
assign (residue 59 and name HN) (residue 38 and name O) 2.00 0.2 0.6
assign (residue 60 and name O) (residue 64 and name HN) 2.00 0.2 0.6
assign (residue 65 and name O) (residue 69 and name HN) 2.00 0.2 0.6
assign (residue 70 and name O) (residue 74 and name HN) 2.00 0.2 0.6
assign (residue 71 and name O) (residue 75 and name HN) 2.00 0.2 0.6
assign (residue 75 and name O) (residue 78 and name HN) 2.00 0.2 0.6
assign (residue 68 and name O) (residue 85 and name HN) 2.00 0.2 0.6
assign (residue 87 and name O) (residue 91 and name HN) 2.00 0.2 0.6
assign (residue 90 and name O) (residue 94 and name HN) 2.00 0.2 0.6
!Non-secondary structure (longer range) H-bond restraints
assign (residue 93 and name OD1) (residue 2 and name HN) 2.00 0.2 0.6
assign (residue 30 and name O) (residue 18 and name HD1) 2.00 0.2 0.6
assign (residue 105 and name O2D) (residue 49 and name HN) 2.00 0.2 0.6
assign (residue 49 and name OG1) (residue 52 and name HN) 2.00 0.2 0.6
assign (residue 98 and name O) (residue 102 and name HG1) 2.00 0.2 0.6
!assign (residue 2 and name OD2) (residue 5 and name HZ1) 2.00 0.2 0.6
assign (residue 105 and name O2A) (residue 59 and name HE1) 2.00 0.2 0.6
!assign (residue 61 and name OE2) (residue 99 and name HZ1) 2.00 0.2 0.6
assign (residue 34 and name HN) (residue 102 and name O) 2.00 0.2 0.6
assign (residue 70 and name HN) (residue 67 and name O) 2.00 0.2 0.6
assign (residue 91 and name HN) (residue 88 and name O) 2.00 0.2 0.6
assign (residue 19 and name HG1) (residue 25 and name O) 2.00 0.2 0.6
assign (residue 40 and name HG1) (residue 57 and name O) 2.00 0.2 0.6
assign (residue 41 and name HN) (residue 105 and name O2A) 2.00 0.2 0.6
assign (residue 56 and name HN) (residue 40 and name OG1) 2.00 0.2 0.6
assign (residue 60 and name HN) (residue 63 and name OG1) 2.00 0.2 0.6
assign (residue 79 and name HN) (residue 105 and name O2D) 2.00 0.2 0.6
assign (residue 86 and name HN) (residue 90 and name OE2) 2.00 0.2 0.6
assign (residue 48 and name HH) (residue 105 and name O2A) 2.00 0.2 0.6
assign (residue 52 and name HD21) (residue 105 and name O2D) 2.00 0.2 0.6
assign (residue 67 and name HH) (residue 80 and name SD) 2.00 0.2 0.6
assign (residue 38 and name HH22) (residue 202 and name OH2) 2.00 0.2 0.6
!
!set message=off echo=off end
!restraints dihedral reset
!ox cytc dihedral restraints from TALOS+ without hydrogens
!as described above, restraints from chemical shifts deposited in the BMRB.
!without Hydrogens (Paramagnetic mode)
!Commented out restraints were not used in minimization
! V 3   Phi Psi
assign (resid  2 and name C ) (resid  3 and name N)
       (resid  3 and name CA) (resid  3 and name C) 1.0   -59.66    15.00  2
assign (resid  3 and name N) (resid  3 and name CA)
       (resid  3 and name C) (resid  4 and name  N) 1.0   -30.16    20.86  2
! E 4   Phi Psi
assign (resid  3 and name C ) (resid  4 and name N)
       (resid  4 and name CA) (resid  4 and name C) 1.0   -63.98    15.00  2
assign (resid  4 and name N) (resid  4 and name CA)
       (resid  4 and name C) (resid  5 and name  N) 1.0   -38.31    19.79  2
! K 5   Phi Psi
assign (resid  4 and name C ) (resid  5 and name N)
       (resid  5 and name CA) (resid  5 and name C) 1.0   -72.14    15.00  2
assign (resid  5 and name N) (resid  5 and name CA)
       (resid  5 and name C) (resid  6 and name  N) 1.0   -29.61    31.09  2
! G 6   Phi Psi
assign (resid  5 and name C ) (resid  6 and name N)
       (resid  6 and name CA) (resid  6 and name C) 1.0   -71.33    33.00  2
assign (resid  6 and name N) (resid  6 and name CA)
       (resid  6 and name C) (resid  7 and name  N) 1.0   -27.64    40.07  2
! K 7   Phi Psi
assign (resid  6 and name C ) (resid  7 and name N)
       (resid  7 and name CA) (resid  7 and name C) 1.0   -63.07    15.00  2
assign (resid  7 and name N) (resid  7 and name CA)
       (resid  7 and name C) (resid  8 and name  N) 1.0   -42.31    15.00  2
! K 8   Phi Psi
assign (resid  7 and name C ) (resid  8 and name N)
       (resid  8 and name CA) (resid  8 and name C) 1.0   -63.81    15.00  2
assign (resid  8 and name N) (resid  8 and name CA)
       (resid  8 and name C) (resid  9 and name  N) 1.0   -32.05    26.61  2
! I 9   Phi Psi
assign (resid  8 and name C ) (resid  9 and name N)
       (resid  9 and name CA) (resid  9 and name C) 1.0   -67.82    15.00  2
assign (resid  9 and name N) (resid  9 and name CA)
       (resid  9 and name C) (resid  10 and name  N) 1.0   -40.13    18.36  2
! F 10  Phi Psi
assign (resid  9 and name C ) (resid  10 and name N)
       (resid  10 and name CA) (resid  10 and name C) 1.0   -66.55    15.00  2
assign (resid  10 and name N) (resid  10 and name CA)
       (resid  10 and name C) (resid  11 and name  N) 1.0   -36.52    15.00  2
! V 11  Phi Psi
assign (resid  10 and name C ) (resid  11 and name N)
       (resid  11 and name CA) (resid  11 and name C) 1.0   -60.57    15.00  2
assign (resid  11 and name N) (resid  11 and name CA)
       (resid  11 and name C) (resid  12 and name  N) 1.0   -43.47    15.00  2
! Q 12  Phi Psi
assign (resid  11 and name C ) (resid  12 and name N)
       (resid  12 and name CA) (resid  12 and name C) 1.0   -68.48    30.82  2
assign (resid  12 and name N) (resid  12 and name CA)
       (resid  12 and name C) (resid  13 and name  N) 1.0   -36.09    16.15  2
! K 13  Phi Psi
assign (resid  12 and name C ) (resid  13 and name N)
       (resid  13 and name CA) (resid  13 and name C) 1.0   -79.94    20.31  2
assign (resid  13 and name N) (resid  13 and name CA)
       (resid  13 and name C) (resid  14 and name  N) 1.0   -33.60    48.23  2
! A 15  Phi Psi
assign (resid  14 and name C ) (resid  15 and name N)
       (resid  15 and name CA) (resid  15 and name C) 1.0   -64.08    15.00  2
assign (resid  15 and name N) (resid  15 and name CA)
       (resid  15 and name C) (resid  16 and name  N) 1.0   -42.33    15.00  2
! Q 16  Phi Psi
!assign (resid  15 and name C ) (resid  16 and name N)
!       (resid  16 and name CA) (resid  16 and name C) 1.0   -61.69    15.00  2
!assign (resid  16 and name N) (resid  16 and name CA)
!       (resid  16 and name C) (resid  17 and name  N) 1.0   -46.77    15.00  2
! c 17  Phi Psi
!assign (resid  16 and name C ) (resid  17 and name N)
!       (resid  17 and name CA) (resid  17 and name C) 1.0   -65.15    15.00  2
!assign (resid  17 and name N) (resid  17 and name CA)
!       (resid  17 and name C) (resid  18 and name  N) 1.0   -26.86    31.37  2
! H 18  Phi Psi
!assign (resid  17 and name C ) (resid  18 and name N)
!       (resid  18 and name CA) (resid  18 and name C) 1.0   -88.06    27.87  2
!assign (resid  18 and name N) (resid  18 and name CA)
!       (resid  18 and name C) (resid  19 and name  N) 1.0   -10.99    40.12  2
! V 20  Phi Psi
!assign (resid  19 and name C ) (resid  20 and name N)
!       (resid  20 and name CA) (resid  20 and name C) 1.0  -136.89    37.04  2
!assign (resid  20 and name N) (resid  20 and name CA)
!       (resid  20 and name C) (resid  21 and name  N) 1.0   153.99    22.10  2
! E 21  Phi Psi
assign (resid  20 and name C ) (resid  21 and name N)
       (resid  21 and name CA) (resid  21 and name C) 1.0   -94.13    52.42  2
assign (resid  21 and name N) (resid  21 and name CA)
       (resid  21 and name C) (resid  22 and name  N) 1.0   130.19    44.48  2
! K 22  Phi Psi
assign (resid  21 and name C ) (resid  22 and name N)
       (resid  22 and name CA) (resid  22 and name C) 1.0   -57.99    24.89  2
assign (resid  22 and name N) (resid  22 and name CA)
       (resid  22 and name C) (resid  23 and name  N) 1.0   129.24    19.90  2
! K 25  Phi Psi
assign (resid  24 and name C ) (resid  25 and name N)
       (resid  25 and name CA) (resid  25 and name C) 1.0   -94.19    57.30  2
assign (resid  25 and name N) (resid  25 and name CA)
       (resid  25 and name C) (resid  26 and name  N) 1.0   136.34    51.30  2
! H 26  Phi Psi
assign (resid  25 and name C ) (resid  26 and name N)
       (resid  26 and name CA) (resid  26 and name C) 1.0   -92.56    38.05  2
assign (resid  26 and name N) (resid  26 and name CA)
       (resid  26 and name C) (resid  27 and name  N) 1.0   134.39    35.09  2
! K 27  Phi Psi
assign (resid  26 and name C ) (resid  27 and name N)
       (resid  27 and name CA) (resid  27 and name C) 1.0  -115.41    41.79  2
assign (resid  27 and name N) (resid  27 and name CA)
       (resid  27 and name C) (resid  28 and name  N) 1.0   115.52    52.91  2
! T 28  Phi Psi
assign (resid  27 and name C ) (resid  28 and name N)
       (resid  28 and name CA) (resid  28 and name C) 1.0    50.76    15.00  2
assign (resid  28 and name N) (resid  28 and name CA)
       (resid  28 and name C) (resid  29 and name  N) 1.0    43.61    15.90  2
! N 31  Phi Psi
!assign (resid  30 and name C ) (resid  31 and name N)
!       (resid  31 and name CA) (resid  31 and name C) 1.0   -82.22    32.76  2
!assign (resid  31 and name N) (resid  31 and name CA)
!       (resid  31 and name C) (resid  32 and name  N) 1.0   -24.40    39.13  2
! H 33  Phi Psi
assign (resid  32 and name C ) (resid  33 and name N)
       (resid  33 and name CA) (resid  33 and name C) 1.0   -56.23    15.00  2
assign (resid  33 and name N) (resid  33 and name CA)
       (resid  33 and name C) (resid  34 and name  N) 1.0   130.38    15.00  2
! L 35  Phi Psi
assign (resid  34 and name C ) (resid  35 and name N)
       (resid  35 and name CA) (resid  35 and name C) 1.0   -83.83    48.83  2
assign (resid  35 and name N) (resid  35 and name CA)
       (resid  35 and name C) (resid  36 and name  N) 1.0   -29.86    27.04  2
! R 38  Phi Psi
assign (resid  37 and name C ) (resid  38 and name N)
       (resid  38 and name CA) (resid  38 and name C) 1.0  -113.54    37.88  2
assign (resid  38 and name N) (resid  38 and name CA)
       (resid  38 and name C) (resid  39 and name  N) 1.0   139.09    19.26  2
! G 41  Phi Psi
assign (resid  40 and name C ) (resid  41 and name N)
       (resid  41 and name CA) (resid  41 and name C) 1.0    64.77    19.60  2
assign (resid  41 and name N) (resid  41 and name CA)
       (resid  41 and name C) (resid  42 and name  N) 1.0    29.52    20.24  2
! Q 42  Phi Psi
assign (resid  41 and name C ) (resid  42 and name N)
       (resid  42 and name CA) (resid  42 and name C) 1.0  -107.38    34.28  2
assign (resid  42 and name N) (resid  42 and name CA)
       (resid  42 and name C) (resid  43 and name  N) 1.0    12.60    31.42  2
! F 46  Phi Psi
assign (resid  45 and name C ) (resid  46 and name N)
       (resid  46 and name CA) (resid  46 and name C) 1.0  -113.49    42.48  2
assign (resid  46 and name N) (resid  46 and name CA)
       (resid  46 and name C) (resid  47 and name  N) 1.0   121.91    32.99  2
! T 47  Phi Psi
assign (resid  46 and name C ) (resid  47 and name N)
       (resid  47 and name CA) (resid  47 and name C) 1.0  -108.44    36.97  2
assign (resid  47 and name N) (resid  47 and name CA)
       (resid  47 and name C) (resid  48 and name  N) 1.0   118.83    38.02  2
! Y 48  Phi Psi
assign (resid  47 and name C ) (resid  48 and name N)
       (resid  48 and name CA) (resid  48 and name C) 1.0  -110.98    53.74  2
assign (resid  48 and name N) (resid  48 and name CA)
       (resid  48 and name C) (resid  49 and name  N) 1.0   149.50    43.39  2
! T 49  Phi Psi
assign (resid  48 and name C ) (resid  49 and name N)
       (resid  49 and name CA) (resid  49 and name C) 1.0   -82.63    15.00  2
assign (resid  49 and name N) (resid  49 and name CA)
       (resid  49 and name C) (resid  50 and name  N) 1.0   166.92    15.40  2
! D 50  Phi Psi
assign (resid  49 and name C ) (resid  50 and name N)
       (resid  50 and name CA) (resid  50 and name C) 1.0   -59.94    15.00  2
assign (resid  50 and name N) (resid  50 and name CA)
       (resid  50 and name C) (resid  51 and name  N) 1.0   -38.26    15.00  2
! A 51  Phi Psi
assign (resid  50 and name C ) (resid  51 and name N)
       (resid  51 and name CA) (resid  51 and name C) 1.0   -62.13    15.00  2
assign (resid  51 and name N) (resid  51 and name CA)
       (resid  51 and name C) (resid  52 and name  N) 1.0   -41.10    15.00  2
! N 52  Phi Psi
assign (resid  51 and name C ) (resid  52 and name N)
       (resid  52 and name CA) (resid  52 and name C) 1.0   -65.86    15.00  2
assign (resid  52 and name N) (resid  52 and name CA)
       (resid  52 and name C) (resid  53 and name  N) 1.0   -34.39    23.69  2
! K 53  Phi Psi
!assign (resid  52 and name C ) (resid  53 and name N)
!       (resid  53 and name CA) (resid  53 and name C) 1.0   -68.41    22.37  2
!assign (resid  53 and name N) (resid  53 and name CA)
!       (resid  53 and name C) (resid  54 and name  N) 1.0   -30.01    22.48  2
! N 54  Phi Psi
assign (resid  53 and name C ) (resid  54 and name N)
       (resid  54 and name CA) (resid  54 and name C) 1.0   -90.47    24.93  2
assign (resid  54 and name N) (resid  54 and name CA)
       (resid  54 and name C) (resid  55 and name  N) 1.0    -0.32    17.68  2
! K 55  Phi Psi
assign (resid  54 and name C ) (resid  55 and name N)
       (resid  55 and name CA) (resid  55 and name C) 1.0    56.27    15.00  2
assign (resid  55 and name N) (resid  55 and name CA)
       (resid  55 and name C) (resid  56 and name  N) 1.0    38.98    25.09  2
! I 57  Phi Psi
assign (resid  56 and name C ) (resid  57 and name N)
       (resid  57 and name CA) (resid  57 and name C) 1.0  -135.85    31.39  2
assign (resid  57 and name N) (resid  57 and name CA)
       (resid  57 and name C) (resid  58 and name  N) 1.0   164.25    16.78  2
! T 58  Phi Psi
assign (resid  57 and name C ) (resid  58 and name N)
       (resid  58 and name CA) (resid  58 and name C) 1.0  -105.65    23.12  2
assign (resid  58 and name N) (resid  58 and name CA)
       (resid  58 and name C) (resid  59 and name  N) 1.0   125.69    15.00  2
! W 59  Phi Psi
assign (resid  58 and name C ) (resid  59 and name N)
       (resid  59 and name CA) (resid  59 and name C) 1.0  -104.10    41.22  2
assign (resid  59 and name N) (resid  59 and name CA)
       (resid  59 and name C) (resid  60 and name  N) 1.0   136.04    29.29  2
! K 60  Phi Psi
assign (resid  59 and name C ) (resid  60 and name N)
       (resid  60 and name CA) (resid  60 and name C) 1.0  -116.01    57.69  2
assign (resid  60 and name N) (resid  60 and name CA)
       (resid  60 and name C) (resid  61 and name  N) 1.0   140.14    59.08  2
! E 61  Phi Psi
assign (resid  60 and name C ) (resid  61 and name N)
       (resid  61 and name CA) (resid  61 and name C) 1.0   -59.88    16.47  2
assign (resid  61 and name N) (resid  61 and name CA)
       (resid  61 and name C) (resid  62 and name  N) 1.0   -42.69    15.00  2
! E 62  Phi Psi
!assign (resid  61 and name C ) (resid  62 and name N)
!       (resid  62 and name CA) (resid  62 and name C) 1.0   -65.18    15.00  2
assign (resid  62 and name N) (resid  62 and name CA)
       (resid  62 and name C) (resid  63 and name  N) 1.0   -37.47    20.90  2
! T 63  Phi Psi
assign (resid  62 and name C ) (resid  63 and name N)
       (resid  63 and name CA) (resid  63 and name C) 1.0   -73.66    28.14  2
assign (resid  63 and name N) (resid  63 and name CA)
       (resid  63 and name C) (resid  64 and name  N) 1.0   -24.10    35.07  2
! L 64  Phi Psi
assign (resid  63 and name C ) (resid  64 and name N)
       (resid  64 and name CA) (resid  64 and name C) 1.0   -68.51    15.00  2
assign (resid  64 and name N) (resid  64 and name CA)
       (resid  64 and name C) (resid  65 and name  N) 1.0   -36.50    17.69  2
! M 65  Phi Psi
assign (resid  64 and name C ) (resid  65 and name N)
       (resid  65 and name CA) (resid  65 and name C) 1.0   -68.03    18.49  2
assign (resid  65 and name N) (resid  65 and name CA)
       (resid  65 and name C) (resid  66 and name  N) 1.0   -35.70    20.67  2
! E 66  Phi Psi
assign (resid  65 and name C ) (resid  66 and name N)
       (resid  66 and name CA) (resid  66 and name C) 1.0   -69.38    18.36  2
assign (resid  66 and name N) (resid  66 and name CA)
       (resid  66 and name C) (resid  67 and name  N) 1.0   -28.17    25.60  2
! Y 67  Phi Psi
assign (resid  66 and name C ) (resid  67 and name N)
       (resid  67 and name CA) (resid  67 and name C) 1.0   -62.02    15.00  2
assign (resid  67 and name N) (resid  67 and name CA)
       (resid  67 and name C) (resid  68 and name  N) 1.0   -35.12    19.42  2
! L 68  Phi Psi
assign (resid  67 and name C ) (resid  68 and name N)
       (resid  68 and name CA) (resid  68 and name C) 1.0   -77.12    30.99  2
assign (resid  68 and name N) (resid  68 and name CA)
       (resid  68 and name C) (resid  69 and name  N) 1.0    -8.84    31.02  2
! P 71  Phi Psi
assign (resid  70 and name C ) (resid  71 and name N)
       (resid  71 and name CA) (resid  71 and name C) 1.0   -55.42    15.00  2
assign (resid  71 and name N) (resid  71 and name CA)
       (resid  71 and name C) (resid  72 and name  N) 1.0   -32.49    23.77  2
! K 72  Phi Psi
assign (resid  71 and name C ) (resid  72 and name N)
       (resid  72 and name CA) (resid  72 and name C) 1.0   -67.00    18.12  2
assign (resid  72 and name N) (resid  72 and name CA)
       (resid  72 and name C) (resid  73 and name  N) 1.0   -25.46    22.13  2
! K 73  Phi Psi
assign (resid  72 and name C ) (resid  73 and name N)
       (resid  73 and name CA) (resid  73 and name C) 1.0   -67.75    20.42  2
assign (resid  73 and name N) (resid  73 and name CA)
       (resid  73 and name C) (resid  74 and name  N) 1.0   -32.80    30.32  2
! Y 74  Phi Psi
assign (resid  73 and name C ) (resid  74 and name N)
       (resid  74 and name CA) (resid  74 and name C) 1.0   -82.30    32.48  2
assign (resid  74 and name N) (resid  74 and name CA)
       (resid  74 and name C) (resid  75 and name  N) 1.0   -40.83    15.91  2
! I 75  Phi Psi
assign (resid  74 and name C ) (resid  75 and name N)
       (resid  75 and name CA) (resid  75 and name C) 1.0  -123.01    56.15  2
assign (resid  75 and name N) (resid  75 and name CA)
       (resid  75 and name C) (resid  76 and name  N) 1.0   128.16    66.28  2
! P 76  Phi Psi
assign (resid  75 and name C ) (resid  76 and name N)
       (resid  76 and name CA) (resid  76 and name C) 1.0   -58.48    19.18  2
assign (resid  76 and name N) (resid  76 and name CA)
       (resid  76 and name C) (resid  77 and name  N) 1.0   141.80    17.49  2
! G 77  Phi Psi
assign (resid  76 and name C ) (resid  77 and name N)
       (resid  77 and name CA) (resid  77 and name C) 1.0    91.33    26.19  2
assign (resid  77 and name N) (resid  77 and name CA)
       (resid  77 and name C) (resid  78 and name  N) 1.0   -12.86    21.39  2
! T 78  Phi Psi
assign (resid  77 and name C ) (resid  78 and name N)
       (resid  78 and name CA) (resid  78 and name C) 1.0   -93.39    37.87  2
assign (resid  78 and name N) (resid  78 and name CA)
       (resid  78 and name C) (resid  79 and name  N) 1.0   150.00    37.28  2
! K 79  Phi Psi
assign (resid  78 and name C ) (resid  79 and name N)
       (resid  79 and name CA) (resid  79 and name C) 1.0  -101.07    50.04  2
assign (resid  79 and name N) (resid  79 and name CA)
       (resid  79 and name C) (resid  80 and name  N) 1.0   130.00    38.33  2
! M 80  Phi Psi
assign (resid  79 and name C ) (resid  80 and name N)
       (resid  80 and name CA) (resid  80 and name C) 1.0  -115.34    67.90  2
assign (resid  80 and name N) (resid  80 and name CA)
       (resid  80 and name C) (resid  81 and name  N) 1.0   118.12    21.98  2
! I 81  Phi Psi
assign (resid  80 and name C ) (resid  81 and name N)
       (resid  81 and name CA) (resid  81 and name C) 1.0  -103.82    69.24  2
assign (resid  81 and name N) (resid  81 and name CA)
       (resid  81 and name C) (resid  82 and name  N) 1.0   109.88    39.41  2
! A 83  Phi Psi
assign (resid  82 and name C ) (resid  83 and name N)
       (resid  83 and name CA) (resid  83 and name C) 1.0  -116.45    62.60  2
assign (resid  83 and name N) (resid  83 and name CA)
       (resid  83 and name C) (resid  84 and name  N) 1.0   138.35    28.03  2
! I 85  Phi Psi
assign (resid  84 and name C ) (resid  85 and name N)
       (resid  85 and name CA) (resid  85 and name C) 1.0  -127.09    55.91  2
assign (resid  85 and name N) (resid  85 and name CA)
       (resid  85 and name C) (resid  86 and name  N) 1.0   141.22    44.48  2
! K 87  Phi Psi
assign (resid  86 and name C ) (resid  87 and name N)
       (resid  87 and name CA) (resid  87 and name C) 1.0   -85.98    52.08  2
assign (resid  87 and name N) (resid  87 and name CA)
       (resid  87 and name C) (resid  88 and name  N) 1.0   118.98    43.49  2
! K 88  Phi Psi
assign (resid  87 and name C ) (resid  88 and name N)
       (resid  88 and name CA) (resid  88 and name C) 1.0   -55.94    15.00  2
assign (resid  88 and name N) (resid  88 and name CA)
       (resid  88 and name C) (resid  89 and name  N) 1.0   -39.58    18.30  2
! T 89  Phi Psi
assign (resid  88 and name C ) (resid  89 and name N)
       (resid  89 and name CA) (resid  89 and name C) 1.0   -64.65    15.65  2
assign (resid  89 and name N) (resid  89 and name CA)
       (resid  89 and name C) (resid  90 and name  N) 1.0   -21.87    23.26  2
! E 90  Phi Psi
assign (resid  89 and name C ) (resid  90 and name N)
       (resid  90 and name CA) (resid  90 and name C) 1.0   -63.52    19.14  2
assign (resid  90 and name N) (resid  90 and name CA)
       (resid  90 and name C) (resid  91 and name  N) 1.0   -38.67    17.81  2
! R 91  Phi Psi
assign (resid  90 and name C ) (resid  91 and name N)
       (resid  91 and name CA) (resid  91 and name C) 1.0   -59.63    17.32  2
assign (resid  91 and name N) (resid  91 and name CA)
       (resid  91 and name C) (resid  92 and name  N) 1.0   -49.40    15.00  2
! E 92  Phi Psi
assign (resid  91 and name C ) (resid  92 and name N)
       (resid  92 and name CA) (resid  92 and name C) 1.0   -67.37    15.00  2
assign (resid  92 and name N) (resid  92 and name CA)
       (resid  92 and name C) (resid  93 and name  N) 1.0   -38.01    15.00  2
! D 93  Phi Psi
assign (resid  92 and name C ) (resid  93 and name N)
       (resid  93 and name CA) (resid  93 and name C) 1.0   -64.89    15.00  2
assign (resid  93 and name N) (resid  93 and name CA)
       (resid  93 and name C) (resid  94 and name  N) 1.0   -40.42    15.00  2
! L 94  Phi Psi
assign (resid  93 and name C ) (resid  94 and name N)
       (resid  94 and name CA) (resid  94 and name C) 1.0   -62.91    15.00  2
assign (resid  94 and name N) (resid  94 and name CA)
       (resid  94 and name C) (resid  95 and name  N) 1.0   -42.83    15.00  2
! I 95  Phi Psi
assign (resid  94 and name C ) (resid  95 and name N)
       (resid  95 and name CA) (resid  95 and name C) 1.0   -61.86    15.00  2
assign (resid  95 and name N) (resid  95 and name CA)
       (resid  95 and name C) (resid  96 and name  N) 1.0   -42.31    15.00  2
! A 96  Phi Psi
assign (resid  95 and name C ) (resid  96 and name N)
       (resid  96 and name CA) (resid  96 and name C) 1.0   -64.77    15.00  2
assign (resid  96 and name N) (resid  96 and name CA)
       (resid  96 and name C) (resid  97 and name  N) 1.0   -40.47    15.00  2
! Y 97  Phi Psi
assign (resid  96 and name C ) (resid  97 and name N)
       (resid  97 and name CA) (resid  97 and name C) 1.0   -63.49    15.00  2
assign (resid  97 and name N) (resid  97 and name CA)
       (resid  97 and name C) (resid  98 and name  N) 1.0   -36.44    33.45  2
! L 98  Phi Psi
assign (resid  97 and name C ) (resid  98 and name N)
       (resid  98 and name CA) (resid  98 and name C) 1.0   -67.62    21.93  2
assign (resid  98 and name N) (resid  98 and name CA)
       (resid  98 and name C) (resid  99 and name  N) 1.0   -30.72    45.39  2
! K 99  Phi Psi
assign (resid  98 and name C ) (resid  99 and name N)
       (resid  99 and name CA) (resid  99 and name C) 1.0   -65.25    15.00  2
assign (resid  99 and name N) (resid  99 and name CA)
       (resid  99 and name C) (resid  100 and name  N) 1.0   -30.03    25.66  2
! K 100 Phi Psi
assign (resid  99 and name C ) (resid  100 and name N)
       (resid  100 and name CA) (resid  100 and name C) 1.0   -70.34    18.53  2
assign (resid  100 and name N) (resid  100 and name CA)
       (resid  100 and name C) (resid  101 and name  N) 1.0   -16.13    51.40  2
! A 101 Phi Psi
assign (resid  100 and name C ) (resid  101 and name N)
       (resid  101 and name CA) (resid  101 and name C) 1.0   -67.02    18.78  2
assign (resid  101 and name N) (resid  101 and name CA)
       (resid  101 and name C) (resid  102 and name  N) 1.0   -28.68    21.36  2
! T 102 Phi Psi
assign (resid  101 and name C ) (resid  102 and name N)
       (resid  102 and name CA) (resid  102 and name C) 1.0  -111.20    31.90  2
assign (resid  102 and name N) (resid  102 and name CA)
       (resid  102 and name C) (resid  103 and name  N) 1.0     4.71    27.89  2
! N 103 Phi Psi
!assign (resid  102 and name C ) (resid  103 and name N)
!       (resid  103 and name CA) (resid  103 and name C) 1.0  -122.74    56.98  2
!assign (resid  103 and name N) (resid  103 and name CA)
!       (resid  103 and name C) (resid  104 and name  N) 1.0   132.01    25.43  2
!backbone PCS values, from RM ox minus RM red values
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   2 and name H  )  -0.112 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   3 and name H  )  -0.066 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   4 and name H  )  -0.085 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   5 and name H  )  -0.08  .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   6 and name H  )  -0.206 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   7 and name H  )  -0.078 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   8 and name H  )  -0.076 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   9 and name H  )  -0.245 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  10 and name H  )  -0.290 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  11 and name H  )  0.067  .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  12 and name H  )  -.162 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  13 and name H  )  -0.527 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  15 and name H  )  0.692 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  16 and name H  )  1.07  .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  19 and name H  )  2.816 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  20 and name H  )  1.119 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  22 and name H  )  0.339 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  24 and name H  )  0.346 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  25 and name H  )  0.527 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  27 and name H  )  0.420 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  29 and name H  )  -.484 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  31 and name H  )  0.937 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  33 and name H  )  .738 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  34 and name H  )  0.171 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  35 and name H  )  0.007 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  36 and name H  )  -.018 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  37 and name H  )  -.190 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  38 and name H  )  -.177 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  39 and name H  )  -0.043 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  40 and name H  )  0.175 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  41 and name H  )  0.577 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  42 and name H  )  -.827 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  43 and name H  )  -.560 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  46 and name H  )  -.316 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  48 and name H  )  -.507 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  49 and name H  )  -.652 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  50 and name H  )  0.042 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  51 and name H  )  0.240 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  52 and name H  )  0.136 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  53 and name H  )  0.568 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  54 and name H  )  -0.54 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  55 and name H  )  -0.464 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  56 and name H  )  0.715 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  57 and name H  )  0.180 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  58 and name H  )  -0.117 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  59 and name H  )  -0.259 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  60 and name H  )  -0.204 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  61 and name H  )  -0.205 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  62 and name H  )  -0.120 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  63 and name H  )  -0.177 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  64 and name H  )  -0.370 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  65 and name H  )  -0.318 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  66 and name H  )  -0.097 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  67 and name H  )  -0.157 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  68 and name H  )  -0.228 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  69 and name H  )  -0.089 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  70 and name H  )  0.457 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  72 and name H  )  1.702 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  73 and name H  )  0.815 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  74 and name H  )  0.809 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  75 and name H  )  1.136 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  77 and name H  )  0.643 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  78 and name H  )  0.891 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  79 and name H  )  0.299 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  81 and name H  )  0.600 .10
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  82 and name H  )  2.416 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  85 and name H  )  -0.476 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  87 and name H  )  -0.239 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  89 and name H  )  -0.186 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  90 and name H  )  -0.274 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  91 and name H  )  -0.377 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  92 and name H  )  -0.341 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  93 and name H  )  -0.276 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name H  )  -0.579 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  96 and name H  )  -0.333 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  97 and name H  )  -0.281 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  98 and name H  )  -0.353 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  99 and name H  )  -0.161 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name H  )  -0.102 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 101 and name H  )  -0.002 .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 102 and name H  )  0.097  .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 103 and name H  )  0.055  .10
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 104 and name H  )  0.068  .10
!SC PCS values, from RM ox minus aq red values
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   1 and name HA1 ) -0.152  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   1 and name HA2 ) -0.157  .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid   2 and name HA )  0.469  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   2 and name HB2 ) -0.103  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   2 and name HB1 ) -0.092  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   3 and name HA ) -0.094  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   3 and name HB ) -0.021  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   3 and name HG11 ) -0.040  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   3 and name HG12 ) -0.040  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   3 and name HG13 ) -0.040  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   3 and name HG21 ) -0.020  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid   3 and name HG22 ) -0.020  .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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!       ( resid  13 and name HE1 ) -0.443  .20
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!       ( resid 500 and name Y  )
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!       ( resid 500 and name Y  )
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!       ( resid  13 and name HG1 ) -0.976  .20
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!       ( resid 500 and name Y  )
!       ( resid  13 and name HG2 ) -0.976  .20
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!       ( resid  15 and name HA ) 2.065  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  15 and name HB1 ) 0.837  .20
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!       ( resid 500 and name Y  )
!       ( resid  15 and name HB2 ) 0.837  .20
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assign ( resid 500 and name OO )
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       ( resid  16 and name HA ) 0.775  .20
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       ( resid  16 and name HG2 ) 0.262  .20
assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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       ( resid  16 and name HB2 ) 0.48  .20
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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       ( resid  20 and name HB ) 0.727  .20
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!       ( resid  20 and name HG21 ) 0.670  .20
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!       ( resid  20 and name HG22 ) 0.670  .20
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!       ( resid 500 and name Y  )
!       ( resid  20 and name HG23 ) 0.670  .20
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!       ( resid 500 and name Y  )
!       ( resid  20 and name HG11 ) 1.100  .20
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!       ( resid  20 and name HG12 ) 1.100  .20
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assign ( resid 500 and name OO )
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       ( resid  21 and name HA ) 0.434  .20
assign ( resid 500 and name OO )
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       ( resid  21 and name HG1 ) 0.703  .20
assign ( resid 500 and name OO )
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       ( resid  21 and name HG2 ) 0.703  .20
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!       ( resid 500 and name Y  )
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!       ( resid 500 and name Y  )
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!       ( resid 500 and name Y  )
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assign ( resid 500 and name OO )
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       ( resid  22 and name HE1 ) 0.042  .20
assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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       ( resid  22 and name HB1 ) -0.129  .20
assign ( resid 500 and name OO )
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       ( resid  22 and name HB2 ) -0.129  .20
!assign ( resid 500 and name OO )
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!       ( resid  22 and name HD1 ) -0.617  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  22 and name HD2 ) -0.617  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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       ( resid  28 and name HA ) -1.008  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  28 and name HG21 ) -2.056  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  28 and name HG22 ) -2.056  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  28 and name HG23 ) -2.056  .20
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!       ( resid 500 and name Y  )
!       ( resid  30 and name HA ) 0.450  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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       ( resid  31 and name HB1 ) 0.663  .20
assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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       ( resid  35 and name HB2 ) 0.009  .20
!assign ( resid 500 and name OO )
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!       ( resid  35 and name HG ) 0.196  .20
assign ( resid 500 and name OO )
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       ( resid  35 and name HD11 ) -0.255  .20
assign ( resid 500 and name OO )
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       ( resid  35 and name HD12 ) -0.255  .20
assign ( resid 500 and name OO )
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       ( resid  35 and name HD13 ) -0.255  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  35 and name HD21 ) -0.639  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  35 and name HD22 ) -0.639  .20
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       ( resid  67 and name HA )  0.355  .20
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       ( resid  67 and name HB2 )  -0.145  .20
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       ( resid  69 and name HA )  -0.102  .20
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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       ( resid  71 and name HA )   1.600   .20
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!       ( resid  71 and name HB1 )   4.061  .20
assign ( resid 500 and name OO )
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       ( resid  71 and name HB2 )   4.061  .20
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!       ( resid  71 and name HG1 )   1.422   .20
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!       ( resid 500 and name Y  )
!       ( resid  71 and name HG2 )   1.422   .20
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!       ( resid 500 and name Y  )
!       ( resid  72 and name HA )   1.454   .20
assign ( resid 500 and name OO )
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       ( resid  72 and name HE1 )   0.777   .20
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!       ( resid 500 and name Y  )
!       ( resid  72 and name HE2 )   0.777   .20
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!       ( resid 500 and name Y  )
!       ( resid  72 and name HB1 )   1.114   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  72 and name HB2 )   1.114   .20
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!       ( resid 500 and name Y  )
!       ( resid  72 and name HD1 )   1.176   .20
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!       ( resid 500 and name Y  )
!       ( resid  72 and name HD2 )   1.176   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  72 and name HG1 )   1.209   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  72 and name HG2 )   1.209   .20
assign ( resid 500 and name OO )
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       ( resid  73 and name HA )    0.540   .20
assign ( resid 500 and name OO )
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       ( resid  73 and name HE1 )    0.262   .20
assign ( resid 500 and name OO )
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       ( resid  73 and name HE2 )    0.262   .20
assign ( resid 500 and name OO )
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       ( resid  73 and name HB1 )    0.447   .20
assign ( resid 500 and name OO )
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       ( resid  73 and name HB2 )    0.447   .20
assign ( resid 500 and name OO )
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       ( resid  73 and name HG1 )    0.358   .20
assign ( resid 500 and name OO )
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       ( resid  73 and name HG2 )    0.358   .20
assign ( resid 500 and name OO )
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       ( resid  74 and name HA )    0.389   .20
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!       ( resid 500 and name Y  )
!       ( resid  74 and name HB2 )    0.892   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  74 and name HB1 )    0.760   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  75 and name HD11 )    1.058   .20
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!       ( resid 500 and name Y  )
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!       ( resid 500 and name Y  )
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assign ( resid 500 and name OO )
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       ( resid  75 and name HG21 )    0.685   .20
assign ( resid 500 and name OO )
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       ( resid  75 and name HG22 )    0.685   .20
assign ( resid 500 and name OO )
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       ( resid  75 and name HG23 )    0.685   .20
assign ( resid 500 and name OO )
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       ( resid  76 and name HA )     0.739   .20
assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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assign ( resid 500 and name OO )
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       ( resid  76 and name HB1 )     0.114   .20
assign ( resid 500 and name OO )
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       ( resid  76 and name HB2 )     0.114   .20
assign ( resid 500 and name OO )
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       ( resid  76 and name HG1 )     0.188   .20
assign ( resid 500 and name OO )
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       ( resid  76 and name HG2 )     0.188   .20
assign ( resid 500 and name OO )
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       ( resid  77 and name HA1 )     0.397   .20
assign ( resid 500 and name OO )
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!       ( resid  78 and name HB )     1.654   .20
assign ( resid 500 and name OO )
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       ( resid  78 and name HA )     0.683   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  78 and name HG21 )     2.705   .20
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!       ( resid 500 and name Y  )
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!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  78 and name HG23 )     2.705   .20
assign ( resid 500 and name OO )
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       ( resid  79 and name HA )     0.345   .20
assign ( resid 500 and name OO )
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       ( resid  79 and name HD1 )     -0.437   .20
assign ( resid 500 and name OO )
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       ( resid  79 and name HD2 )     -0.437   .20
assign ( resid 500 and name OO )
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       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  79 and name HA )     0.345   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  81 and name HA )     1.542   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  81 and name HB )     0.043   .20
assign ( resid 500 and name OO )
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       ( resid  81 and name HG21 )     0.332  .20
assign ( resid 500 and name OO )
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       ( resid  81 and name HG22 )     0.332  .20
assign ( resid 500 and name OO )
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       ( resid  81 and name HG23 )     0.332  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  81 and name HD11 )     0.251   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  81 and name HD12 )     0.251   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  81 and name HD13 )     0.251   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  82 and name HA )     -0.626   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  82 and name HB2 )     0.909   .20
assign ( resid 500 and name OO )
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       ( resid  83 and name HB1 )     0.161  .20
assign ( resid 500 and name OO )
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       ( resid  83 and name HB2 )     0.161  .20
assign ( resid 500 and name OO )
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       ( resid  83 and name HB3 )     0.161  .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name Y  )
!       ( resid  84 and name HA2 )     0.193   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  84 and name HA1 )     -0.084   .20
assign ( resid 500 and name OO )
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       ( resid  85 and name HA )     -0.382   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  85 and name HB )     -0.837   .20
assign ( resid 500 and name OO )
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       ( resid  85 and name HG21 )     -0.535   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
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       ( resid  85 and name HG22 )     -0.535   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  85 and name HG23 )     -0.535   .20
!assign ( resid 500 and name OO )
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!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  85 and name HD11 )     -1.236   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  85 and name HD12 )     -1.236   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  85 and name HD13 )     -1.236   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  86 and name HA )     -0.077   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  86 and name HE1 )     0.045   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  86 and name HE2 )     0.045   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  86 and name HB1 )     -0.088   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  86 and name HB2 )     -0.088   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
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       ( resid  86 and name HD1 )     0.032   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  86 and name HD2 )     0.032   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  86 and name HG1 )     -0.029   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  86 and name HG2 )     -0.029   .20
assign ( resid 500 and name OO )
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       ( resid 500 and name X  )
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       ( resid  87 and name HA )     -0.102   .20
assign ( resid 500 and name OO )
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       ( resid  87 and name HE1 )     -0.111   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
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       ( resid  87 and name HE2 )     -0.111   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  87 and name HG1 )     0.052   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  87 and name HG2 )     0.052   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
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       ( resid  88 and name HA )     -0.171   .20
assign ( resid 500 and name OO )
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       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  88 and name HE1 )     -0.104   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  88 and name HE2 )     -0.104   .20
assign ( resid 500 and name OO )
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       ( resid 500 and name X  )
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       ( resid  88 and name HB1 )     -0.108   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  88 and name HB2 )     -0.108   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  88 and name HD1 )     -0.050   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  88 and name HD2 )     -0.050   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
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       ( resid  88 and name HG1 )     -0.082   .20
assign ( resid 500 and name OO )
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       ( resid 500 and name X  )
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       ( resid  88 and name HG2 )     -0.082   .20
assign ( resid 500 and name OO )
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       ( resid  89 and name HB )     -0.151   .20
assign ( resid 500 and name OO )
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       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  89 and name HA )     -0.095   .20
assign ( resid 500 and name OO )
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       ( resid 500 and name X  )
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       ( resid  89 and name HG21 )     -0.086   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  89 and name HG22 )     -0.086   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  89 and name HG23 )     -0.086   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  90 and name HA )     -0.374   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  90 and name HG1 )     -0.296   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  90 and name HG2 )     -0.296   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  90 and name HB1 )     -0.366   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  90 and name HB2 )     -0.366   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  91 and name HA )     -0.618   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  91 and name HD1 )     -0.365   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  91 and name HD2 )     -0.365   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  91 and name HB1 )     -0.523   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  91 and name HB2 )     -0.523   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  92 and name HA )     -0.356   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  92 and name HG1 )     -0.042   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  92 and name HG2 )     -0.042   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  92 and name HB1 )     0.050   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  92 and name HB2 )     0.050   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  93 and name HB1 )     -0.302   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  93 and name HB2 )     -0.302   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  94 and name HA )     -0.475   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  94 and name HB2 )     -0.849   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  94 and name HB1 )     -0.776   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  94 and name HD11 )     -0.967   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  94 and name HD12 )     -0.967   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  94 and name HD13 )     -0.967   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  94 and name HD21 )     -1.781   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  94 and name HD22 )     -1.781   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  94 and name HD23 )     -1.781   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name HA )     -0.657   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name HB )     -0.339   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name HG21 )     -0.412   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name HG22 )     -0.412   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name HG23 )     -0.412   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  95 and name HG12 )     -0.393   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name HD11 )     -0.549   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name HD12 )     -0.549   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  95 and name HD13 )     -0.549   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  96 and name HA )     -0.175   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  96 and name HB1 )     -0.169   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  96 and name HB2 )     -0.169   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  96 and name HB3 )     -0.169   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  97 and name HA )     -0.083   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  97 and name HB2 )     -0.127   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  97 and name HB1 )     -0.305   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  98 and name HA )     -0.083   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  98 and name HB1 )     -0.518   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  98 and name HB2 )     -0.518   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  98 and name HG )     -0.344   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  98 and name HD21 )     -0.226   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  98 and name HD22 )     -0.226   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  98 and name HD23 )     -0.226   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  98 and name HD11 )     -1.215   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  98 and name HD12 )     -1.215   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  98 and name HD13 )     -1.215   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  99 and name HA )     -0.118   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  99 and name HB1 )     -0.121   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid  99 and name HB2 )     -0.121   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  99 and name HG1 )      0.346   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid  99 and name HG2 )      0.346   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HA )     -0.003   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HE1 )     0.061   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HE2 )     0.061   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HB1 )     0.036   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HB2 )     0.036   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HD1 )     0.079   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HD2 )     0.079   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HG1 )     0.016   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 100 and name HG2 )     0.016   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 101 and name HA )     0.203   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 101 and name HB1 )     0.231   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 101 and name HB2 )     0.231   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 101 and name HB3 )     0.231   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 102 and name HB )     0.006   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 102 and name HA )     0.234   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid 102 and name HG21 )     0.224   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid 102 and name HG22 )     0.224   .20
!assign ( resid 500 and name OO )
!       ( resid 500 and name Z  )
!       ( resid 500 and name X  )
!       ( resid 500 and name Y  )
!       ( resid 102 and name HG23 )     0.224   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 103 and name HA )     -0.029   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 103 and name HB2 )     -0.019   .20
assign ( resid 500 and name OO )
       ( resid 500 and name Z  )
       ( resid 500 and name X  )
       ( resid 500 and name Y  )
       ( resid 103 and name HB1 )     -0.046   .20

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H1       GLY   1  75.825  10.005  -8.062
    2    H2   GLY   1           H2       GLY   1  76.207  10.231  -6.421
    3    H3   GLY   1           H3       GLY   1  75.433  11.466  -7.294
    4    HA2  GLY   1           HA2      GLY   1  74.312   9.195  -5.955
    5    HA3  GLY   1           HA3      GLY   1  73.529  10.681  -6.491
    6    H    ASP   2           H        ASP   2  75.348   8.295  -8.390
    7    HA   ASP   2           HA       ASP   2  72.869   7.655  -9.877
    8    HB2  ASP   2           HB2      ASP   2  75.610   8.269 -10.989
    9    HB3  ASP   2           HB1      ASP   2  74.317   7.521 -11.927
   10    H    VAL   3           H        VAL   3  72.658   5.730  -8.696
   11    HA   VAL   3           HA       VAL   3  74.567   3.804  -8.181
   12    HB   VAL   3           HB       VAL   3  72.342   3.587  -7.285
   13   HG11  VAL   3          HG11      VAL   3  71.004   4.617  -8.979
   14   HG12  VAL   3          HG12      VAL   3  70.463   2.941  -8.888
   15   HG13  VAL   3          HG13      VAL   3  71.527   3.455 -10.197
   16   HG21  VAL   3          HG21      VAL   3  73.680   1.495  -7.890
   17   HG22  VAL   3          HG22      VAL   3  72.637   1.350  -9.303
   18   HG23  VAL   3          HG23      VAL   3  71.946   1.262  -7.683
   19    H    GLU   4           H        GLU   4  73.356   4.845 -11.207
   20    HA   GLU   4           HA       GLU   4  73.831   2.416 -12.666
   21    HB2  GLU   4           HB2      GLU   4  73.567   5.271 -13.638
   22    HB3  GLU   4           HB3      GLU   4  73.548   3.835 -14.663
   23    HG2  GLU   4           HG2      GLU   4  71.535   3.022 -13.606
   24    HG3  GLU   4           HG3      GLU   4  71.602   4.295 -12.388
   25    H    LYS   5           H        LYS   5  75.535   5.561 -12.657
   26    HA   LYS   5           HA       LYS   5  77.820   4.454 -14.006
   27    HB2  LYS   5           HB2      LYS   5  77.271   7.102 -12.658
   28    HB3  LYS   5           HB3      LYS   5  78.850   6.706 -13.336
   29    HG2  LYS   5           HG2      LYS   5  77.963   6.475 -15.538
   30    HG3  LYS   5           HG3      LYS   5  76.301   6.460 -14.946
   31    HD2  LYS   5           HD2      LYS   5  78.014   8.856 -14.363
   32    HD3  LYS   5           HD3      LYS   5  77.342   8.671 -15.983
   33    HE2  LYS   5           HE2      LYS   5  75.078   8.491 -15.047
   34    HE3  LYS   5           HE3      LYS   5  75.730   8.623 -13.414
   35    HZ1  LYS   5           HZ1      LYS   5  74.860  10.735 -14.375
   36    HZ2  LYS   5           HZ2      LYS   5  76.131  10.689 -15.502
   37    HZ3  LYS   5           HZ3      LYS   5  76.468  10.815 -13.842
   38    H    GLY   6           H        GLY   6  76.731   4.577 -10.779
   39    HA2  GLY   6           HA2      GLY   6  79.287   4.485  -9.475
   40    HA3  GLY   6           HA3      GLY   6  77.733   4.050  -8.759
   41    H    LYS   7           H        LYS   7  76.953   2.168 -10.714
   42    HA   LYS   7           HA       LYS   7  78.224  -0.180  -9.734
   43    HB2  LYS   7           HB2      LYS   7  75.873  -0.152 -10.476
   44    HB3  LYS   7           HB3      LYS   7  76.399   0.188 -12.124
   45    HG2  LYS   7           HG2      LYS   7  77.664  -1.936 -12.157
   46    HG3  LYS   7           HG3      LYS   7  77.123  -2.280 -10.516
   47    HD2  LYS   7           HD2      LYS   7  75.017  -2.872 -11.192
   48    HD3  LYS   7           HD3      LYS   7  74.961  -1.632 -12.444
   49    HE2  LYS   7           HE2      LYS   7  76.302  -2.970 -13.934
   50    HE3  LYS   7           HE3      LYS   7  76.640  -4.144 -12.662
   51    HZ1  LYS   7           HZ1      LYS   7  73.942  -4.054 -12.696
   52    HZ2  LYS   7           HZ2      LYS   7  74.888  -5.224 -13.487
   53    HZ3  LYS   7           HZ3      LYS   7  74.317  -3.870 -14.340
   54    H    LYS   8           H        LYS   8  78.377   1.630 -12.789
   55    HA   LYS   8           HA       LYS   8  80.016  -0.095 -14.248
   56    HB2  LYS   8           HB2      LYS   8  78.946   1.834 -15.267
   57    HB3  LYS   8           HB3      LYS   8  79.897   2.928 -14.266
   58    HG2  LYS   8           HG2      LYS   8  81.517   0.986 -15.791
   59    HG3  LYS   8           HG3      LYS   8  80.607   2.105 -16.802
   60    HD2  LYS   8           HD2      LYS   8  82.250   3.075 -14.457
   61    HD3  LYS   8           HD3      LYS   8  82.963   2.849 -16.052
   62    HE2  LYS   8           HE2      LYS   8  80.962   4.307 -16.891
   63    HE3  LYS   8           HE3      LYS   8  80.828   4.796 -15.202
   64    HZ1  LYS   8           HZ1      LYS   8  82.965   5.692 -15.216
   65    HZ2  LYS   8           HZ2      LYS   8  82.302   6.185 -16.701
   66    HZ3  LYS   8           HZ3      LYS   8  83.404   4.893 -16.647
   67    H    ILE   9           H        ILE   9  80.935   2.592 -12.105
   68    HA   ILE   9           HA       ILE   9  83.732   2.253 -12.398
   69    HB   ILE   9           HB       ILE   9  82.150   3.483 -10.129
   70   HG12  ILE   9          HG12      ILE   9  83.581   4.884 -12.396
   71   HG13  ILE   9          HG13      ILE   9  81.888   4.402 -12.522
   72   HG21  ILE   9          HG21      ILE   9  85.077   3.668 -10.900
   73   HG22  ILE   9          HG22      ILE   9  84.425   2.961  -9.421
   74   HG23  ILE   9          HG23      ILE   9  84.297   4.697  -9.701
   75   HD11  ILE   9          HD11      ILE   9  82.988   6.111 -10.275
   76   HD12  ILE   9          HD12      ILE   9  81.294   5.752 -10.604
   77   HD13  ILE   9          HD13      ILE   9  82.213   6.766 -11.716
   78    H    PHE  10           H        PHE  10  81.344   0.624 -10.470
   79    HA   PHE  10           HA       PHE  10  83.218  -0.433  -8.552
   80    HB2  PHE  10           HB2      PHE  10  81.084  -0.321  -7.653
   81    HB3  PHE  10           HB1      PHE  10  80.315  -0.838  -9.152
   82    HD1  PHE  10           HD1      PHE  10  80.282  -3.206  -9.810
   83    HD2  PHE  10           HD2      PHE  10  82.009  -1.939  -6.092
   84    HE1  PHE  10           HE1      PHE  10  80.297  -5.556  -9.022
   85    HE2  PHE  10           HE2      PHE  10  82.027  -4.290  -5.298
   86    HZ   PHE  10           HZ       PHE  10  81.172  -6.100  -6.769
   87    H    VAL  11           H        VAL  11  81.371  -1.885 -11.244
   88    HA   VAL  11           HA       VAL  11  82.359  -4.467 -11.071
   89    HB   VAL  11           HB       VAL  11  81.819  -4.667 -13.483
   90   HG11  VAL  11          HG11      VAL  11  79.739  -3.009 -12.049
   91   HG12  VAL  11          HG12      VAL  11  80.092  -4.678 -11.603
   92   HG13  VAL  11          HG13      VAL  11  79.476  -4.307 -13.212
   93   HG21  VAL  11          HG21      VAL  11  82.630  -2.376 -14.098
   94   HG22  VAL  11          HG22      VAL  11  81.229  -1.706 -13.267
   95   HG23  VAL  11          HG23      VAL  11  81.006  -2.714 -14.693
   96    H    GLN  12           H        GLN  12  83.854  -1.600 -12.396
   97    HA   GLN  12           HA       GLN  12  86.059  -3.219 -13.471
   98    HB2  GLN  12           HB2      GLN  12  86.830  -1.149 -14.521
   99    HB3  GLN  12           HB1      GLN  12  85.154  -1.502 -14.932
  100    HG2  GLN  12           HG2      GLN  12  84.701   0.019 -12.768
  101    HG3  GLN  12           HG1      GLN  12  86.271   0.675 -13.225
  102   HE21  GLN  12          HE21      GLN  12  83.568  -0.504 -15.286
  103   HE22  GLN  12          HE22      GLN  12  83.412   0.947 -16.145
  104    H    LYS  13           H        LYS  13  85.364  -1.166 -10.740
  105    HA   LYS  13           HA       LYS  13  88.240  -0.927 -10.149
  106    HB2  LYS  13           HB2      LYS  13  85.861   0.408  -8.858
  107    HB3  LYS  13           HB3      LYS  13  87.531   0.636  -8.358
  108    HG2  LYS  13           HG2      LYS  13  86.512   1.192 -11.154
  109    HG3  LYS  13           HG3      LYS  13  86.713   2.420  -9.910
  110    HD2  LYS  13           HD2      LYS  13  89.160   1.481  -9.754
  111    HD3  LYS  13           HD3      LYS  13  88.818   0.837 -11.361
  112    HE2  LYS  13           HE2      LYS  13  89.738   2.951 -11.814
  113    HE3  LYS  13           HE3      LYS  13  88.002   3.233 -11.917
  114    HZ1  LYS  13           HZ1      LYS  13  88.467   3.626  -9.309
  115    HZ2  LYS  13           HZ2      LYS  13  88.436   4.866 -10.470
  116    HZ3  LYS  13           HZ3      LYS  13  89.918   4.196  -9.978
  117    H    CYS  14           H        CYS  14  85.375  -1.485  -8.075
  118    HA   CYS  14           HA       CYS  14  87.045  -2.862  -6.169
  119    HB2  CYS  14           HB2      CYS  14  84.089  -2.798  -5.885
  120    HB3  CYS  14           HB1      CYS  14  85.340  -2.574  -4.666
  121    H    ALA  15           H        ALA  15  84.543  -3.928  -8.453
  122    HA   ALA  15           HA       ALA  15  83.991  -6.429  -7.455
  123    HB1  ALA  15           HB1      ALA  15  83.990  -7.123  -9.982
  124    HB2  ALA  15           HB2      ALA  15  84.282  -5.405 -10.255
  125    HB3  ALA  15           HB3      ALA  15  82.829  -5.928  -9.404
  126    H    GLN  16           H        GLN  16  86.965  -5.277  -8.832
  127    HA   GLN  16           HA       GLN  16  88.271  -7.571  -9.608
  128    HB2  GLN  16           HB2      GLN  16  89.382  -5.209  -8.089
  129    HB3  GLN  16           HB1      GLN  16  90.366  -6.433  -8.886
  130    HG2  GLN  16           HG2      GLN  16  89.106  -5.897 -11.023
  131    HG3  GLN  16           HG1      GLN  16  88.413  -4.515 -10.175
  132   HE21  GLN  16          HE21      GLN  16  91.243  -5.682 -11.825
  133   HE22  GLN  16          HE22      GLN  16  92.205  -4.306 -11.571
  134    H    CYS  17           H        CYS  17  88.586  -6.165  -6.320
  135    HA   CYS  17           HA       CYS  17  88.980  -8.924  -5.309
  136    HB2  CYS  17           HB2      CYS  17  90.142  -6.698  -3.744
  137    HB3  CYS  17           HB1      CYS  17  90.804  -8.286  -4.104
  138    H    HIS  18           H        HSD  18  86.391  -8.000  -5.395
  139    HA   HIS  18           HA       HSD  18  85.753  -7.938  -2.556
  140    HB2  HIS  18           HB2      HSD  18  85.180  -5.613  -4.373
  141    HB3  HIS  18           HB1      HSD  18  84.102  -5.978  -3.031
  142    HD1  HIS  18           HD1      HSD  18  85.067  -5.738  -0.612
  143    HD2  HIS  18           HD2      HSD  18  87.709  -4.592  -3.620
  144    HE1  HIS  18           HE1      HSD  18  86.932  -4.455   0.525
  145    H    THR  19           H        THR  19  83.160  -7.591  -2.470
  146    HA   THR  19           HA       THR  19  81.904  -9.174  -4.613
  147    HB   THR  19           HB       THR  19  80.762 -10.105  -2.217
  148    HG1  THR  19           HG1      THR  19  83.098 -10.973  -1.603
  149   HG21  THR  19          HG21      THR  19  81.081 -11.428  -4.245
  150   HG22  THR  19          HG22      THR  19  81.853 -12.239  -2.883
  151   HG23  THR  19          HG23      THR  19  82.832 -11.348  -4.048
  152    H    VAL  20           H        VAL  20  81.519  -7.206  -1.709
  153    HA   VAL  20           HA       VAL  20  79.771  -5.926  -0.939
  154    HB   VAL  20           HB       VAL  20  79.158  -4.168  -2.453
  155   HG11  VAL  20          HG11      VAL  20  81.956  -5.121  -3.121
  156   HG12  VAL  20          HG12      VAL  20  81.517  -4.287  -1.633
  157   HG13  VAL  20          HG13      VAL  20  81.369  -3.460  -3.183
  158   HG21  VAL  20          HG21      VAL  20  78.643  -5.787  -4.369
  159   HG22  VAL  20          HG22      VAL  20  80.372  -5.783  -4.698
  160   HG23  VAL  20          HG23      VAL  20  79.452  -4.289  -4.819
  161    H    GLU  21           H        GLU  21  78.968  -8.646  -1.883
  162    HA   GLU  21           HA       GLU  21  76.119  -8.012  -2.387
  163    HB2  GLU  21           HB2      GLU  21  75.888  -9.910  -3.799
  164    HB3  GLU  21           HB3      GLU  21  77.338  -9.074  -4.352
  165    HG2  GLU  21           HG2      GLU  21  78.576 -10.667  -2.681
  166    HG3  GLU  21           HG3      GLU  21  77.109 -11.638  -2.800
  167    H    LYS  22           H        LYS  22  75.006  -8.420  -0.619
  168    HA   LYS  22           HA       LYS  22  75.725  -9.638   1.682
  169    HB2  LYS  22           HB2      LYS  22  73.557  -8.479   1.290
  170    HB3  LYS  22           HB3      LYS  22  72.980  -9.906   0.434
  171    HG2  LYS  22           HG2      LYS  22  72.195  -9.977   2.744
  172    HG3  LYS  22           HG3      LYS  22  73.372 -11.263   2.489
  173    HD2  LYS  22           HD2      LYS  22  74.998 -10.226   3.781
  174    HD3  LYS  22           HD3      LYS  22  74.370  -8.609   3.463
  175    HE2  LYS  22           HE2      LYS  22  72.456  -9.028   4.926
  176    HE3  LYS  22           HE3      LYS  22  72.993 -10.687   5.189
  177    HZ1  LYS  22           HZ1      LYS  22  74.801 -10.000   6.424
  178    HZ2  LYS  22           HZ2      LYS  22  73.602  -8.898   6.909
  179    HZ3  LYS  22           HZ3      LYS  22  74.788  -8.428   5.786
  180    H    GLY  23           H        GLY  23  75.614 -11.689   2.607
  181    HA2  GLY  23           HA2      GLY  23  76.039 -13.954   2.622
  182    HA3  GLY  23           HA3      GLY  23  74.621 -14.036   1.582
  183    H    GLY  24           H        GLY  24  77.496 -12.313   0.595
  184    HA2  GLY  24           HA2      GLY  24  77.765 -14.045  -1.720
  185    HA3  GLY  24           HA3      GLY  24  78.669 -12.568  -1.402
  186    H    LYS  25           H        LYS  25  80.717 -13.281  -1.692
  187    HA   LYS  25           HA       LYS  25  81.814 -15.020   0.373
  188    HB2  LYS  25           HB2      LYS  25  83.069 -16.326  -1.447
  189    HB3  LYS  25           HB3      LYS  25  81.372 -16.730  -1.197
  190    HG2  LYS  25           HG2      LYS  25  81.853 -14.556  -3.156
  191    HG3  LYS  25           HG3      LYS  25  82.459 -16.137  -3.642
  192    HD2  LYS  25           HD2      LYS  25  80.230 -17.121  -3.199
  193    HD3  LYS  25           HD3      LYS  25  79.626 -15.528  -2.749
  194    HE2  LYS  25           HE2      LYS  25  80.124 -14.675  -4.994
  195    HE3  LYS  25           HE3      LYS  25  80.790 -16.243  -5.455
  196    HZ1  LYS  25           HZ1      LYS  25  78.681 -17.256  -5.222
  197    HZ2  LYS  25           HZ2      LYS  25  78.438 -15.846  -6.139
  198    HZ3  LYS  25           HZ3      LYS  25  78.009 -15.877  -4.496
  199    H    HIS  26           H        HIS  26  83.215 -13.554   1.160
  200    HA   HIS  26           HA       HIS  26  84.519 -11.529  -0.238
  201    HB2  HIS  26           HB2      HIS  26  86.305 -12.015   1.740
  202    HB3  HIS  26           HB1      HIS  26  84.785 -11.161   1.999
  203    HD1  HIS  26           HD1      HIS  26  82.853 -12.467   3.154
  204    HD2  HIS  26           HD2      HIS  26  86.385 -14.652   2.799
  205    HE1  HIS  26           HE1      HIS  26  82.587 -14.504   4.638
  206    HE2  HIS  26           HE2      HIS  26  84.733 -15.846   4.432
  207    H    LYS  27           H        LYS  27  85.885 -11.669  -1.876
  208    HA   LYS  27           HA       LYS  27  87.787 -13.944  -1.968
  209    HB2  LYS  27           HB2      LYS  27  86.499 -12.414  -4.245
  210    HB3  LYS  27           HB3      LYS  27  87.783 -13.606  -4.443
  211    HG2  LYS  27           HG2      LYS  27  86.045 -15.060  -2.947
  212    HG3  LYS  27           HG3      LYS  27  84.907 -14.008  -3.786
  213    HD2  LYS  27           HD2      LYS  27  87.047 -15.660  -5.162
  214    HD3  LYS  27           HD3      LYS  27  85.355 -16.133  -5.021
  215    HE2  LYS  27           HE2      LYS  27  84.641 -14.209  -6.303
  216    HE3  LYS  27           HE3      LYS  27  86.276 -13.547  -6.306
  217    HZ1  LYS  27           HZ1      LYS  27  86.128 -16.239  -7.298
  218    HZ2  LYS  27           HZ2      LYS  27  86.886 -14.873  -7.969
  219    HZ3  LYS  27           HZ3      LYS  27  85.228 -15.140  -8.225
  220    H    THR  28           H        THR  28  89.914 -13.493  -2.176
  221    HA   THR  28           HA       THR  28  91.808 -12.192  -1.882
  222    HB   THR  28           HB       THR  28  90.675 -10.591  -4.172
  223    HG1  THR  28           HG1      THR  28  91.263 -12.263  -5.507
  224   HG21  THR  28          HG21      THR  28  93.428 -11.435  -3.259
  225   HG22  THR  28          HG22      THR  28  92.820  -9.803  -3.526
  226   HG23  THR  28          HG23      THR  28  93.126 -10.864  -4.898
  227    H    GLY  29           H        GLY  29  89.389 -11.313  -0.414
  228    HA2  GLY  29           HA2      GLY  29  90.269  -9.133   0.947
  229    HA3  GLY  29           HA3      GLY  29  89.413  -8.425  -0.420
  230    HA   PRO  30           HA       PRO  30  86.482  -9.919   3.055
  231    HB2  PRO  30           HB2      PRO  30  86.041  -7.556   4.365
  232    HB3  PRO  30           HB1      PRO  30  87.320  -8.697   4.826
  233    HG2  PRO  30           HG2      PRO  30  87.510  -6.185   3.230
  234    HG3  PRO  30           HG1      PRO  30  88.605  -6.820   4.472
  235    HD2  PRO  30           HD2      PRO  30  89.116  -7.046   1.791
  236    HD3  PRO  30           HD1      PRO  30  89.689  -8.230   2.987
  237    H    ASN  31           H        ASN  31  84.217  -8.958   3.470
  238    HA   ASN  31           HA       ASN  31  83.191  -7.921   0.914
  239    HB2  ASN  31           HB2      ASN  31  81.051  -8.740   1.618
  240    HB3  ASN  31           HB1      ASN  31  82.229 -10.003   1.978
  241   HD21  ASN  31          HD21      ASN  31  82.789 -10.376   4.246
  242   HD22  ASN  31          HD22      ASN  31  81.828  -9.751   5.498
  243    H    LEU  32           H        LEU  32  81.385  -6.307   1.065
  244    HA   LEU  32           HA       LEU  32  81.902  -4.373   3.252
  245    HB2  LEU  32           HB2      LEU  32  80.871  -3.661   0.504
  246    HB3  LEU  32           HB3      LEU  32  81.479  -2.575   1.748
  247    HG   LEU  32           HG       LEU  32  83.069  -4.560   0.101
  248   HD11  LEU  32          HD11      LEU  32  84.374  -2.368  -0.320
  249   HD12  LEU  32          HD12      LEU  32  82.969  -1.549   0.359
  250   HD13  LEU  32          HD13      LEU  32  82.802  -2.529  -1.097
  251   HD21  LEU  32          HD21      LEU  32  84.207  -4.785   2.109
  252   HD22  LEU  32          HD22      LEU  32  83.700  -3.207   2.698
  253   HD23  LEU  32          HD23      LEU  32  84.984  -3.329   1.501
  254    H    HIS  33           H        HIS  33  79.991  -6.522   3.392
  255    HA   HIS  33           HA       HIS  33  77.362  -5.642   2.777
  256    HB2  HIS  33           HB2      HIS  33  78.276  -7.567   4.932
  257    HB3  HIS  33           HB1      HIS  33  76.629  -7.404   4.324
  258    HD1  HIS  33           HD1      HIS  33  78.336 -10.049   4.058
  259    HD2  HIS  33           HD2      HIS  33  77.876  -7.184   1.065
  260    HE1  HIS  33           HE1      HIS  33  78.785 -11.229   1.863
  261    HE2  HIS  33           HE2      HIS  33  78.505  -9.498   0.028
  262    H    GLY  34           H        GLY  34  75.848  -4.539   4.004
  263    HA2  GLY  34           HA2      GLY  34  75.284  -2.752   5.398
  264    HA3  GLY  34           HA3      GLY  34  75.675  -3.949   6.630
  265    H    LEU  35           H        LEU  35  78.040  -2.702   4.408
  266    HA   LEU  35           HA       LEU  35  80.028  -2.132   6.205
  267    HB2  LEU  35           HB2      LEU  35  80.414  -2.169   3.815
  268    HB3  LEU  35           HB3      LEU  35  79.370  -0.771   3.586
  269    HG   LEU  35           HG       LEU  35  81.098   0.322   5.330
  270   HD11  LEU  35          HD11      LEU  35  82.919  -1.491   3.771
  271   HD12  LEU  35          HD12      LEU  35  82.303  -1.982   5.347
  272   HD13  LEU  35          HD13      LEU  35  83.286  -0.526   5.196
  273   HD21  LEU  35          HD21      LEU  35  81.827  -0.047   2.415
  274   HD22  LEU  35          HD22      LEU  35  82.215   1.329   3.449
  275   HD23  LEU  35          HD23      LEU  35  80.546   1.034   2.965
  276    H    PHE  36           H        PHE  36  77.833   0.299   4.802
  277    HA   PHE  36           HA       PHE  36  78.670   2.480   6.295
  278    HB2  PHE  36           HB2      PHE  36  75.808   2.011   5.448
  279    HB3  PHE  36           HB1      PHE  36  76.637   3.554   5.651
  280    HD1  PHE  36           HD2      PHE  36  76.534   0.447   3.596
  281    HD2  PHE  36           HD1      PHE  36  77.976   4.487   3.894
  282    HE1  PHE  36           HE2      PHE  36  77.299   0.353   1.241
  283    HE2  PHE  36           HE1      PHE  36  78.727   4.391   1.543
  284    HZ   PHE  36           HZ       PHE  36  78.391   2.326   0.211
  285    H    GLY  37           H        GLY  37  79.047   1.979   8.473
  286    HA2  GLY  37           HA2      GLY  37  77.567   2.678  10.473
  287    HA3  GLY  37           HA3      GLY  37  76.689   1.212  10.078
  288    H    ARG  38           H        ARG  38  79.288  -0.162   9.343
  289    HA   ARG  38           HA       ARG  38  79.882  -1.056  12.054
  290    HB2  ARG  38           HB2      ARG  38  80.295  -2.095   9.313
  291    HB3  ARG  38           HB3      ARG  38  81.515  -2.553  10.502
  292    HG2  ARG  38           HG2      ARG  38  79.636  -3.292  12.021
  293    HG3  ARG  38           HG3      ARG  38  78.524  -3.016  10.680
  294    HD2  ARG  38           HD2      ARG  38  80.843  -4.623   9.889
  295    HD3  ARG  38           HD3      ARG  38  79.915  -5.378  11.181
  296    HE   ARG  38           HE       ARG  38  77.943  -4.750   9.518
  297   HH11  ARG  38          HH21      ARG  38  81.097  -6.042   8.855
  298   HH12  ARG  38          HH22      ARG  38  80.595  -6.887   7.430
  299   HH21  ARG  38          HH11      ARG  38  77.290  -5.870   7.662
  300   HH22  ARG  38          HH12      ARG  38  78.443  -6.796   6.760
  301    H    LYS  39           H        LYS  39  81.971  -1.209  12.945
  302    HA   LYS  39           HA       LYS  39  83.624   1.093  12.443
  303    HB2  LYS  39           HB2      LYS  39  83.106   0.101  14.715
  304    HB3  LYS  39           HB3      LYS  39  84.205  -1.212  14.302
  305    HG2  LYS  39           HG2      LYS  39  85.984   0.056  14.873
  306    HG3  LYS  39           HG3      LYS  39  85.507   1.291  13.715
  307    HD2  LYS  39           HD2      LYS  39  85.627   2.235  15.981
  308    HD3  LYS  39           HD3      LYS  39  83.968   2.266  15.382
  309    HE2  LYS  39           HE2      LYS  39  84.550  -0.245  16.750
  310    HE3  LYS  39           HE3      LYS  39  84.830   1.145  17.800
  311    HZ1  LYS  39           HZ1      LYS  39  82.664   1.731  17.766
  312    HZ2  LYS  39           HZ2      LYS  39  82.449   0.071  17.469
  313    HZ3  LYS  39           HZ3      LYS  39  82.407   1.181  16.183
  314    H    THR  40           H        THR  40  85.883   1.057  11.966
  315    HA   THR  40           HA       THR  40  86.662  -0.369   9.748
  316    HB   THR  40           HB       THR  40  89.036   0.212  10.510
  317    HG1  THR  40           HG1      THR  40  87.852   1.868  12.393
  318   HG21  THR  40          HG21      THR  40  88.671   2.598  10.098
  319   HG22  THR  40          HG22      THR  40  86.953   2.414  10.451
  320   HG23  THR  40          HG23      THR  40  87.649   1.639   9.028
  321    H    GLY  41           H        GLY  41  87.839  -2.188   9.313
  322    HA2  GLY  41           HA2      GLY  41  88.411  -4.401   9.594
  323    HA3  GLY  41           HA3      GLY  41  89.325  -3.789  10.970
  324    H    GLN  42           H        GLN  42  85.839  -4.176  10.320
  325    HA   GLN  42           HA       GLN  42  85.635  -5.651  12.886
  326    HB2  GLN  42           HB2      GLN  42  84.449  -3.515  12.936
  327    HB3  GLN  42           HB1      GLN  42  83.549  -3.964  11.487
  328    HG2  GLN  42           HG2      GLN  42  82.346  -5.653  12.603
  329    HG3  GLN  42           HG1      GLN  42  83.510  -5.737  13.923
  330   HE21  GLN  42          HE21      GLN  42  81.653  -3.009  12.442
  331   HE22  GLN  42          HE22      GLN  42  81.037  -2.448  13.921
  332    H    ALA  43           H        ALA  43  85.115  -5.809   9.480
  333    HA   ALA  43           HA       ALA  43  83.064  -7.748   9.413
  334    HB1  ALA  43           HB1      ALA  43  84.827  -6.455   7.542
  335    HB2  ALA  43           HB2      ALA  43  83.272  -7.230   7.243
  336    HB3  ALA  43           HB3      ALA  43  84.754  -8.182   7.191
  337    HA   PRO  44           HA       PRO  44  85.653 -11.116  10.906
  338    HB2  PRO  44           HB2      PRO  44  83.715 -12.988  11.151
  339    HB3  PRO  44           HB1      PRO  44  83.842 -11.618  12.274
  340    HG2  PRO  44           HG2      PRO  44  82.002 -12.000   9.960
  341    HG3  PRO  44           HG1      PRO  44  81.674 -11.313  11.560
  342    HD2  PRO  44           HD2      PRO  44  82.137  -9.796   9.292
  343    HD3  PRO  44           HD1      PRO  44  82.410  -9.219  10.952
  344    H    GLY  45           H        GLY  45  86.993 -11.914   9.345
  345    HA2  GLY  45           HA2      GLY  45  86.516 -14.179   7.880
  346    HA3  GLY  45           HA3      GLY  45  86.037 -12.869   6.806
  347    H    PHE  46           H        PHE  46  87.645 -11.242   6.267
  348    HA   PHE  46           HA       PHE  46  90.193 -12.411   5.690
  349    HB2  PHE  46           HB2      PHE  46  88.915 -10.677   4.302
  350    HB3  PHE  46           HB1      PHE  46  89.509  -9.483   5.456
  351    HD1  PHE  46           HD2      PHE  46  90.636 -12.184   3.132
  352    HD2  PHE  46           HD1      PHE  46  91.700  -8.622   5.284
  353    HE1  PHE  46           HE2      PHE  46  92.815 -12.121   1.949
  354    HE2  PHE  46           HE1      PHE  46  93.878  -8.558   4.101
  355    HZ   PHE  46           HZ       PHE  46  94.436 -10.306   2.433
  356    H    THR  47           H        THR  47  92.249 -11.699   6.401
  357    HA   THR  47           HA       THR  47  92.344 -11.048   9.205
  358    HB   THR  47           HB       THR  47  94.649 -11.225   7.256
  359    HG1  THR  47           HG1      THR  47  93.142 -13.086   7.421
  360   HG21  THR  47          HG21      THR  47  95.341 -10.272   9.340
  361   HG22  THR  47          HG22      THR  47  95.815 -11.970   9.389
  362   HG23  THR  47          HG23      THR  47  94.380 -11.428  10.261
  363    H    TYR  48           H        TYR  48  91.371  -8.960   9.219
  364    HA   TYR  48           HA       TYR  48  92.196  -6.744   7.730
  365    HB2  TYR  48           HB2      TYR  48  90.801  -7.140  10.336
  366    HB3  TYR  48           HB3      TYR  48  91.394  -5.523   9.965
  367    HD1  TYR  48           HD2      TYR  48  90.797  -4.519   7.685
  368    HD2  TYR  48           HD1      TYR  48  88.791  -7.919   9.371
  369    HE1  TYR  48           HE2      TYR  48  88.875  -4.130   6.176
  370    HE2  TYR  48           HE1      TYR  48  86.866  -7.531   7.859
  371    HH   TYR  48           HH       TYR  48  86.323  -4.712   6.269
  372    H    THR  49           H        THR  49  93.525  -4.962   8.265
  373    HA   THR  49           HA       THR  49  95.996  -5.742   9.582
  374    HB   THR  49           HB       THR  49  96.829  -3.572   8.777
  375    HG1  THR  49           HG1      THR  49  95.422  -2.071   8.470
  376   HG21  THR  49          HG21      THR  49  97.056  -5.246   7.143
  377   HG22  THR  49          HG22      THR  49  96.208  -3.962   6.283
  378   HG23  THR  49          HG23      THR  49  95.315  -5.358   6.883
  379    H    ASP  50           H        ASP  50  96.955  -4.589  11.321
  380    HA   ASP  50           HA       ASP  50  95.397  -4.101  13.532
  381    HB2  ASP  50           HB2      ASP  50  98.009  -2.724  12.860
  382    HB3  ASP  50           HB1      ASP  50  97.310  -2.893  14.470
  383    H    ALA  51           H        ALA  51  96.482  -1.744  11.105
  384    HA   ALA  51           HA       ALA  51  95.522   0.586  12.285
  385    HB1  ALA  51           HB1      ALA  51  95.551  -0.096   9.336
  386    HB2  ALA  51           HB2      ALA  51  96.916   0.541  10.252
  387    HB3  ALA  51           HB3      ALA  51  95.471   1.524  10.028
  388    H    ASN  52           H        ASN  52  93.825  -1.800  10.288
  389    HA   ASN  52           HA       ASN  52  91.335  -0.316  10.356
  390    HB2  ASN  52           HB2      ASN  52  92.240  -2.954   9.248
  391    HB3  ASN  52           HB1      ASN  52  90.517  -2.656   9.450
  392   HD21  ASN  52          HD21      ASN  52  90.198  -2.593   7.110
  393   HD22  ASN  52          HD22      ASN  52  90.715  -1.256   6.197
  394    H    LYS  53           H        LYS  53  92.935  -2.746  12.223
  395    HA   LYS  53           HA       LYS  53  90.532  -3.552  13.650
  396    HB2  LYS  53           HB2      LYS  53  91.774  -5.410  13.941
  397    HB3  LYS  53           HB3      LYS  53  93.175  -4.613  13.239
  398    HG2  LYS  53           HG2      LYS  53  93.727  -3.640  15.450
  399    HG3  LYS  53           HG3      LYS  53  92.325  -4.455  16.149
  400    HD2  LYS  53           HD2      LYS  53  93.253  -6.618  15.718
  401    HD3  LYS  53           HD3      LYS  53  94.527  -5.941  14.703
  402    HE2  LYS  53           HE2      LYS  53  94.226  -5.243  17.632
  403    HE3  LYS  53           HE3      LYS  53  95.240  -6.570  17.063
  404    HZ1  LYS  53           HZ1      LYS  53  96.613  -4.672  17.253
  405    HZ2  LYS  53           HZ2      LYS  53  95.506  -3.689  16.420
  406    HZ3  LYS  53           HZ3      LYS  53  96.352  -4.908  15.594
  407    H    ASN  54           H        ASN  54  92.748  -1.043  13.724
  408    HA   ASN  54           HA       ASN  54  93.024  -0.582  16.505
  409    HB2  ASN  54           HB2      ASN  54  94.026   1.399  15.894
  410    HB3  ASN  54           HB1      ASN  54  94.215   0.487  14.402
  411   HD21  ASN  54          HD21      ASN  54  91.476   0.713  13.473
  412   HD22  ASN  54          HD22      ASN  54  91.199   2.341  13.085
  413    H    LYS  55           H        LYS  55  90.435  -0.200  14.314
  414    HA   LYS  55           HA       LYS  55  88.305   0.682  14.522
  415    HB2  LYS  55           HB2      LYS  55  88.888   0.326  17.471
  416    HB3  LYS  55           HB3      LYS  55  87.292   0.521  16.747
  417    HG2  LYS  55           HG2      LYS  55  87.307  -1.604  15.799
  418    HG3  LYS  55           HG3      LYS  55  89.067  -1.680  15.738
  419    HD2  LYS  55           HD2      LYS  55  89.134  -1.878  18.207
  420    HD3  LYS  55           HD3      LYS  55  87.371  -1.845  18.248
  421    HE2  LYS  55           HE2      LYS  55  87.196  -3.927  17.126
  422    HE3  LYS  55           HE3      LYS  55  88.877  -3.876  16.597
  423    HZ1  LYS  55           HZ1      LYS  55  89.324  -3.807  19.144
  424    HZ2  LYS  55           HZ2      LYS  55  89.005  -5.288  18.375
  425    HZ3  LYS  55           HZ3      LYS  55  87.779  -4.500  19.248
  426    H    GLY  56           H        GLY  56  89.677   2.694  13.821
  427    HA2  GLY  56           HA2      GLY  56  89.746   4.777  15.882
  428    HA3  GLY  56           HA3      GLY  56  90.411   4.897  14.257
  429    H    ILE  57           H        ILE  57  88.048   3.997  12.874
  430    HA   ILE  57           HA       ILE  57  86.017   6.003  13.576
  431    HB   ILE  57           HB       ILE  57  85.959   6.900  11.317
  432   HG12  ILE  57          HG12      ILE  57  88.212   6.162   9.985
  433   HG13  ILE  57          HG13      ILE  57  87.875   4.659  10.841
  434   HG21  ILE  57          HG21      ILE  57  88.029   8.153  11.385
  435   HG22  ILE  57          HG22      ILE  57  88.812   6.894  12.339
  436   HG23  ILE  57          HG23      ILE  57  87.517   7.858  13.046
  437   HD11  ILE  57          HD11      ILE  57  85.725   4.445   9.825
  438   HD12  ILE  57          HD12      ILE  57  86.812   4.915   8.523
  439   HD13  ILE  57          HD13      ILE  57  85.746   6.112   9.253
  440    H    THR  58           H        THR  58  84.222   5.816  11.717
  441    HA   THR  58           HA       THR  58  83.695   2.933  11.318
  442    HB   THR  58           HB       THR  58  81.907   5.109  12.361
  443    HG1  THR  58           HG1      THR  58  83.059   3.570  13.706
  444   HG21  THR  58          HG21      THR  58  80.087   3.246  12.023
  445   HG22  THR  58          HG22      THR  58  81.153   2.703  10.729
  446   HG23  THR  58          HG23      THR  58  80.478   4.331  10.688
  447    H    TRP  59           H        TRP  59  82.852   2.305   9.393
  448    HA   TRP  59           HA       TRP  59  83.249   3.943   7.125
  449    HB2  TRP  59           HB2      TRP  59  81.412   1.555   7.177
  450    HB3  TRP  59           HB1      TRP  59  82.418   2.141   5.850
  451    HD1  TRP  59           HD1      TRP  59  85.158   2.474   7.289
  452    HE1  TRP  59           HE1      TRP  59  86.472   0.406   8.099
  453    HE3  TRP  59           HE3      TRP  59  81.378  -0.946   7.571
  454    HZ2  TRP  59           HZ2      TRP  59  85.975  -2.322   8.808
  455    HZ3  TRP  59           HZ3      TRP  59  81.830  -3.266   8.303
  456    HH2  TRP  59           HH2      TRP  59  84.122  -3.956   8.925
  457    H    LYS  60           H        LYS  60  81.911   5.214   5.970
  458    HA   LYS  60           HA       LYS  60  79.037   5.221   6.446
  459    HB2  LYS  60           HB2      LYS  60  80.781   7.624   7.053
  460    HB3  LYS  60           HB3      LYS  60  79.027   7.683   6.901
  461    HG2  LYS  60           HG2      LYS  60  78.995   5.815   8.689
  462    HG3  LYS  60           HG3      LYS  60  80.676   6.257   8.989
  463    HD2  LYS  60           HD2      LYS  60  78.454   8.310   8.996
  464    HD3  LYS  60           HD3      LYS  60  78.914   7.422  10.447
  465    HE2  LYS  60           HE2      LYS  60  81.257   8.216  10.153
  466    HE3  LYS  60           HE3      LYS  60  80.731   9.176   8.771
  467    HZ1  LYS  60           HZ1      LYS  60  79.091  10.231  10.318
  468    HZ2  LYS  60           HZ2      LYS  60  80.719  10.599  10.631
  469    HZ3  LYS  60           HZ3      LYS  60  79.900   9.468  11.599
  470    H    GLU  61           H        GLU  61  78.449   7.620   5.149
  471    HA   GLU  61           HA       GLU  61  78.973   6.865   2.422
  472    HB2  GLU  61           HB2      GLU  61  76.805   7.819   3.117
  473    HB3  GLU  61           HB3      GLU  61  77.611   9.333   3.528
  474    HG2  GLU  61           HG2      GLU  61  78.287   9.669   1.227
  475    HG3  GLU  61           HG3      GLU  61  77.688   8.074   0.772
  476    H    GLU  62           H        GLU  62  79.610   9.866   4.262
  477    HA   GLU  62           HA       GLU  62  81.358  10.935   2.281
  478    HB2  GLU  62           HB2      GLU  62  80.991  11.640   5.203
  479    HB3  GLU  62           HB3      GLU  62  81.955  12.579   4.062
  480    HG2  GLU  62           HG2      GLU  62  79.040  11.914   3.596
  481    HG3  GLU  62           HG3      GLU  62  79.570  13.395   4.389
  482    H    THR  63           H        THR  63  81.891   9.148   5.296
  483    HA   THR  63           HA       THR  63  84.674   9.395   5.455
  484    HB   THR  63           HB       THR  63  84.619   7.305   6.748
  485    HG1  THR  63           HG1      THR  63  83.165   6.148   5.494
  486   HG21  THR  63          HG21      THR  63  83.959   9.190   8.011
  487   HG22  THR  63          HG22      THR  63  82.707   7.989   8.321
  488   HG23  THR  63          HG23      THR  63  82.406   9.303   7.184
  489    H    LEU  64           H        LEU  64  82.633   7.253   3.558
  490    HA   LEU  64           HA       LEU  64  84.726   5.589   2.593
  491    HB2  LEU  64           HB2      LEU  64  81.871   5.917   2.135
  492    HB3  LEU  64           HB3      LEU  64  82.734   5.593   0.640
  493    HG   LEU  64           HG       LEU  64  83.145   3.936   3.135
  494   HD11  LEU  64          HD11      LEU  64  81.685   2.362   1.416
  495   HD12  LEU  64          HD12      LEU  64  80.938   3.939   1.176
  496   HD13  LEU  64          HD13      LEU  64  81.009   3.237   2.789
  497   HD21  LEU  64          HD21      LEU  64  83.808   2.275   1.241
  498   HD22  LEU  64          HD22      LEU  64  84.938   3.569   1.631
  499   HD23  LEU  64          HD23      LEU  64  83.896   3.705   0.215
  500    H    MET  65           H        MET  65  83.296   8.626   1.505
  501    HA   MET  65           HA       MET  65  84.411   8.727  -1.071
  502    HB2  MET  65           HB2      MET  65  83.804  10.996   0.836
  503    HB3  MET  65           HB1      MET  65  84.148  11.185  -0.883
  504    HG2  MET  65           HG2      MET  65  82.202   9.922  -1.497
  505    HG3  MET  65           HG1      MET  65  81.930   9.424   0.172
  506    HE1  MET  65           HE1      MET  65  80.399  11.508  -2.397
  507    HE2  MET  65           HE2      MET  65  82.047  12.131  -2.407
  508    HE3  MET  65           HE3      MET  65  80.714  13.194  -1.963
  509    H    GLU  66           H        GLU  66  85.666  10.247   1.915
  510    HA   GLU  66           HA       GLU  66  88.106  11.100   0.805
  511    HB2  GLU  66           HB2      GLU  66  87.573  10.275   3.672
  512    HB3  GLU  66           HB3      GLU  66  88.883  11.312   3.106
  513    HG2  GLU  66           HG2      GLU  66  87.093  12.856   2.165
  514    HG3  GLU  66           HG3      GLU  66  85.915  11.896   3.056
  515    H    TYR  67           H        TYR  67  87.023   8.028   2.026
  516    HA   TYR  67           HA       TYR  67  89.643   6.823   2.142
  517    HB2  TYR  67           HB2      TYR  67  87.985   5.930   3.610
  518    HB3  TYR  67           HB3      TYR  67  86.833   5.743   2.295
  519    HD1  TYR  67           HD2      TYR  67  87.080   3.949   0.632
  520    HD2  TYR  67           HD1      TYR  67  89.803   4.345   3.930
  521    HE1  TYR  67           HE2      TYR  67  87.912   1.649   0.222
  522    HE2  TYR  67           HE1      TYR  67  90.633   2.044   3.522
  523    HH   TYR  67           HH       TYR  67  90.481   0.464   0.955
  524    H    LEU  68           H        LEU  68  87.110   7.229  -0.205
  525    HA   LEU  68           HA       LEU  68  88.103   5.219  -2.024
  526    HB2  LEU  68           HB2      LEU  68  85.893   7.231  -2.024
  527    HB3  LEU  68           HB3      LEU  68  86.446   6.621  -3.577
  528    HG   LEU  68           HG       LEU  68  85.593   4.868  -1.256
  529   HD11  LEU  68          HD11      LEU  68  83.602   5.861  -1.958
  530   HD12  LEU  68          HD12      LEU  68  83.656   4.407  -2.947
  531   HD13  LEU  68          HD13      LEU  68  84.113   5.964  -3.639
  532   HD21  LEU  68          HD21      LEU  68  86.706   4.373  -3.970
  533   HD22  LEU  68          HD22      LEU  68  85.366   3.345  -3.477
  534   HD23  LEU  68          HD23      LEU  68  86.832   3.406  -2.505
  535    H    GLU  69           H        GLU  69  88.749   8.542  -1.362
  536    HA   GLU  69           HA       GLU  69  90.021   8.975  -3.967
  537    HB2  GLU  69           HB2      GLU  69  89.891  11.224  -3.524
  538    HB3  GLU  69           HB3      GLU  69  88.586  10.670  -2.482
  539    HG2  GLU  69           HG2      GLU  69  89.792  12.011  -1.013
  540    HG3  GLU  69           HG3      GLU  69  90.492  10.430  -0.683
  541    H    ASN  70           H        ASN  70  90.796   7.738  -0.966
  542    HA   ASN  70           HA       ASN  70  93.536   7.374  -1.570
  543    HB2  ASN  70           HB2      ASN  70  93.274   9.907  -0.838
  544    HB3  ASN  70           HB1      ASN  70  93.271   9.215   0.779
  545   HD21  ASN  70          HD21      ASN  70  95.119   7.120   0.516
  546   HD22  ASN  70          HD22      ASN  70  96.641   7.751   0.112
  547    HA   PRO  71           HA       PRO  71  91.226   4.592   1.465
  548    HB2  PRO  71           HB2      PRO  71  92.991   2.723  -0.063
  549    HB3  PRO  71           HB1      PRO  71  91.305   2.519   0.444
  550    HG2  PRO  71           HG2      PRO  71  91.952   3.091  -2.080
  551    HG3  PRO  71           HG1      PRO  71  90.485   3.731  -1.322
  552    HD2  PRO  71           HD2      PRO  71  93.016   5.144  -2.004
  553    HD3  PRO  71           HD1      PRO  71  91.364   5.786  -1.873
  554    H    LYS  72           H        LYS  72  94.646   4.723   0.514
  555    HA   LYS  72           HA       LYS  72  95.596   3.389   2.864
  556    HB2  LYS  72           HB2      LYS  72  96.808   3.442   0.686
  557    HB3  LYS  72           HB3      LYS  72  97.133   5.152   0.954
  558    HG2  LYS  72           HG2      LYS  72  98.937   4.599   2.191
  559    HG3  LYS  72           HG3      LYS  72  97.874   3.813   3.354
  560    HD2  LYS  72           HD2      LYS  72  98.864   2.446   0.836
  561    HD3  LYS  72           HD3      LYS  72  99.691   2.327   2.388
  562    HE2  LYS  72           HE2      LYS  72  96.855   1.442   1.777
  563    HE3  LYS  72           HE3      LYS  72  98.230   0.405   2.155
  564    HZ1  LYS  72           HZ1      LYS  72  98.355   1.717   4.307
  565    HZ2  LYS  72           HZ2      LYS  72  97.076   0.610   4.151
  566    HZ3  LYS  72           HZ3      LYS  72  96.796   2.272   3.940
  567    H    LYS  73           H        LYS  73  95.600   6.803   1.837
  568    HA   LYS  73           HA       LYS  73  96.911   7.789   4.121
  569    HB2  LYS  73           HB2      LYS  73  96.641   9.041   1.988
  570    HB3  LYS  73           HB3      LYS  73  94.937   9.271   2.379
  571    HG2  LYS  73           HG2      LYS  73  95.464  10.549   4.335
  572    HG3  LYS  73           HG3      LYS  73  97.168  10.105   4.244
  573    HD2  LYS  73           HD2      LYS  73  96.946  12.356   3.388
  574    HD3  LYS  73           HD3      LYS  73  97.286  11.289   2.026
  575    HE2  LYS  73           HE2      LYS  73  95.044  11.343   1.274
  576    HE3  LYS  73           HE3      LYS  73  94.452  11.966   2.813
  577    HZ1  LYS  73           HZ1      LYS  73  94.911  13.502   0.703
  578    HZ2  LYS  73           HZ2      LYS  73  96.436  13.591   1.446
  579    HZ3  LYS  73           HZ3      LYS  73  95.042  14.061   2.299
  580    H    TYR  74           H        TYR  74  93.547   6.990   3.560
  581    HA   TYR  74           HA       TYR  74  92.451   8.490   5.702
  582    HB2  TYR  74           HB2      TYR  74  91.324   7.180   3.685
  583    HB3  TYR  74           HB3      TYR  74  91.217   5.893   4.883
  584    HD1  TYR  74           HD1      TYR  74  90.710   9.623   4.766
  585    HD2  TYR  74           HD2      TYR  74  89.228   5.816   6.098
  586    HE1  TYR  74           HE1      TYR  74  88.753  10.743   5.794
  587    HE2  TYR  74           HE2      TYR  74  87.273   6.939   7.127
  588    HH   TYR  74           HH       TYR  74  86.827   9.371   8.046
  589    H    ILE  75           H        ILE  75  93.185   5.000   5.499
  590    HA   ILE  75           HA       ILE  75  93.624   5.017   8.430
  591    HB   ILE  75           HB       ILE  75  92.384   2.762   6.831
  592   HG12  ILE  75          HG12      ILE  75  91.007   4.530   8.863
  593   HG13  ILE  75          HG13      ILE  75  91.011   4.927   7.146
  594   HG21  ILE  75          HG21      ILE  75  92.907   3.213   9.785
  595   HG22  ILE  75          HG22      ILE  75  93.549   1.921   8.770
  596   HG23  ILE  75          HG23      ILE  75  91.833   1.954   9.173
  597   HD11  ILE  75          HD11      ILE  75  90.080   2.263   8.241
  598   HD12  ILE  75          HD12      ILE  75  89.907   2.855   6.588
  599   HD13  ILE  75          HD13      ILE  75  88.995   3.609   7.896
  600    HA   PRO  76           HA       PRO  76  97.505   3.915   5.981
  601    HB2  PRO  76           HB2      PRO  76  98.386   4.664   8.753
  602    HB3  PRO  76           HB1      PRO  76  99.167   5.004   7.196
  603    HG2  PRO  76           HG2      PRO  76  97.745   6.863   8.480
  604    HG3  PRO  76           HG1      PRO  76  97.752   6.747   6.712
  605    HD2  PRO  76           HD2      PRO  76  95.576   6.090   8.613
  606    HD3  PRO  76           HD1      PRO  76  95.480   6.484   6.884
  607    H    GLY  77           H        GLY  77  98.016   1.823   5.826
  608    HA2  GLY  77           HA2      GLY  77  99.094  -0.092   6.942
  609    HA3  GLY  77           HA3      GLY  77  97.952   0.134   8.262
  610    H    THR  78           H        THR  78  95.786   0.763   6.280
  611    HA   THR  78           HA       THR  78  94.575  -1.742   6.119
  612    HB   THR  78           HB       THR  78  93.312   0.337   5.911
  613    HG1  THR  78           HG1      THR  78  92.976  -1.804   4.521
  614   HG21  THR  78          HG21      THR  78  95.102   1.512   4.593
  615   HG22  THR  78          HG22      THR  78  93.473   1.726   3.949
  616   HG23  THR  78          HG23      THR  78  94.584   0.593   3.180
  617    H    LYS  79           H        LYS  79  94.618  -3.389   4.680
  618    HA   LYS  79           HA       LYS  79  96.722  -3.353   2.678
  619    HB2  LYS  79           HB2      LYS  79  95.559  -5.321   4.281
  620    HB3  LYS  79           HB3      LYS  79  95.001  -5.711   2.658
  621    HG2  LYS  79           HG2      LYS  79  97.108  -6.843   3.019
  622    HG3  LYS  79           HG3      LYS  79  97.376  -5.542   1.861
  623    HD2  LYS  79           HD2      LYS  79  98.790  -4.442   3.259
  624    HD3  LYS  79           HD3      LYS  79  97.727  -4.667   4.647
  625    HE2  LYS  79           HE2      LYS  79  99.502  -6.844   3.511
  626    HE3  LYS  79           HE3      LYS  79  99.947  -5.824   4.879
  627    HZ1  LYS  79           HZ1      LYS  79  98.131  -8.048   4.767
  628    HZ2  LYS  79           HZ2      LYS  79  97.467  -6.685   5.533
  629    HZ3  LYS  79           HZ3      LYS  79  98.918  -7.358   6.102
  630    H    MET  80           H        MET  80  96.021  -1.923   1.089
  631    HA   MET  80           HA       MET  80  94.440  -3.007  -0.984
  632    HB2  MET  80           HB2      MET  80  92.506  -2.547   0.359
  633    HB3  MET  80           HB1      MET  80  93.090  -0.929   0.750
  634    HG2  MET  80           HG2      MET  80  92.742  -0.150  -1.468
  635    HG3  MET  80           HG1      MET  80  92.575  -1.786  -2.103
  636    HE1  MET  80           HE1      MET  80  89.184   0.525  -2.118
  637    HE2  MET  80           HE2      MET  80  90.325  -0.236  -3.223
  638    HE3  MET  80           HE3      MET  80  90.880   1.026  -2.124
  639    H    ILE  81           H        ILE  81  96.106  -2.354  -2.299
  640    HA   ILE  81           HA       ILE  81  96.379   0.568  -2.697
  641    HB   ILE  81           HB       ILE  81  98.533  -1.560  -2.765
  642   HG12  ILE  81          HG12      ILE  81  99.599   0.158  -1.180
  643   HG13  ILE  81          HG13      ILE  81  98.014   0.923  -1.106
  644   HG21  ILE  81          HG21      ILE  81  99.994   0.464  -3.373
  645   HG22  ILE  81          HG22      ILE  81  98.491   1.273  -3.816
  646   HG23  ILE  81          HG23      ILE  81  98.984  -0.196  -4.659
  647   HD11  ILE  81          HD11      ILE  81  97.806  -1.954  -0.685
  648   HD12  ILE  81          HD12      ILE  81  97.253  -0.630   0.339
  649   HD13  ILE  81          HD13      ILE  81  98.910  -1.212   0.473
  650    H    PHE  82           H        PHE  82  95.042   0.749  -4.452
  651    HA   PHE  82           HA       PHE  82  95.893  -0.695  -6.888
  652    HB2  PHE  82           HB2      PHE  82  93.843  -1.757  -6.105
  653    HB3  PHE  82           HB1      PHE  82  93.045  -0.189  -5.991
  654    HD1  PHE  82           HD1      PHE  82  94.739  -2.486  -8.406
  655    HD2  PHE  82           HD2      PHE  82  91.974   0.759  -7.869
  656    HE1  PHE  82           HE1      PHE  82  94.101  -2.633 -10.798
  657    HE2  PHE  82           HE2      PHE  82  91.336   0.612 -10.261
  658    HZ   PHE  82           HZ       PHE  82  92.400  -1.084 -11.726
  659    H    ALA  83           H        ALA  83  93.398   1.740  -6.155
  660    HA   ALA  83           HA       ALA  83  94.806   3.963  -7.177
  661    HB1  ALA  83           HB1      ALA  83  94.717   2.954  -9.341
  662    HB2  ALA  83           HB2      ALA  83  93.471   4.203  -9.321
  663    HB3  ALA  83           HB3      ALA  83  93.023   2.509  -9.134
  664    H    GLY  84           H        GLY  84  93.821   5.690  -6.346
  665    HA2  GLY  84           HA2      GLY  84  91.247   5.455  -5.092
  666    HA3  GLY  84           HA3      GLY  84  92.239   6.908  -5.175
  667    H    ILE  85           H        ILE  85  89.775   7.554  -5.470
  668    HA   ILE  85           HA       ILE  85  88.929   7.370  -8.270
  669    HB   ILE  85           HB       ILE  85  87.641   8.533  -5.798
  670   HG12  ILE  85          HG12      ILE  85  87.829   5.950  -6.376
  671   HG13  ILE  85          HG13      ILE  85  86.317   6.616  -5.772
  672   HG21  ILE  85          HG21      ILE  85  86.778   8.573  -8.693
  673   HG22  ILE  85          HG22      ILE  85  86.867   9.922  -7.562
  674   HG23  ILE  85          HG23      ILE  85  85.615   8.694  -7.374
  675   HD11  ILE  85          HD11      ILE  85  85.304   6.593  -7.888
  676   HD12  ILE  85          HD12      ILE  85  86.234   5.095  -7.877
  677   HD13  ILE  85          HD13      ILE  85  86.849   6.509  -8.733
  678    H    LYS  86           H        LYS  86  88.288   9.351  -9.426
  679    HA   LYS  86           HA       LYS  86  90.257  11.481  -8.952
  680    HB2  LYS  86           HB2      LYS  86  88.579  11.523 -11.400
  681    HB3  LYS  86           HB3      LYS  86  90.310  11.800 -11.210
  682    HG2  LYS  86           HG2      LYS  86  90.491   9.285 -10.708
  683    HG3  LYS  86           HG3      LYS  86  88.847   9.160 -11.332
  684    HD2  LYS  86           HD2      LYS  86  90.022   8.807 -13.295
  685    HD3  LYS  86           HD3      LYS  86  89.885  10.564 -13.352
  686    HE2  LYS  86           HE2      LYS  86  92.183  10.106 -13.774
  687    HE3  LYS  86           HE3      LYS  86  92.120  10.620 -12.088
  688    HZ1  LYS  86           HZ1      LYS  86  91.843   7.768 -12.734
  689    HZ2  LYS  86           HZ2      LYS  86  92.453   8.501 -11.327
  690    HZ3  LYS  86           HZ3      LYS  86  93.387   8.470 -12.747
  691    H    LYS  87           H        LYS  87  86.947  11.494 -10.309
  692    HA   LYS  87           HA       LYS  87  86.500  14.140  -9.187
  693    HB2  LYS  87           HB2      LYS  87  84.596  12.408 -10.772
  694    HB3  LYS  87           HB3      LYS  87  84.464  14.143 -10.481
  695    HG2  LYS  87           HG2      LYS  87  86.876  14.194 -11.576
  696    HG3  LYS  87           HG3      LYS  87  86.362  12.659 -12.277
  697    HD2  LYS  87           HD2      LYS  87  84.778  15.239 -12.478
  698    HD3  LYS  87           HD3      LYS  87  85.854  14.632 -13.736
  699    HE2  LYS  87           HE2      LYS  87  83.439  13.165 -12.632
  700    HE3  LYS  87           HE3      LYS  87  83.517  13.986 -14.190
  701    HZ1  LYS  87           HZ1      LYS  87  84.860  11.521 -13.323
  702    HZ2  LYS  87           HZ2      LYS  87  85.577  12.479 -14.529
  703    HZ3  LYS  87           HZ3      LYS  87  84.021  11.838 -14.761
  704    H    LYS  88           H        LYS  88  84.473  14.648  -8.051
  705    HA   LYS  88           HA       LYS  88  84.154  12.989  -5.751
  706    HB2  LYS  88           HB2      LYS  88  83.881  15.346  -5.469
  707    HB3  LYS  88           HB3      LYS  88  82.672  15.426  -6.747
  708    HG2  LYS  88           HG2      LYS  88  81.990  13.531  -4.579
  709    HG3  LYS  88           HG3      LYS  88  82.098  15.209  -4.052
  710    HD2  LYS  88           HD2      LYS  88  80.566  15.858  -5.916
  711    HD3  LYS  88           HD3      LYS  88  80.393  14.152  -6.327
  712    HE2  LYS  88           HE2      LYS  88  78.524  14.684  -4.935
  713    HE3  LYS  88           HE3      LYS  88  79.644  13.782  -3.918
  714    HZ1  LYS  88           HZ1      LYS  88  78.603  16.086  -3.185
  715    HZ2  LYS  88           HZ2      LYS  88  79.972  16.676  -4.000
  716    HZ3  LYS  88           HZ3      LYS  88  80.152  15.597  -2.700
  717    H    THR  89           H        THR  89  81.953  13.820  -8.447
  718    HA   THR  89           HA       THR  89  79.777  12.277  -7.695
  719    HB   THR  89           HB       THR  89  79.224  12.141 -10.104
  720    HG1  THR  89           HG1      THR  89  80.675  12.760 -11.592
  721   HG21  THR  89          HG21      THR  89  78.619  14.163  -8.936
  722   HG22  THR  89          HG22      THR  89  79.270  14.633 -10.506
  723   HG23  THR  89          HG23      THR  89  80.264  14.786  -9.058
  724    H    GLU  90           H        GLU  90  82.864  11.272  -8.938
  725    HA   GLU  90           HA       GLU  90  82.076   8.656  -9.768
  726    HB2  GLU  90           HB2      GLU  90  84.721   9.923  -9.076
  727    HB3  GLU  90           HB3      GLU  90  84.598   8.202  -9.429
  728    HG2  GLU  90           HG2      GLU  90  83.690   8.651 -11.623
  729    HG3  GLU  90           HG3      GLU  90  83.568  10.374 -11.270
  730    H    ARG  91           H        ARG  91  83.233  10.093  -6.769
  731    HA   ARG  91           HA       ARG  91  83.376   7.600  -5.335
  732    HB2  ARG  91           HB2      ARG  91  83.238  10.444  -4.286
  733    HB3  ARG  91           HB3      ARG  91  83.711   9.018  -3.363
  734    HG2  ARG  91           HG2      ARG  91  85.534   8.660  -5.101
  735    HG3  ARG  91           HG3      ARG  91  85.165  10.277  -5.695
  736    HD2  ARG  91           HD2      ARG  91  85.415  10.893  -3.113
  737    HD3  ARG  91           HD3      ARG  91  86.402   9.437  -3.103
  738    HE   ARG  91           HE       ARG  91  87.949  10.503  -4.540
  739   HH11  ARG  91          HH21      ARG  91  85.181  12.479  -3.833
  740   HH12  ARG  91          HH22      ARG  91  85.923  13.939  -4.387
  741   HH21  ARG  91          HH11      ARG  91  88.906  12.419  -5.268
  742   HH22  ARG  91          HH12      ARG  91  88.024  13.907  -5.199
  743    H    GLU  92           H        GLU  92  81.139  10.381  -5.342
  744    HA   GLU  92           HA       GLU  92  79.287   9.377  -3.500
  745    HB2  GLU  92           HB2      GLU  92  79.483  11.697  -4.829
  746    HB3  GLU  92           HB3      GLU  92  78.263  10.927  -5.839
  747    HG2  GLU  92           HG2      GLU  92  78.116  11.437  -2.856
  748    HG3  GLU  92           HG3      GLU  92  77.102  12.146  -4.111
  749    H    ASP  93           H        ASP  93  79.220   9.199  -7.073
  750    HA   ASP  93           HA       ASP  93  76.942   7.576  -7.301
  751    HB2  ASP  93           HB2      ASP  93  79.388   7.713  -9.085
  752    HB3  ASP  93           HB1      ASP  93  77.860   6.951  -9.524
  753    H    LEU  94           H        LEU  94  80.386   6.651  -7.286
  754    HA   LEU  94           HA       LEU  94  80.097   3.889  -7.398
  755    HB2  LEU  94           HB2      LEU  94  82.286   4.954  -7.560
  756    HB3  LEU  94           HB3      LEU  94  82.150   5.528  -5.900
  757    HG   LEU  94           HG       LEU  94  82.153   3.250  -5.056
  758   HD11  LEU  94          HD11      LEU  94  81.041   1.946  -6.638
  759   HD12  LEU  94          HD12      LEU  94  82.716   1.454  -6.877
  760   HD13  LEU  94          HD13      LEU  94  81.970   2.606  -7.983
  761   HD21  LEU  94          HD21      LEU  94  84.424   2.719  -5.502
  762   HD22  LEU  94          HD22      LEU  94  84.322   4.466  -5.697
  763   HD23  LEU  94          HD23      LEU  94  84.356   3.420  -7.117
  764    H    ILE  95           H        ILE  95  79.865   6.092  -4.667
  765    HA   ILE  95           HA       ILE  95  79.663   3.998  -2.733
  766    HB   ILE  95           HB       ILE  95  79.336   6.976  -2.640
  767   HG12  ILE  95          HG12      ILE  95  81.105   5.379  -0.840
  768   HG13  ILE  95          HG13      ILE  95  81.531   5.402  -2.544
  769   HG21  ILE  95          HG21      ILE  95  77.714   6.477  -1.043
  770   HG22  ILE  95          HG22      ILE  95  79.168   6.423  -0.046
  771   HG23  ILE  95          HG23      ILE  95  78.447   4.927  -0.636
  772   HD11  ILE  95          HD11      ILE  95  82.310   7.302  -0.749
  773   HD12  ILE  95          HD12      ILE  95  80.858   8.047  -1.407
  774   HD13  ILE  95          HD13      ILE  95  82.174   7.578  -2.481
  775    H    ALA  96           H        ALA  96  77.459   5.789  -4.722
  776    HA   ALA  96           HA       ALA  96  75.078   5.239  -3.266
  777    HB1  ALA  96           HB1      ALA  96  75.379   5.657  -6.249
  778    HB2  ALA  96           HB2      ALA  96  75.284   6.966  -5.070
  779    HB3  ALA  96           HB3      ALA  96  73.914   5.876  -5.291
  780    H    TYR  97           H        TYR  97  76.980   3.509  -5.651
  781    HA   TYR  97           HA       TYR  97  75.039   1.407  -6.022
  782    HB2  TYR  97           HB2      TYR  97  76.529   1.820  -7.855
  783    HB3  TYR  97           HB3      TYR  97  77.945   1.688  -6.813
  784    HD1  TYR  97           HD1      TYR  97  75.108  -0.222  -8.282
  785    HD2  TYR  97           HD2      TYR  97  78.896  -0.436  -6.271
  786    HE1  TYR  97           HE1      TYR  97  75.189  -2.665  -8.694
  787    HE2  TYR  97           HE2      TYR  97  78.976  -2.880  -6.682
  788    HH   TYR  97           HH       TYR  97  77.045  -4.737  -7.100
  789    H    LEU  98           H        LEU  98  78.044   1.864  -4.182
  790    HA   LEU  98           HA       LEU  98  78.285  -0.740  -3.166
  791    HB2  LEU  98           HB2      LEU  98  79.190   1.959  -2.205
  792    HB3  LEU  98           HB3      LEU  98  79.444   0.536  -1.202
  793    HG   LEU  98           HG       LEU  98  80.270   0.466  -4.097
  794   HD11  LEU  98          HD11      LEU  98  82.445   1.353  -3.567
  795   HD12  LEU  98          HD12      LEU  98  82.029   1.492  -1.859
  796   HD13  LEU  98          HD13      LEU  98  81.252   2.537  -3.046
  797   HD21  LEU  98          HD21      LEU  98  81.821  -1.190  -3.291
  798   HD22  LEU  98          HD22      LEU  98  80.258  -1.557  -2.563
  799   HD23  LEU  98          HD23      LEU  98  81.503  -0.746  -1.614
  800    H    LYS  99           H        LYS  99  76.096   1.827  -2.408
  801    HA   LYS  99           HA       LYS  99  75.353   0.811   0.196
  802    HB2  LYS  99           HB2      LYS  99  74.375   3.013  -1.594
  803    HB3  LYS  99           HB3      LYS  99  73.386   2.488  -0.233
  804    HG2  LYS  99           HG2      LYS  99  75.428   2.808   1.243
  805    HG3  LYS  99           HG3      LYS  99  76.214   3.574  -0.139
  806    HD2  LYS  99           HD2      LYS  99  73.538   4.483   0.954
  807    HD3  LYS  99           HD3      LYS  99  75.076   5.171   1.477
  808    HE2  LYS  99           HE2      LYS  99  75.550   5.593  -1.011
  809    HE3  LYS  99           HE3      LYS  99  73.842   5.247  -1.281
  810    HZ1  LYS  99           HZ1      LYS  99  73.886   7.522  -0.974
  811    HZ2  LYS  99           HZ2      LYS  99  75.065   7.451   0.247
  812    HZ3  LYS  99           HZ3      LYS  99  73.472   6.957   0.571
  813    H    LYS 100           H        LYS 100  73.767   0.987  -2.995
  814    HA   LYS 100           HA       LYS 100  71.559  -0.659  -2.163
  815    HB2  LYS 100           HB2      LYS 100  72.505   0.368  -4.838
  816    HB3  LYS 100           HB3      LYS 100  71.110  -0.700  -4.680
  817    HG2  LYS 100           HG2      LYS 100  69.888   0.882  -3.424
  818    HG3  LYS 100           HG3      LYS 100  71.330   1.816  -3.031
  819    HD2  LYS 100           HD2      LYS 100  71.540   2.581  -5.317
  820    HD3  LYS 100           HD3      LYS 100  70.242   1.509  -5.843
  821    HE2  LYS 100           HE2      LYS 100  69.821   3.651  -3.749
  822    HE3  LYS 100           HE3      LYS 100  69.593   3.956  -5.470
  823    HZ1  LYS 100           HZ1      LYS 100  68.299   1.605  -4.303
  824    HZ2  LYS 100           HZ2      LYS 100  67.782   2.609  -5.572
  825    HZ3  LYS 100           HZ3      LYS 100  67.633   3.127  -3.961
  826    H    ALA 101           H        ALA 101  74.739  -1.241  -3.262
  827    HA   ALA 101           HA       ALA 101  74.190  -3.900  -4.309
  828    HB1  ALA 101           HB1      ALA 101  76.654  -4.000  -4.601
  829    HB2  ALA 101           HB2      ALA 101  76.786  -2.419  -3.832
  830    HB3  ALA 101           HB3      ALA 101  75.941  -2.582  -5.371
  831    H    THR 102           H        THR 102  75.388  -2.389  -1.381
  832    HA   THR 102           HA       THR 102  76.126  -4.974  -0.219
  833    HB   THR 102           HB       THR 102  76.867  -3.615   1.712
  834    HG1  THR 102           HG1      THR 102  75.564  -1.650   0.211
  835   HG21  THR 102          HG21      THR 102  78.584  -3.918   0.145
  836   HG22  THR 102          HG22      THR 102  78.535  -2.165   0.330
  837   HG23  THR 102          HG23      THR 102  77.781  -2.927  -1.071
  838    H    ASN 103           H        ASN 103  73.389  -3.153  -0.616
  839    HA   ASN 103           HA       ASN 103  72.176  -3.858   1.961
  840    HB2  ASN 103           HB2      ASN 103  71.364  -2.106  -0.349
  841    HB3  ASN 103           HB1      ASN 103  70.205  -2.588   0.884
  842   HD21  ASN 103          HD21      ASN 103  73.622  -2.048   1.632
  843   HD22  ASN 103          HD22      ASN 103  73.368  -0.650   2.559
  844    H    GLU 104           H        GLU 104  72.251  -4.825  -1.366
  845    HA   GLU 104           HA       GLU 104  69.868  -6.514  -1.073
  846    HB2  GLU 104           HB2      GLU 104  70.040  -6.889  -3.444
  847    HB3  GLU 104           HB3      GLU 104  70.248  -5.162  -3.155
  848    HG2  GLU 104           HG2      GLU 104  72.770  -5.636  -3.098
  849    HG3  GLU 104           HG3      GLU 104  72.376  -7.213  -3.780
  850    HHA  HEC 201           HA       HEC 105  89.440  -3.551   3.157
  851    HHB  HEC 201           HB       HEC 105  85.613  -0.029  -0.435
  852    HHC  HEC 201           HC       HEC 105  88.843  -1.793  -5.582
  853    HHD  HEC 201           HD       HEC 105  92.274  -5.762  -2.044
  854   HMA1  HEC 201          HMA1      HEC 105  85.261  -0.466   3.295
  855   HMA2  HEC 201          HMA2      HEC 105  84.666  -0.346   1.642
  856   HMA3  HEC 201          HMA3      HEC 105  85.826   0.836   2.247
  857   HAA1  HEC 201          HAA1      HEC 105  87.126  -0.920   4.466
  858   HAA2  HEC 201          HAA2      HEC 105  88.505  -1.997   4.413
  859   HBA1  HEC 201          HBA1      HEC 105  87.224  -3.885   4.718
  860   HBA2  HEC 201          HBA2      HEC 105  85.807  -3.184   3.947
  861   HMB1  HEC 201          HMB1      HEC 105  85.149   1.455  -2.240
  862   HMB2  HEC 201          HMB2      HEC 105  84.158   0.080  -2.719
  863   HMB3  HEC 201          HMB3      HEC 105  84.846   1.138  -3.945
  864    HAB  HEC 201           HAB      HEC 105  87.291  -0.650  -6.228
  865   HBB1  HEC 201          HBB1      HEC 105  87.873   1.588  -6.070
  866   HBB2  HEC 201          HBB2      HEC 105  86.185   1.740  -6.554
  867   HBB3  HEC 201          HBB3      HEC 105  86.640   1.938  -4.862
  868   HMC1  HEC 201          HMC1      HEC 105  91.237  -4.341  -6.967
  869   HMC2  HEC 201          HMC2      HEC 105  91.409  -2.607  -6.705
  870   HMC3  HEC 201          HMC3      HEC 105  89.811  -3.313  -6.925
  871    HAC  HEC 201           HAC      HEC 105  92.720  -6.168  -3.967
  872   HBC1  HEC 201          HBC1      HEC 105  93.654  -5.652  -6.491
  873   HBC2  HEC 201          HBC2      HEC 105  94.386  -5.022  -5.017
  874   HBC3  HEC 201          HBC3      HEC 105  93.258  -4.027  -5.935
  875   HMD1  HEC 201          HMD1      HEC 105  92.370  -7.508   0.255
  876   HMD2  HEC 201          HMD2      HEC 105  93.295  -6.634   1.473
  877   HMD3  HEC 201          HMD3      HEC 105  93.536  -6.278  -0.234
  878   HAD1  HEC 201          HAD1      HEC 105  91.932  -6.385   3.108
  879   HAD2  HEC 201          HAD2      HEC 105  90.450  -5.597   3.608
  880   HBD1  HEC 201          HBD1      HEC 105  91.855  -3.421   3.647
  881   HBD2  HEC 201          HBD2      HEC 105  93.250  -4.498   3.620
  882    H1   HOH 301           H2       HOH 200  81.622   3.338  -1.082
  883    H2   HOH 301           H1       HOH 200  80.785   2.310  -0.345
  884    H1   HOH 302           H2       HOH 201  85.825   4.449   5.999
  885    H2   HOH 302           H1       HOH 201  85.038   5.144   7.090
  886    H1   HOH 303           H2       HOH 202  81.531  -5.938   6.211
  887    H2   HOH 303           H1       HOH 202  82.971  -5.474   6.171
  888    H1   HOH 304           H2       HOH 203  81.218  -9.380  -0.319
  889    H2   HOH 304           H1       HOH 203  81.995 -10.678  -0.250
  Start of MODEL    2
    1    H1   GLY   1           H1       GLY   1  75.754  11.244  -7.094
    2    H2   GLY   1           H2       GLY   1  75.666  10.246  -8.466
    3    H3   GLY   1           H3       GLY   1  76.486   9.714  -7.076
    4    HA2  GLY   1           HA2      GLY   1  74.637   8.994  -6.093
    5    HA3  GLY   1           HA3      GLY   1  73.756  10.449  -6.562
    6    H    ASP   2           H        ASP   2  75.491   8.397  -8.821
    7    HA   ASP   2           HA       ASP   2  72.904   7.634 -10.051
    8    HB2  ASP   2           HB2      ASP   2  75.603   7.935 -11.382
    9    HB3  ASP   2           HB1      ASP   2  74.077   7.555 -12.178
   10    H    VAL   3           H        VAL   3  72.693   5.743  -8.816
   11    HA   VAL   3           HA       VAL   3  74.493   3.753  -8.296
   12    HB   VAL   3           HB       VAL   3  72.152   3.700  -7.552
   13   HG11  VAL   3          HG11      VAL   3  71.520   2.943 -10.420
   14   HG12  VAL   3          HG12      VAL   3  71.198   4.526  -9.712
   15   HG13  VAL   3          HG13      VAL   3  70.366   3.099  -9.095
   16   HG21  VAL   3          HG21      VAL   3  72.799   1.279  -9.264
   17   HG22  VAL   3          HG22      VAL   3  71.779   1.314  -7.826
   18   HG23  VAL   3          HG23      VAL   3  73.513   1.592  -7.683
   19    H    GLU   4           H        GLU   4  73.336   4.789 -11.368
   20    HA   GLU   4           HA       GLU   4  73.844   2.364 -12.811
   21    HB2  GLU   4           HB2      GLU   4  73.460   5.235 -13.657
   22    HB3  GLU   4           HB3      GLU   4  73.775   3.940 -14.813
   23    HG2  GLU   4           HG2      GLU   4  71.551   3.753 -12.778
   24    HG3  GLU   4           HG3      GLU   4  71.309   4.506 -14.354
   25    H    LYS   5           H        LYS   5  75.580   5.494 -12.774
   26    HA   LYS   5           HA       LYS   5  77.870   4.396 -14.097
   27    HB2  LYS   5           HB2      LYS   5  77.354   6.994 -12.645
   28    HB3  LYS   5           HB3      LYS   5  78.934   6.596 -13.320
   29    HG2  LYS   5           HG2      LYS   5  77.932   6.303 -15.545
   30    HG3  LYS   5           HG3      LYS   5  76.336   6.661 -14.886
   31    HD2  LYS   5           HD2      LYS   5  78.579   8.631 -14.500
   32    HD3  LYS   5           HD3      LYS   5  77.719   8.579 -16.038
   33    HE2  LYS   5           HE2      LYS   5  75.565   8.844 -14.799
   34    HE3  LYS   5           HE3      LYS   5  76.482   9.017 -13.303
   35    HZ1  LYS   5           HZ1      LYS   5  76.317  11.185 -13.887
   36    HZ2  LYS   5           HZ2      LYS   5  76.220  10.861 -15.552
   37    HZ3  LYS   5           HZ3      LYS   5  77.722  10.810 -14.759
   38    H    GLY   6           H        GLY   6  76.756   4.478 -10.860
   39    HA2  GLY   6           HA2      GLY   6  79.289   4.250  -9.544
   40    HA3  GLY   6           HA3      GLY   6  77.716   3.836  -8.855
   41    H    LYS   7           H        LYS   7  76.944   2.058 -10.952
   42    HA   LYS   7           HA       LYS   7  78.103  -0.368 -10.009
   43    HB2  LYS   7           HB2      LYS   7  75.759  -0.115 -10.893
   44    HB3  LYS   7           HB3      LYS   7  76.447   0.046 -12.509
   45    HG2  LYS   7           HG2      LYS   7  77.667  -2.189 -11.972
   46    HG3  LYS   7           HG3      LYS   7  76.484  -2.351 -10.679
   47    HD2  LYS   7           HD2      LYS   7  75.367  -3.430 -12.408
   48    HD3  LYS   7           HD3      LYS   7  74.760  -1.787 -12.612
   49    HE2  LYS   7           HE2      LYS   7  75.424  -2.373 -14.790
   50    HE3  LYS   7           HE3      LYS   7  76.817  -1.475 -14.189
   51    HZ1  LYS   7           HZ1      LYS   7  77.829  -3.340 -14.978
   52    HZ2  LYS   7           HZ2      LYS   7  76.509  -4.354 -14.637
   53    HZ3  LYS   7           HZ3      LYS   7  77.535  -3.839 -13.384
   54    H    LYS   8           H        LYS   8  78.432   1.545 -12.994
   55    HA   LYS   8           HA       LYS   8  80.107  -0.226 -14.396
   56    HB2  LYS   8           HB2      LYS   8  79.063   1.678 -15.489
   57    HB3  LYS   8           HB3      LYS   8  79.979   2.797 -14.481
   58    HG2  LYS   8           HG2      LYS   8  81.639   0.812 -15.921
   59    HG3  LYS   8           HG3      LYS   8  80.782   1.939 -16.969
   60    HD2  LYS   8           HD2      LYS   8  82.287   2.969 -14.569
   61    HD3  LYS   8           HD3      LYS   8  83.148   2.600 -16.062
   62    HE2  LYS   8           HE2      LYS   8  81.956   4.222 -17.295
   63    HE3  LYS   8           HE3      LYS   8  80.676   4.329 -16.086
   64    HZ1  LYS   8           HZ1      LYS   8  83.361   4.968 -15.175
   65    HZ2  LYS   8           HZ2      LYS   8  81.878   5.707 -14.799
   66    HZ3  LYS   8           HZ3      LYS   8  82.667   6.072 -16.259
   67    H    ILE   9           H        ILE   9  80.925   2.495 -12.254
   68    HA   ILE   9           HA       ILE   9  83.735   2.194 -12.449
   69    HB   ILE   9           HB       ILE   9  82.052   3.420 -10.256
   70   HG12  ILE   9          HG12      ILE   9  83.540   4.821 -12.486
   71   HG13  ILE   9          HG13      ILE   9  81.859   4.316 -12.661
   72   HG21  ILE   9          HG21      ILE   9  85.006   3.559 -10.903
   73   HG22  ILE   9          HG22      ILE   9  84.261   3.000  -9.405
   74   HG23  ILE   9          HG23      ILE   9  84.196   4.708  -9.839
   75   HD11  ILE   9          HD11      ILE   9  81.158   5.704 -10.836
   76   HD12  ILE   9          HD12      ILE   9  82.196   6.706 -11.851
   77   HD13  ILE   9          HD13      ILE   9  82.824   6.019 -10.353
   78    H    PHE  10           H        PHE  10  81.318   0.516 -10.635
   79    HA   PHE  10           HA       PHE  10  83.145  -0.488  -8.631
   80    HB2  PHE  10           HB2      PHE  10  80.994  -0.347  -7.778
   81    HB3  PHE  10           HB1      PHE  10  80.250  -0.894  -9.280
   82    HD1  PHE  10           HD1      PHE  10  80.215  -3.274  -9.881
   83    HD2  PHE  10           HD2      PHE  10  81.900  -1.933  -6.170
   84    HE1  PHE  10           HE1      PHE  10  80.213  -5.606  -9.045
   85    HE2  PHE  10           HE2      PHE  10  81.899  -4.268  -5.328
   86    HZ   PHE  10           HZ       PHE  10  81.057  -6.105  -6.771
   87    H    VAL  11           H        VAL  11  81.344  -1.989 -11.337
   88    HA   VAL  11           HA       VAL  11  82.349  -4.568 -11.082
   89    HB   VAL  11           HB       VAL  11  81.827  -4.839 -13.491
   90   HG11  VAL  11          HG11      VAL  11  79.711  -3.181 -12.120
   91   HG12  VAL  11          HG12      VAL  11  80.093  -4.825 -11.615
   92   HG13  VAL  11          HG13      VAL  11  79.480  -4.520 -13.240
   93   HG21  VAL  11          HG21      VAL  11  81.279  -1.863 -13.330
   94   HG22  VAL  11          HG22      VAL  11  80.927  -2.893 -14.715
   95   HG23  VAL  11          HG23      VAL  11  82.598  -2.608 -14.229
   96    H    GLN  12           H        GLN  12  83.810  -1.733 -12.518
   97    HA   GLN  12           HA       GLN  12  86.016  -3.347 -13.585
   98    HB2  GLN  12           HB2      GLN  12  86.709  -1.360 -14.729
   99    HB3  GLN  12           HB1      GLN  12  84.967  -1.537 -14.938
  100    HG2  GLN  12           HG2      GLN  12  84.681   0.004 -12.936
  101    HG3  GLN  12           HG1      GLN  12  86.414   0.325 -13.041
  102   HE21  GLN  12          HE21      GLN  12  85.668  -0.222 -16.167
  103   HE22  GLN  12          HE22      GLN  12  85.253   1.344 -16.663
  104    H    LYS  13           H        LYS  13  85.355  -1.188 -10.902
  105    HA   LYS  13           HA       LYS  13  88.238  -0.997 -10.349
  106    HB2  LYS  13           HB2      LYS  13  86.635   1.020 -10.375
  107    HB3  LYS  13           HB3      LYS  13  86.117   0.443  -8.791
  108    HG2  LYS  13           HG2      LYS  13  88.333   0.651  -7.898
  109    HG3  LYS  13           HG3      LYS  13  89.025   0.912  -9.496
  110    HD2  LYS  13           HD2      LYS  13  86.898   2.802  -8.556
  111    HD3  LYS  13           HD3      LYS  13  88.519   2.966  -7.881
  112    HE2  LYS  13           HE2      LYS  13  89.457   3.122 -10.156
  113    HE3  LYS  13           HE3      LYS  13  87.840   2.951 -10.838
  114    HZ1  LYS  13           HZ1      LYS  13  87.187   4.965  -9.642
  115    HZ2  LYS  13           HZ2      LYS  13  88.457   5.263 -10.730
  116    HZ3  LYS  13           HZ3      LYS  13  88.771   5.142  -9.065
  117    H    CYS  14           H        CYS  14  85.339  -1.464  -8.257
  118    HA   CYS  14           HA       CYS  14  87.031  -2.689  -6.254
  119    HB2  CYS  14           HB2      CYS  14  84.054  -2.591  -6.049
  120    HB3  CYS  14           HB1      CYS  14  85.258  -2.457  -4.774
  121    H    ALA  15           H        ALA  15  84.551  -3.895  -8.476
  122    HA   ALA  15           HA       ALA  15  84.022  -6.356  -7.371
  123    HB1  ALA  15           HB1      ALA  15  83.971  -7.147  -9.860
  124    HB2  ALA  15           HB2      ALA  15  84.283  -5.449 -10.216
  125    HB3  ALA  15           HB3      ALA  15  82.835  -5.909  -9.323
  126    H    GLN  16           H        GLN  16  86.985  -5.260  -8.824
  127    HA   GLN  16           HA       GLN  16  88.279  -7.546  -9.580
  128    HB2  GLN  16           HB2      GLN  16  89.304  -5.111  -8.139
  129    HB3  GLN  16           HB1      GLN  16  90.383  -6.403  -8.664
  130    HG2  GLN  16           HG2      GLN  16  89.522  -6.146 -10.982
  131    HG3  GLN  16           HG1      GLN  16  88.516  -4.804 -10.440
  132   HE21  GLN  16          HE21      GLN  16  91.598  -5.591 -11.680
  133   HE22  GLN  16          HE22      GLN  16  92.369  -4.117 -11.338
  134    H    CYS  17           H        CYS  17  88.517  -6.214  -6.248
  135    HA   CYS  17           HA       CYS  17  88.921  -8.996  -5.307
  136    HB2  CYS  17           HB2      CYS  17  90.092  -6.846  -3.653
  137    HB3  CYS  17           HB1      CYS  17  90.758  -8.410  -4.108
  138    H    HIS  18           H        HSD  18  86.340  -8.120  -5.358
  139    HA   HIS  18           HA       HSD  18  85.704  -8.100  -2.529
  140    HB2  HIS  18           HB2      HSD  18  85.121  -5.727  -4.286
  141    HB3  HIS  18           HB1      HSD  18  84.115  -6.098  -2.887
  142    HD1  HIS  18           HD1      HSD  18  86.552  -7.169  -1.097
  143    HD2  HIS  18           HD2      HSD  18  86.395  -3.513  -3.091
  144    HE1  HIS  18           HE1      HSD  18  88.175  -5.630   0.096
  145    H    THR  19           H        THR  19  83.152  -7.797  -2.359
  146    HA   THR  19           HA       THR  19  81.850  -9.288  -4.545
  147    HB   THR  19           HB       THR  19  81.144  -9.945  -1.714
  148    HG1  THR  19           HG1      THR  19  83.183 -11.370  -2.989
  149   HG21  THR  19          HG21      THR  19  80.105 -10.798  -3.980
  150   HG22  THR  19          HG22      THR  19  80.361 -11.922  -2.646
  151   HG23  THR  19          HG23      THR  19  81.508 -11.865  -3.984
  152    H    VAL  20           H        VAL  20  81.537  -7.272  -1.676
  153    HA   VAL  20           HA       VAL  20  79.844  -5.930  -0.897
  154    HB   VAL  20           HB       VAL  20  79.144  -4.240  -2.475
  155   HG11  VAL  20          HG11      VAL  20  81.522  -4.314  -1.651
  156   HG12  VAL  20          HG12      VAL  20  81.323  -3.485  -3.192
  157   HG13  VAL  20          HG13      VAL  20  81.961  -5.128  -3.151
  158   HG21  VAL  20          HG21      VAL  20  80.396  -5.907  -4.658
  159   HG22  VAL  20          HG22      VAL  20  79.432  -4.445  -4.831
  160   HG23  VAL  20          HG23      VAL  20  78.668  -5.947  -4.323
  161    H    GLU  21           H        GLU  21  78.915  -8.621  -1.456
  162    HA   GLU  21           HA       GLU  21  76.074  -7.960  -1.909
  163    HB2  GLU  21           HB2      GLU  21  75.705  -9.786  -3.343
  164    HB3  GLU  21           HB3      GLU  21  77.209  -9.082  -3.933
  165    HG2  GLU  21           HG2      GLU  21  78.404 -10.747  -2.392
  166    HG3  GLU  21           HG3      GLU  21  76.847 -11.562  -2.251
  167    H    LYS  22           H        LYS  22  74.919  -8.500  -0.203
  168    HA   LYS  22           HA       LYS  22  75.869  -9.793   2.061
  169    HB2  LYS  22           HB2      LYS  22  73.825  -8.392   1.979
  170    HB3  LYS  22           HB3      LYS  22  72.998  -9.681   1.107
  171    HG2  LYS  22           HG2      LYS  22  74.328 -10.536   3.617
  172    HG3  LYS  22           HG3      LYS  22  72.980  -9.422   3.836
  173    HD2  LYS  22           HD2      LYS  22  71.561 -10.913   2.426
  174    HD3  LYS  22           HD3      LYS  22  72.903 -12.053   2.328
  175    HE2  LYS  22           HE2      LYS  22  71.738 -11.104   4.954
  176    HE3  LYS  22           HE3      LYS  22  71.194 -12.566   4.132
  177    HZ1  LYS  22           HZ1      LYS  22  73.026 -13.667   4.718
  178    HZ2  LYS  22           HZ2      LYS  22  73.250 -12.440   5.872
  179    HZ3  LYS  22           HZ3      LYS  22  74.053 -12.361   4.377
  180    H    GLY  23           H        GLY  23  76.035 -11.859   2.724
  181    HA2  GLY  23           HA2      GLY  23  75.977 -14.160   2.697
  182    HA3  GLY  23           HA3      GLY  23  74.559 -14.038   1.661
  183    H    GLY  24           H        GLY  24  77.599 -12.555   0.772
  184    HA2  GLY  24           HA2      GLY  24  77.747 -14.321  -1.564
  185    HA3  GLY  24           HA3      GLY  24  78.592 -12.792  -1.359
  186    H    LYS  25           H        LYS  25  80.584 -13.681  -1.911
  187    HA   LYS  25           HA       LYS  25  81.857 -15.243   0.240
  188    HB2  LYS  25           HB2      LYS  25  82.500 -15.811  -2.649
  189    HB3  LYS  25           HB3      LYS  25  82.848 -16.790  -1.226
  190    HG2  LYS  25           HG2      LYS  25  81.030 -17.960  -2.028
  191    HG3  LYS  25           HG3      LYS  25  80.175 -16.786  -1.031
  192    HD2  LYS  25           HD2      LYS  25  80.138 -15.305  -3.160
  193    HD3  LYS  25           HD3      LYS  25  80.560 -16.782  -4.025
  194    HE2  LYS  25           HE2      LYS  25  78.171 -16.512  -2.181
  195    HE3  LYS  25           HE3      LYS  25  78.093 -16.370  -3.936
  196    HZ1  LYS  25           HZ1      LYS  25  78.103 -18.562  -4.132
  197    HZ2  LYS  25           HZ2      LYS  25  77.976 -18.687  -2.443
  198    HZ3  LYS  25           HZ3      LYS  25  79.503 -18.708  -3.186
  199    H    HIS  26           H        HIS  26  83.407 -13.947   1.007
  200    HA   HIS  26           HA       HIS  26  84.468 -11.697  -0.242
  201    HB2  HIS  26           HB2      HIS  26  86.495 -12.301   1.398
  202    HB3  HIS  26           HB1      HIS  26  84.957 -11.689   2.004
  203    HD1  HIS  26           HD1      HIS  26  85.970 -15.198   0.880
  204    HD2  HIS  26           HD2      HIS  26  84.376 -13.249   4.204
  205    HE1  HIS  26           HE1      HIS  26  85.441 -16.998   2.581
  206    HE2  HIS  26           HE2      HIS  26  84.470 -15.826   4.613
  207    H    LYS  27           H        LYS  27  85.669 -11.517  -2.001
  208    HA   LYS  27           HA       LYS  27  87.430 -13.765  -2.783
  209    HB2  LYS  27           HB2      LYS  27  86.003 -11.644  -4.384
  210    HB3  LYS  27           HB3      LYS  27  87.342 -12.573  -5.058
  211    HG2  LYS  27           HG2      LYS  27  86.127 -14.676  -4.495
  212    HG3  LYS  27           HG3      LYS  27  84.767 -13.711  -3.927
  213    HD2  LYS  27           HD2      LYS  27  85.832 -13.225  -6.694
  214    HD3  LYS  27           HD3      LYS  27  84.803 -14.627  -6.409
  215    HE2  LYS  27           HE2      LYS  27  83.993 -11.872  -5.475
  216    HE3  LYS  27           HE3      LYS  27  83.636 -12.434  -7.108
  217    HZ1  LYS  27           HZ1      LYS  27  82.811 -13.751  -4.578
  218    HZ2  LYS  27           HZ2      LYS  27  82.522 -14.366  -6.135
  219    HZ3  LYS  27           HZ3      LYS  27  81.799 -12.908  -5.646
  220    H    THR  28           H        THR  28  89.531 -13.457  -2.472
  221    HA   THR  28           HA       THR  28  91.485 -12.356  -1.871
  222    HB   THR  28           HB       THR  28  90.696 -10.736  -4.304
  223    HG1  THR  28           HG1      THR  28  91.087 -13.332  -4.028
  224   HG21  THR  28          HG21      THR  28  93.423 -11.232  -4.352
  225   HG22  THR  28          HG22      THR  28  93.113 -10.922  -2.645
  226   HG23  THR  28          HG23      THR  28  92.672  -9.717  -3.854
  227    H    GLY  29           H        GLY  29  88.994 -11.275  -0.686
  228    HA2  GLY  29           HA2      GLY  29  90.003  -9.117   0.734
  229    HA3  GLY  29           HA3      GLY  29  89.103  -8.433  -0.617
  230    HA   PRO  30           HA       PRO  30  86.305  -9.998   2.962
  231    HB2  PRO  30           HB2      PRO  30  85.910  -7.652   4.331
  232    HB3  PRO  30           HB1      PRO  30  87.179  -8.823   4.741
  233    HG2  PRO  30           HG2      PRO  30  87.378  -6.281   3.196
  234    HG3  PRO  30           HG1      PRO  30  88.487  -6.960   4.400
  235    HD2  PRO  30           HD2      PRO  30  88.955  -7.133   1.715
  236    HD3  PRO  30           HD1      PRO  30  89.507  -8.370   2.868
  237    H    ASN  31           H        ASN  31  84.060  -9.044   3.478
  238    HA   ASN  31           HA       ASN  31  82.923  -8.007   0.977
  239    HB2  ASN  31           HB2      ASN  31  80.762  -8.642   1.991
  240    HB3  ASN  31           HB1      ASN  31  81.885  -9.999   1.960
  241   HD21  ASN  31          HD21      ASN  31  81.060  -7.276   4.197
  242   HD22  ASN  31          HD22      ASN  31  81.141  -8.227   5.600
  243    H    LEU  32           H        LEU  32  81.107  -6.404   1.225
  244    HA   LEU  32           HA       LEU  32  81.748  -4.412   3.325
  245    HB2  LEU  32           HB2      LEU  32  80.636  -3.722   0.608
  246    HB3  LEU  32           HB3      LEU  32  81.347  -2.640   1.798
  247    HG   LEU  32           HG       LEU  32  82.795  -4.757   0.181
  248   HD11  LEU  32          HD11      LEU  32  82.064  -2.326  -0.670
  249   HD12  LEU  32          HD12      LEU  32  83.629  -3.016  -1.096
  250   HD13  LEU  32          HD13      LEU  32  83.509  -1.849   0.220
  251   HD21  LEU  32          HD21      LEU  32  83.547  -3.235   2.632
  252   HD22  LEU  32          HD22      LEU  32  84.768  -3.341   1.369
  253   HD23  LEU  32          HD23      LEU  32  84.103  -4.809   2.074
  254    H    HIS  33           H        HIS  33  79.822  -6.521   3.574
  255    HA   HIS  33           HA       HIS  33  77.186  -5.673   2.977
  256    HB2  HIS  33           HB2      HIS  33  78.045  -7.421   5.293
  257    HB3  HIS  33           HB1      HIS  33  76.462  -7.381   4.517
  258    HD1  HIS  33           HD1      HIS  33  78.583  -9.854   4.667
  259    HD2  HIS  33           HD2      HIS  33  77.718  -7.468   1.360
  260    HE1  HIS  33           HE1      HIS  33  79.209 -11.210   2.622
  261    HE2  HIS  33           HE2      HIS  33  78.689  -9.768   0.597
  262    H    GLY  34           H        GLY  34  75.725  -4.438   4.106
  263    HA2  GLY  34           HA2      GLY  34  75.201  -2.569   5.406
  264    HA3  GLY  34           HA3      GLY  34  75.541  -3.716   6.700
  265    H    LEU  35           H        LEU  35  78.002  -2.717   4.472
  266    HA   LEU  35           HA       LEU  35  79.990  -2.121   6.225
  267    HB2  LEU  35           HB2      LEU  35  80.373  -2.206   3.843
  268    HB3  LEU  35           HB3      LEU  35  79.342  -0.804   3.581
  269    HG   LEU  35           HG       LEU  35  81.073   0.341   5.265
  270   HD11  LEU  35          HD11      LEU  35  83.237  -0.550   5.250
  271   HD12  LEU  35          HD12      LEU  35  82.918  -1.549   3.837
  272   HD13  LEU  35          HD13      LEU  35  82.241  -1.997   5.400
  273   HD21  LEU  35          HD21      LEU  35  80.578   0.943   2.865
  274   HD22  LEU  35          HD22      LEU  35  81.828  -0.203   2.384
  275   HD23  LEU  35          HD23      LEU  35  82.253   1.212   3.348
  276    H    PHE  36           H        PHE  36  77.847   0.328   4.792
  277    HA   PHE  36           HA       PHE  36  78.737   2.514   6.260
  278    HB2  PHE  36           HB2      PHE  36  75.880   2.093   5.368
  279    HB3  PHE  36           HB1      PHE  36  76.724   3.625   5.592
  280    HD1  PHE  36           HD2      PHE  36  76.637   0.518   3.534
  281    HD2  PHE  36           HD1      PHE  36  78.104   4.545   3.867
  282    HE1  PHE  36           HE2      PHE  36  77.454   0.417   1.199
  283    HE2  PHE  36           HE1      PHE  36  78.912   4.443   1.533
  284    HZ   PHE  36           HZ       PHE  36  78.589   2.380   0.194
  285    H    GLY  37           H        GLY  37  79.081   1.965   8.452
  286    HA2  GLY  37           HA2      GLY  37  77.562   2.747  10.417
  287    HA3  GLY  37           HA3      GLY  37  76.686   1.278  10.025
  288    H    ARG  38           H        ARG  38  79.402  -0.020   9.356
  289    HA   ARG  38           HA       ARG  38  79.895  -0.885  12.112
  290    HB2  ARG  38           HB2      ARG  38  80.237  -2.057   9.434
  291    HB3  ARG  38           HB3      ARG  38  81.540  -2.428  10.561
  292    HG2  ARG  38           HG2      ARG  38  79.746  -3.098  12.238
  293    HG3  ARG  38           HG3      ARG  38  78.584  -2.980  10.916
  294    HD2  ARG  38           HD2      ARG  38  81.061  -4.599  10.469
  295    HD3  ARG  38           HD3      ARG  38  79.800  -5.283  11.487
  296    HE   ARG  38           HE       ARG  38  78.338  -4.584   9.393
  297   HH11  ARG  38          HH21      ARG  38  81.508  -6.003   9.499
  298   HH12  ARG  38          HH22      ARG  38  81.325  -6.836   7.993
  299   HH21  ARG  38          HH11      ARG  38  78.104  -5.695   7.433
  300   HH22  ARG  38          HH12      ARG  38  79.405  -6.669   6.831
  301    H    LYS  39           H        LYS  39  81.963  -1.077  13.023
  302    HA   LYS  39           HA       LYS  39  83.688   1.167  12.533
  303    HB2  LYS  39           HB2      LYS  39  83.147   0.208  14.795
  304    HB3  LYS  39           HB3      LYS  39  84.146  -1.181  14.377
  305    HG2  LYS  39           HG2      LYS  39  85.685   0.162  15.497
  306    HG3  LYS  39           HG3      LYS  39  85.964   0.649  13.830
  307    HD2  LYS  39           HD2      LYS  39  85.754   2.725  14.861
  308    HD3  LYS  39           HD3      LYS  39  84.090   2.442  14.359
  309    HE2  LYS  39           HE2      LYS  39  83.853   1.292  16.705
  310    HE3  LYS  39           HE3      LYS  39  85.298   2.220  17.103
  311    HZ1  LYS  39           HZ1      LYS  39  83.825   4.088  15.925
  312    HZ2  LYS  39           HZ2      LYS  39  83.789   3.791  17.597
  313    HZ3  LYS  39           HZ3      LYS  39  82.591   3.133  16.589
  314    H    THR  40           H        THR  40  85.888   1.121  11.950
  315    HA   THR  40           HA       THR  40  86.625  -0.365   9.762
  316    HB   THR  40           HB       THR  40  89.001   0.249  10.406
  317    HG1  THR  40           HG1      THR  40  87.915   1.878  12.371
  318   HG21  THR  40          HG21      THR  40  87.518   1.687   9.022
  319   HG22  THR  40          HG22      THR  40  88.619   2.631  10.024
  320   HG23  THR  40          HG23      THR  40  86.928   2.457  10.494
  321    H    GLY  41           H        GLY  41  87.826  -2.175   9.346
  322    HA2  GLY  41           HA2      GLY  41  88.431  -4.372   9.655
  323    HA3  GLY  41           HA3      GLY  41  89.333  -3.736  11.028
  324    H    GLN  42           H        GLN  42  85.856  -4.174  10.368
  325    HA   GLN  42           HA       GLN  42  85.667  -5.659  12.929
  326    HB2  GLN  42           HB2      GLN  42  84.486  -3.557  13.086
  327    HB3  GLN  42           HB1      GLN  42  83.626  -3.882  11.581
  328    HG2  GLN  42           HG2      GLN  42  82.321  -5.579  12.539
  329    HG3  GLN  42           HG1      GLN  42  83.452  -5.834  13.866
  330   HE21  GLN  42          HE21      GLN  42  82.844  -2.505  13.173
  331   HE22  GLN  42          HE22      GLN  42  81.757  -2.219  14.445
  332    H    ALA  43           H        ALA  43  85.109  -5.770   9.527
  333    HA   ALA  43           HA       ALA  43  83.050  -7.705   9.468
  334    HB1  ALA  43           HB1      ALA  43  84.893  -7.966   7.243
  335    HB2  ALA  43           HB2      ALA  43  84.546  -6.272   7.585
  336    HB3  ALA  43           HB3      ALA  43  83.227  -7.392   7.252
  337    HA   PRO  44           HA       PRO  44  85.639 -11.113  10.843
  338    HB2  PRO  44           HB2      PRO  44  83.723 -13.020  10.967
  339    HB3  PRO  44           HB1      PRO  44  83.810 -11.698  12.150
  340    HG2  PRO  44           HG2      PRO  44  82.022 -12.004   9.784
  341    HG3  PRO  44           HG1      PRO  44  81.653 -11.390  11.406
  342    HD2  PRO  44           HD2      PRO  44  82.137  -9.767   9.217
  343    HD3  PRO  44           HD1      PRO  44  82.378  -9.262  10.906
  344    H    GLY  45           H        GLY  45  87.024 -11.932   9.357
  345    HA2  GLY  45           HA2      GLY  45  86.612 -14.109   7.776
  346    HA3  GLY  45           HA3      GLY  45  86.157 -12.767   6.732
  347    H    PHE  46           H        PHE  46  87.758 -11.152   6.236
  348    HA   PHE  46           HA       PHE  46  90.340 -12.269   5.738
  349    HB2  PHE  46           HB2      PHE  46  89.163 -10.572   4.290
  350    HB3  PHE  46           HB1      PHE  46  89.531  -9.364   5.522
  351    HD1  PHE  46           HD2      PHE  46  91.162 -11.975   3.389
  352    HD2  PHE  46           HD1      PHE  46  91.606  -8.260   5.498
  353    HE1  PHE  46           HE2      PHE  46  93.440 -11.713   2.446
  354    HE2  PHE  46           HE1      PHE  46  93.885  -7.997   4.555
  355    HZ   PHE  46           HZ       PHE  46  94.802  -9.724   3.029
  356    H    THR  47           H        THR  47  92.364 -11.555   6.533
  357    HA   THR  47           HA       THR  47  92.346 -10.925   9.351
  358    HB   THR  47           HB       THR  47  94.765 -11.074   7.554
  359    HG1  THR  47           HG1      THR  47  94.600 -13.187   7.569
  360   HG21  THR  47          HG21      THR  47  95.837 -11.842   9.644
  361   HG22  THR  47          HG22      THR  47  94.300 -11.664  10.490
  362   HG23  THR  47          HG23      THR  47  95.119 -10.243   9.840
  363    H    TYR  48           H        TYR  48  91.405  -8.820   9.322
  364    HA   TYR  48           HA       TYR  48  92.335  -6.624   7.866
  365    HB2  TYR  48           HB2      TYR  48  90.861  -6.957  10.447
  366    HB3  TYR  48           HB3      TYR  48  91.447  -5.355  10.010
  367    HD1  TYR  48           HD2      TYR  48  90.798  -4.358   7.800
  368    HD2  TYR  48           HD1      TYR  48  88.969  -7.916   9.354
  369    HE1  TYR  48           HE2      TYR  48  88.905  -4.065   6.233
  370    HE2  TYR  48           HE1      TYR  48  87.073  -7.626   7.785
  371    HH   TYR  48           HH       TYR  48  86.438  -4.788   6.186
  372    H    THR  49           H        THR  49  93.728  -4.926   8.378
  373    HA   THR  49           HA       THR  49  96.101  -5.749   9.827
  374    HB   THR  49           HB       THR  49  97.050  -3.640   9.004
  375    HG1  THR  49           HG1      THR  49  94.542  -2.902   8.999
  376   HG21  THR  49          HG21      THR  49  96.419  -4.048   6.487
  377   HG22  THR  49          HG22      THR  49  95.542  -5.437   7.125
  378   HG23  THR  49          HG23      THR  49  97.282  -5.300   7.379
  379    H    ASP  50           H        ASP  50  97.073  -4.514  11.533
  380    HA   ASP  50           HA       ASP  50  95.504  -3.988  13.720
  381    HB2  ASP  50           HB2      ASP  50  97.998  -2.392  13.168
  382    HB3  ASP  50           HB1      ASP  50  97.383  -2.962  14.718
  383    H    ALA  51           H        ALA  51  96.439  -1.730  11.160
  384    HA   ALA  51           HA       ALA  51  95.490   0.641  12.290
  385    HB1  ALA  51           HB1      ALA  51  96.811   0.523  10.201
  386    HB2  ALA  51           HB2      ALA  51  95.346   1.486  10.009
  387    HB3  ALA  51           HB3      ALA  51  95.410  -0.157   9.373
  388    H    ASN  52           H        ASN  52  93.774  -1.530  10.027
  389    HA   ASN  52           HA       ASN  52  91.278  -0.197  10.279
  390    HB2  ASN  52           HB2      ASN  52  92.227  -2.791   9.144
  391    HB3  ASN  52           HB1      ASN  52  90.503  -2.617   9.452
  392   HD21  ASN  52          HD21      ASN  52  90.165  -2.642   7.076
  393   HD22  ASN  52          HD22      ASN  52  90.476  -1.240   6.167
  394    H    LYS  53           H        LYS  53  92.895  -2.635  12.139
  395    HA   LYS  53           HA       LYS  53  90.514  -3.409  13.612
  396    HB2  LYS  53           HB2      LYS  53  91.844  -5.263  13.595
  397    HB3  LYS  53           HB3      LYS  53  93.315  -4.325  13.377
  398    HG2  LYS  53           HG2      LYS  53  93.366  -3.758  15.745
  399    HG3  LYS  53           HG3      LYS  53  91.806  -4.546  15.997
  400    HD2  LYS  53           HD2      LYS  53  92.897  -6.681  15.124
  401    HD3  LYS  53           HD3      LYS  53  94.440  -5.838  15.267
  402    HE2  LYS  53           HE2      LYS  53  93.827  -5.355  17.684
  403    HE3  LYS  53           HE3      LYS  53  92.474  -6.468  17.481
  404    HZ1  LYS  53           HZ1      LYS  53  93.842  -8.257  17.322
  405    HZ2  LYS  53           HZ2      LYS  53  94.804  -7.284  18.330
  406    HZ3  LYS  53           HZ3      LYS  53  95.132  -7.374  16.665
  407    H    ASN  54           H        ASN  54  92.774  -0.922  13.645
  408    HA   ASN  54           HA       ASN  54  93.077  -0.452  16.423
  409    HB2  ASN  54           HB2      ASN  54  94.153   1.462  15.790
  410    HB3  ASN  54           HB1      ASN  54  94.218   0.612  14.254
  411   HD21  ASN  54          HD21      ASN  54  91.463   0.987  13.465
  412   HD22  ASN  54          HD22      ASN  54  91.225   2.642  13.177
  413    H    LYS  55           H        LYS  55  90.483  -0.052  14.255
  414    HA   LYS  55           HA       LYS  55  88.359   0.829  14.472
  415    HB2  LYS  55           HB2      LYS  55  89.051   0.391  17.384
  416    HB3  LYS  55           HB3      LYS  55  87.445   0.839  16.814
  417    HG2  LYS  55           HG2      LYS  55  87.556  -1.198  15.285
  418    HG3  LYS  55           HG3      LYS  55  88.992  -1.683  16.185
  419    HD2  LYS  55           HD2      LYS  55  87.581  -1.456  18.301
  420    HD3  LYS  55           HD3      LYS  55  86.178  -1.336  17.237
  421    HE2  LYS  55           HE2      LYS  55  86.342  -3.646  17.795
  422    HE3  LYS  55           HE3      LYS  55  86.998  -3.515  16.163
  423    HZ1  LYS  55           HZ1      LYS  55  89.209  -3.136  17.494
  424    HZ2  LYS  55           HZ2      LYS  55  88.640  -4.703  17.164
  425    HZ3  LYS  55           HZ3      LYS  55  88.385  -4.008  18.693
  426    H    GLY  56           H        GLY  56  89.717   2.813  13.696
  427    HA2  GLY  56           HA2      GLY  56  89.837   4.954  15.690
  428    HA3  GLY  56           HA3      GLY  56  90.449   5.029  14.042
  429    H    ILE  57           H        ILE  57  88.017   4.054  12.799
  430    HA   ILE  57           HA       ILE  57  86.003   6.070  13.498
  431    HB   ILE  57           HB       ILE  57  85.876   6.924  11.222
  432   HG12  ILE  57          HG12      ILE  57  88.127   6.192   9.869
  433   HG13  ILE  57          HG13      ILE  57  87.802   4.697  10.743
  434   HG21  ILE  57          HG21      ILE  57  88.751   6.990  12.174
  435   HG22  ILE  57          HG22      ILE  57  87.454   7.936  12.904
  436   HG23  ILE  57          HG23      ILE  57  87.915   8.220  11.226
  437   HD11  ILE  57          HD11      ILE  57  85.619   4.497   9.767
  438   HD12  ILE  57          HD12      ILE  57  86.713   4.895   8.447
  439   HD13  ILE  57          HD13      ILE  57  85.677   6.143   9.136
  440    H    THR  58           H        THR  58  84.171   5.837  11.683
  441    HA   THR  58           HA       THR  58  83.657   2.944  11.342
  442    HB   THR  58           HB       THR  58  81.870   5.137  12.354
  443    HG1  THR  58           HG1      THR  58  82.786   3.861  13.898
  444   HG21  THR  58          HG21      THR  58  80.050   3.269  12.062
  445   HG22  THR  58          HG22      THR  58  81.110   2.696  10.776
  446   HG23  THR  58          HG23      THR  58  80.436   4.322  10.701
  447    H    TRP  59           H        TRP  59  82.806   2.278   9.424
  448    HA   TRP  59           HA       TRP  59  83.189   3.893   7.136
  449    HB2  TRP  59           HB2      TRP  59  81.362   1.499   7.211
  450    HB3  TRP  59           HB1      TRP  59  82.363   2.081   5.880
  451    HD1  TRP  59           HD1      TRP  59  85.104   2.429   7.292
  452    HE1  TRP  59           HE1      TRP  59  86.429   0.373   8.113
  453    HE3  TRP  59           HE3      TRP  59  81.332  -0.990   7.649
  454    HZ2  TRP  59           HZ2      TRP  59  85.943  -2.346   8.859
  455    HZ3  TRP  59           HZ3      TRP  59  81.791  -3.301   8.408
  456    HH2  TRP  59           HH2      TRP  59  84.091  -3.981   9.014
  457    H    LYS  60           H        LYS  60  81.845   5.135   5.964
  458    HA   LYS  60           HA       LYS  60  78.976   5.131   6.406
  459    HB2  LYS  60           HB2      LYS  60  80.696   7.518   7.129
  460    HB3  LYS  60           HB3      LYS  60  78.950   7.597   6.904
  461    HG2  LYS  60           HG2      LYS  60  78.825   5.684   8.636
  462    HG3  LYS  60           HG3      LYS  60  80.495   6.098   9.020
  463    HD2  LYS  60           HD2      LYS  60  78.250   8.132   9.015
  464    HD3  LYS  60           HD3      LYS  60  78.743   7.246  10.456
  465    HE2  LYS  60           HE2      LYS  60  81.085   8.099  10.089
  466    HE3  LYS  60           HE3      LYS  60  80.449   9.121   8.799
  467    HZ1  LYS  60           HZ1      LYS  60  78.806   9.913  10.565
  468    HZ2  LYS  60           HZ2      LYS  60  80.406  10.477  10.662
  469    HZ3  LYS  60           HZ3      LYS  60  79.877   9.233  11.692
  470    H    GLU  61           H        GLU  61  78.412   7.575   5.151
  471    HA   GLU  61           HA       GLU  61  78.977   6.866   2.420
  472    HB2  GLU  61           HB2      GLU  61  76.805   7.787   2.973
  473    HB3  GLU  61           HB3      GLU  61  77.549   9.244   3.631
  474    HG2  GLU  61           HG2      GLU  61  78.282   9.968   1.493
  475    HG3  GLU  61           HG3      GLU  61  78.007   8.383   0.773
  476    H    GLU  62           H        GLU  62  79.609   9.837   4.314
  477    HA   GLU  62           HA       GLU  62  81.388  10.922   2.373
  478    HB2  GLU  62           HB2      GLU  62  81.320  11.630   5.311
  479    HB3  GLU  62           HB3      GLU  62  81.820  12.649   3.963
  480    HG2  GLU  62           HG2      GLU  62  79.666  13.441   4.262
  481    HG3  GLU  62           HG3      GLU  62  79.346  12.145   3.112
  482    H    THR  63           H        THR  63  81.867   9.062   5.349
  483    HA   THR  63           HA       THR  63  84.653   9.279   5.538
  484    HB   THR  63           HB       THR  63  84.559   7.189   6.815
  485    HG1  THR  63           HG1      THR  63  82.466   6.773   5.220
  486   HG21  THR  63          HG21      THR  63  83.887   9.087   8.064
  487   HG22  THR  63          HG22      THR  63  82.651   7.869   8.377
  488   HG23  THR  63          HG23      THR  63  82.333   9.177   7.238
  489    H    LEU  64           H        LEU  64  82.601   7.181   3.596
  490    HA   LEU  64           HA       LEU  64  84.691   5.508   2.633
  491    HB2  LEU  64           HB2      LEU  64  81.843   5.846   2.159
  492    HB3  LEU  64           HB3      LEU  64  82.711   5.558   0.660
  493    HG   LEU  64           HG       LEU  64  83.028   3.842   3.135
  494   HD11  LEU  64          HD11      LEU  64  81.039   3.803   0.926
  495   HD12  LEU  64          HD12      LEU  64  80.914   3.177   2.567
  496   HD13  LEU  64          HD13      LEU  64  81.764   2.248   1.333
  497   HD21  LEU  64          HD21      LEU  64  84.924   3.376   1.893
  498   HD22  LEU  64          HD22      LEU  64  84.177   3.850   0.369
  499   HD23  LEU  64          HD23      LEU  64  83.800   2.285   1.085
  500    H    MET  65           H        MET  65  83.335   8.591   1.596
  501    HA   MET  65           HA       MET  65  84.455   8.714  -0.979
  502    HB2  MET  65           HB2      MET  65  83.923  10.966   0.970
  503    HB3  MET  65           HB1      MET  65  84.266  11.171  -0.747
  504    HG2  MET  65           HG2      MET  65  82.278   9.947  -1.361
  505    HG3  MET  65           HG1      MET  65  81.980   9.500   0.317
  506    HE1  MET  65           HE1      MET  65  80.379  11.397  -2.197
  507    HE2  MET  65           HE2      MET  65  81.990  12.082  -2.399
  508    HE3  MET  65           HE3      MET  65  80.651  13.123  -1.921
  509    H    GLU  66           H        GLU  66  85.739  10.130   2.043
  510    HA   GLU  66           HA       GLU  66  88.202  10.956   0.980
  511    HB2  GLU  66           HB2      GLU  66  87.447  10.126   3.791
  512    HB3  GLU  66           HB3      GLU  66  88.988  10.872   3.365
  513    HG2  GLU  66           HG2      GLU  66  86.320  12.129   2.692
  514    HG3  GLU  66           HG3      GLU  66  87.188  12.475   4.187
  515    H    TYR  67           H        TYR  67  87.063   7.866   2.115
  516    HA   TYR  67           HA       TYR  67  89.666   6.617   2.179
  517    HB2  TYR  67           HB2      TYR  67  87.931   5.759   3.629
  518    HB3  TYR  67           HB3      TYR  67  86.853   5.513   2.259
  519    HD1  TYR  67           HD1      TYR  67  89.857   4.282   4.000
  520    HD2  TYR  67           HD2      TYR  67  87.169   3.666   0.706
  521    HE1  TYR  67           HE1      TYR  67  90.784   2.005   3.670
  522    HE2  TYR  67           HE2      TYR  67  88.098   1.391   0.375
  523    HH   TYR  67           HH       TYR  67  90.667   0.328   1.112
  524    H    LEU  68           H        LEU  68  87.121   7.126  -0.128
  525    HA   LEU  68           HA       LEU  68  88.041   5.145  -2.010
  526    HB2  LEU  68           HB2      LEU  68  85.860   7.156  -1.859
  527    HB3  LEU  68           HB3      LEU  68  86.398   6.719  -3.474
  528    HG   LEU  68           HG       LEU  68  85.615   4.701  -1.353
  529   HD11  LEU  68          HD11      LEU  68  83.601   5.794  -1.841
  530   HD12  LEU  68          HD12      LEU  68  83.599   4.444  -2.972
  531   HD13  LEU  68          HD13      LEU  68  84.033   6.062  -3.528
  532   HD21  LEU  68          HD21      LEU  68  85.294   3.434  -3.685
  533   HD22  LEU  68          HD22      LEU  68  86.844   3.460  -2.853
  534   HD23  LEU  68          HD23      LEU  68  86.544   4.566  -4.189
  535    H    GLU  69           H        GLU  69  88.758   8.454  -1.305
  536    HA   GLU  69           HA       GLU  69  90.028   8.882  -3.914
  537    HB2  GLU  69           HB2      GLU  69  89.982  11.137  -3.445
  538    HB3  GLU  69           HB3      GLU  69  88.624  10.607  -2.455
  539    HG2  GLU  69           HG2      GLU  69  90.371  10.305  -0.572
  540    HG3  GLU  69           HG3      GLU  69  91.427  11.292  -1.579
  541    H    ASN  70           H        ASN  70  90.782   7.641  -0.903
  542    HA   ASN  70           HA       ASN  70  93.523   7.265  -1.518
  543    HB2  ASN  70           HB2      ASN  70  93.224   9.791  -0.720
  544    HB3  ASN  70           HB1      ASN  70  93.284   9.044   0.872
  545   HD21  ASN  70          HD21      ASN  70  95.139   6.947   0.384
  546   HD22  ASN  70          HD22      ASN  70  96.643   7.626  -0.012
  547    HA   PRO  71           HA       PRO  71  91.240   4.417   1.448
  548    HB2  PRO  71           HB2      PRO  71  93.000   2.566  -0.103
  549    HB3  PRO  71           HB1      PRO  71  91.303   2.374   0.373
  550    HG2  PRO  71           HG2      PRO  71  92.002   2.987  -2.130
  551    HG3  PRO  71           HG1      PRO  71  90.527   3.626  -1.385
  552    HD2  PRO  71           HD2      PRO  71  93.091   5.022  -1.981
  553    HD3  PRO  71           HD1      PRO  71  91.442   5.678  -1.896
  554    H    LYS  72           H        LYS  72  94.651   4.615   0.501
  555    HA   LYS  72           HA       LYS  72  95.595   3.255   2.854
  556    HB2  LYS  72           HB2      LYS  72  96.799   3.200   0.691
  557    HB3  LYS  72           HB3      LYS  72  97.111   4.923   0.842
  558    HG2  LYS  72           HG2      LYS  72  99.083   3.896   1.665
  559    HG3  LYS  72           HG3      LYS  72  98.198   4.378   3.107
  560    HD2  LYS  72           HD2      LYS  72  99.096   2.073   3.303
  561    HD3  LYS  72           HD3      LYS  72  97.339   2.092   3.378
  562    HE2  LYS  72           HE2      LYS  72  98.561   1.762   0.677
  563    HE3  LYS  72           HE3      LYS  72  98.686   0.396   1.783
  564    HZ1  LYS  72           HZ1      LYS  72  96.527   1.008   0.253
  565    HZ2  LYS  72           HZ2      LYS  72  96.083   1.586   1.788
  566    HZ3  LYS  72           HZ3      LYS  72  96.532  -0.041   1.586
  567    H    LYS  73           H        LYS  73  95.675   6.647   1.744
  568    HA   LYS  73           HA       LYS  73  97.030   7.641   3.991
  569    HB2  LYS  73           HB2      LYS  73  96.699   8.831   1.797
  570    HB3  LYS  73           HB3      LYS  73  95.053   9.189   2.310
  571    HG2  LYS  73           HG2      LYS  73  97.394   9.877   4.085
  572    HG3  LYS  73           HG3      LYS  73  96.932  10.948   2.766
  573    HD2  LYS  73           HD2      LYS  73  94.510  10.326   4.085
  574    HD3  LYS  73           HD3      LYS  73  95.680  10.615   5.370
  575    HE2  LYS  73           HE2      LYS  73  95.149  12.482   3.041
  576    HE3  LYS  73           HE3      LYS  73  94.554  12.707   4.686
  577    HZ1  LYS  73           HZ1      LYS  73  97.385  12.656   3.797
  578    HZ2  LYS  73           HZ2      LYS  73  96.904  12.665   5.426
  579    HZ3  LYS  73           HZ3      LYS  73  96.531  13.982   4.421
  580    H    TYR  74           H        TYR  74  93.623   6.968   3.457
  581    HA   TYR  74           HA       TYR  74  92.615   8.467   5.643
  582    HB2  TYR  74           HB2      TYR  74  91.418   7.201   3.617
  583    HB3  TYR  74           HB3      TYR  74  91.258   5.934   4.831
  584    HD1  TYR  74           HD1      TYR  74  90.936   9.683   4.679
  585    HD2  TYR  74           HD2      TYR  74  89.278   5.966   6.060
  586    HE1  TYR  74           HE1      TYR  74  89.042  10.907   5.708
  587    HE2  TYR  74           HE2      TYR  74  87.386   7.193   7.087
  588    HH   TYR  74           HH       TYR  74  86.711   9.289   7.771
  589    H    ILE  75           H        ILE  75  93.218   4.957   5.361
  590    HA   ILE  75           HA       ILE  75  93.756   4.905   8.272
  591    HB   ILE  75           HB       ILE  75  92.345   2.729   6.709
  592   HG12  ILE  75          HG12      ILE  75  91.117   4.559   8.782
  593   HG13  ILE  75          HG13      ILE  75  91.075   4.948   7.063
  594   HG21  ILE  75          HG21      ILE  75  91.822   1.973   9.088
  595   HG22  ILE  75          HG22      ILE  75  93.021   3.147   9.632
  596   HG23  ILE  75          HG23      ILE  75  93.507   1.806   8.594
  597   HD11  ILE  75          HD11      ILE  75  89.847   2.951   6.551
  598   HD12  ILE  75          HD12      ILE  75  89.041   3.700   7.929
  599   HD13  ILE  75          HD13      ILE  75  90.098   2.309   8.174
  600    HA   PRO  76           HA       PRO  76  97.447   3.597   5.634
  601    HB2  PRO  76           HB2      PRO  76  98.528   4.324   8.340
  602    HB3  PRO  76           HB1      PRO  76  99.225   4.619   6.735
  603    HG2  PRO  76           HG2      PRO  76  97.984   6.553   8.085
  604    HG3  PRO  76           HG1      PRO  76  97.859   6.421   6.322
  605    HD2  PRO  76           HD2      PRO  76  95.801   5.860   8.387
  606    HD3  PRO  76           HD1      PRO  76  95.593   6.286   6.675
  607    H    GLY  77           H        GLY  77  98.659   1.687   5.794
  608    HA2  GLY  77           HA2      GLY  77  99.430  -0.298   6.807
  609    HA3  GLY  77           HA3      GLY  77  98.338  -0.012   8.160
  610    H    THR  78           H        THR  78  96.088   0.573   6.296
  611    HA   THR  78           HA       THR  78  94.865  -1.931   6.229
  612    HB   THR  78           HB       THR  78  93.689   0.262   6.045
  613    HG1  THR  78           HG1      THR  78  93.255  -1.718   4.070
  614   HG21  THR  78          HG21      THR  78  95.327   1.152   4.331
  615   HG22  THR  78          HG22      THR  78  93.626   1.425   3.954
  616   HG23  THR  78          HG23      THR  78  94.513   0.136   3.141
  617    H    LYS  79           H        LYS  79  94.567  -3.487   4.642
  618    HA   LYS  79           HA       LYS  79  96.665  -3.562   2.606
  619    HB2  LYS  79           HB2      LYS  79  94.914  -5.534   3.957
  620    HB3  LYS  79           HB3      LYS  79  95.300  -5.894   2.276
  621    HG2  LYS  79           HG2      LYS  79  97.499  -5.068   4.160
  622    HG3  LYS  79           HG3      LYS  79  96.908  -6.729   4.182
  623    HD2  LYS  79           HD2      LYS  79  97.338  -6.903   1.745
  624    HD3  LYS  79           HD3      LYS  79  97.981  -5.261   1.754
  625    HE2  LYS  79           HE2      LYS  79  99.797  -5.890   3.193
  626    HE3  LYS  79           HE3      LYS  79  99.079  -7.469   3.508
  627    HZ1  LYS  79           HZ1      LYS  79  99.227  -7.564   0.877
  628    HZ2  LYS  79           HZ2      LYS  79 100.505  -8.063   1.880
  629    HZ3  LYS  79           HZ3      LYS  79 100.533  -6.521   1.168
  630    H    MET  80           H        MET  80  95.979  -2.061   1.072
  631    HA   MET  80           HA       MET  80  94.331  -3.027  -0.991
  632    HB2  MET  80           HB2      MET  80  92.429  -2.573   0.429
  633    HB3  MET  80           HB1      MET  80  93.031  -0.955   0.794
  634    HG2  MET  80           HG2      MET  80  92.654  -0.197  -1.428
  635    HG3  MET  80           HG1      MET  80  92.453  -1.838  -2.038
  636    HE1  MET  80           HE1      MET  80  90.792   1.052  -1.956
  637    HE2  MET  80           HE2      MET  80  89.104   0.556  -1.980
  638    HE3  MET  80           HE3      MET  80  90.246  -0.176  -3.105
  639    H    ILE  81           H        ILE  81  95.992  -2.353  -2.296
  640    HA   ILE  81           HA       ILE  81  96.524   0.556  -2.422
  641    HB   ILE  81           HB       ILE  81  98.207  -1.835  -3.193
  642   HG12  ILE  81          HG12      ILE  81  99.830  -0.667  -1.662
  643   HG13  ILE  81          HG13      ILE  81  98.560   0.492  -1.277
  644   HG21  ILE  81          HG21      ILE  81  99.880   0.006  -3.862
  645   HG22  ILE  81          HG22      ILE  81  98.484   1.083  -3.927
  646   HG23  ILE  81          HG23      ILE  81  98.564  -0.323  -4.989
  647   HD11  ILE  81          HD11      ILE  81  97.416  -0.996   0.028
  648   HD12  ILE  81          HD12      ILE  81  98.991  -1.774   0.154
  649   HD13  ILE  81          HD13      ILE  81  97.806  -2.369  -1.007
  650    H    PHE  82           H        PHE  82  94.973   1.265  -3.833
  651    HA   PHE  82           HA       PHE  82  95.224   0.324  -6.603
  652    HB2  PHE  82           HB2      PHE  82  93.223  -0.735  -5.197
  653    HB3  PHE  82           HB1      PHE  82  92.451   0.800  -5.592
  654    HD1  PHE  82           HD2      PHE  82  94.064  -2.220  -7.035
  655    HD2  PHE  82           HD1      PHE  82  91.718   1.292  -7.822
  656    HE1  PHE  82           HE2      PHE  82  93.583  -3.053  -9.320
  657    HE2  PHE  82           HE1      PHE  82  91.238   0.458 -10.108
  658    HZ   PHE  82           HZ       PHE  82  92.170  -1.715 -10.856
  659    H    ALA  83           H        ALA  83  94.265   1.831  -8.152
  660    HA   ALA  83           HA       ALA  83  94.981   4.502  -7.638
  661    HB1  ALA  83           HB1      ALA  83  94.842   3.450  -9.901
  662    HB2  ALA  83           HB2      ALA  83  94.015   5.005  -9.799
  663    HB3  ALA  83           HB3      ALA  83  93.084   3.507  -9.775
  664    H    GLY  84           H        GLY  84  94.001   5.762  -6.185
  665    HA2  GLY  84           HA2      GLY  84  91.390   5.470  -5.199
  666    HA3  GLY  84           HA3      GLY  84  92.358   6.936  -5.082
  667    H    ILE  85           H        ILE  85  89.761   7.371  -5.357
  668    HA   ILE  85           HA       ILE  85  88.985   7.577  -8.148
  669    HB   ILE  85           HB       ILE  85  87.682   8.519  -5.589
  670   HG12  ILE  85          HG12      ILE  85  87.934   5.978  -6.343
  671   HG13  ILE  85          HG13      ILE  85  86.420   6.566  -5.668
  672   HG21  ILE  85          HG21      ILE  85  85.656   8.702  -7.186
  673   HG22  ILE  85          HG22      ILE  85  86.853   8.744  -8.479
  674   HG23  ILE  85          HG23      ILE  85  86.855   9.994  -7.235
  675   HD11  ILE  85          HD11      ILE  85  86.331   5.189  -7.870
  676   HD12  ILE  85          HD12      ILE  85  86.900   6.670  -8.639
  677   HD13  ILE  85          HD13      ILE  85  85.368   6.662  -7.764
  678    H    LYS  86           H        LYS  86  88.394   9.646  -9.137
  679    HA   LYS  86           HA       LYS  86  90.269  11.772  -8.319
  680    HB2  LYS  86           HB2      LYS  86  88.924  11.210 -10.969
  681    HB3  LYS  86           HB3      LYS  86  89.950  12.606 -10.649
  682    HG2  LYS  86           HG2      LYS  86  91.687  11.294 -11.294
  683    HG3  LYS  86           HG3      LYS  86  91.504  10.488  -9.739
  684    HD2  LYS  86           HD2      LYS  86  91.407   8.702 -11.258
  685    HD3  LYS  86           HD3      LYS  86  89.704   9.044 -10.959
  686    HE2  LYS  86           HE2      LYS  86  89.549  10.338 -13.012
  687    HE3  LYS  86           HE3      LYS  86  91.285  10.191 -13.280
  688    HZ1  LYS  86           HZ1      LYS  86  90.761   7.667 -13.142
  689    HZ2  LYS  86           HZ2      LYS  86  90.477   8.515 -14.587
  690    HZ3  LYS  86           HZ3      LYS  86  89.186   8.155 -13.542
  691    H    LYS  87           H        LYS  87  87.120  11.733 -10.032
  692    HA   LYS  87           HA       LYS  87  86.478  14.333  -8.943
  693    HB2  LYS  87           HB2      LYS  87  84.495  12.617 -10.397
  694    HB3  LYS  87           HB3      LYS  87  84.704  14.368 -10.443
  695    HG2  LYS  87           HG2      LYS  87  87.012  13.870 -11.500
  696    HG3  LYS  87           HG3      LYS  87  86.385  12.244 -11.775
  697    HD2  LYS  87           HD2      LYS  87  84.350  13.413 -12.853
  698    HD3  LYS  87           HD3      LYS  87  85.362  14.858 -12.887
  699    HE2  LYS  87           HE2      LYS  87  85.993  12.187 -14.175
  700    HE3  LYS  87           HE3      LYS  87  85.585  13.685 -15.011
  701    HZ1  LYS  87           HZ1      LYS  87  87.784  13.987 -15.061
  702    HZ2  LYS  87           HZ2      LYS  87  88.081  12.854 -13.831
  703    HZ3  LYS  87           HZ3      LYS  87  87.628  14.443 -13.436
  704    H    LYS  88           H        LYS  88  84.419  14.779  -7.866
  705    HA   LYS  88           HA       LYS  88  84.088  13.124  -5.560
  706    HB2  LYS  88           HB2      LYS  88  83.765  15.640  -5.657
  707    HB3  LYS  88           HB3      LYS  88  82.234  15.327  -6.475
  708    HG2  LYS  88           HG2      LYS  88  81.789  13.710  -4.449
  709    HG3  LYS  88           HG3      LYS  88  83.040  14.663  -3.651
  710    HD2  LYS  88           HD2      LYS  88  81.171  15.903  -3.066
  711    HD3  LYS  88           HD3      LYS  88  81.595  16.702  -4.580
  712    HE2  LYS  88           HE2      LYS  88  80.028  15.095  -5.754
  713    HE3  LYS  88           HE3      LYS  88  79.494  14.560  -4.161
  714    HZ1  LYS  88           HZ1      LYS  88  78.255  16.471  -5.383
  715    HZ2  LYS  88           HZ2      LYS  88  79.516  17.432  -4.773
  716    HZ3  LYS  88           HZ3      LYS  88  78.515  16.563  -3.710
  717    H    THR  89           H        THR  89  82.007  13.872  -8.361
  718    HA   THR  89           HA       THR  89  79.812  12.310  -7.661
  719    HB   THR  89           HB       THR  89  79.366  12.160 -10.108
  720    HG1  THR  89           HG1      THR  89  81.895  12.308 -10.324
  721   HG21  THR  89          HG21      THR  89  79.016  14.526 -10.401
  722   HG22  THR  89          HG22      THR  89  80.302  14.910  -9.256
  723   HG23  THR  89          HG23      THR  89  78.805  14.171  -8.686
  724    H    GLU  90           H        GLU  90  82.949  11.357  -8.844
  725    HA   GLU  90           HA       GLU  90  82.230   8.738  -9.710
  726    HB2  GLU  90           HB2      GLU  90  84.828  10.026  -8.890
  727    HB3  GLU  90           HB3      GLU  90  84.739   8.304  -9.252
  728    HG2  GLU  90           HG2      GLU  90  83.847   8.795 -11.478
  729    HG3  GLU  90           HG3      GLU  90  83.871  10.521 -11.123
  730    H    ARG  91           H        ARG  91  83.314  10.132  -6.654
  731    HA   ARG  91           HA       ARG  91  83.392   7.622  -5.252
  732    HB2  ARG  91           HB2      ARG  91  83.314  10.477  -4.229
  733    HB3  ARG  91           HB3      ARG  91  83.626   9.054  -3.238
  734    HG2  ARG  91           HG2      ARG  91  85.528   8.533  -4.885
  735    HG3  ARG  91           HG3      ARG  91  85.324  10.185  -5.461
  736    HD2  ARG  91           HD2      ARG  91  85.403  10.308  -2.615
  737    HD3  ARG  91           HD3      ARG  91  86.729   9.269  -3.124
  738    HE   ARG  91           HE       ARG  91  87.733  11.109  -4.155
  739   HH11  ARG  91          HH21      ARG  91  84.491  11.820  -3.146
  740   HH12  ARG  91          HH22      ARG  91  84.643  13.524  -3.408
  741   HH21  ARG  91          HH11      ARG  91  87.927  13.340  -4.499
  742   HH22  ARG  91          HH12      ARG  91  86.584  14.384  -4.173
  743    H    GLU  92           H        GLU  92  81.152  10.399  -5.314
  744    HA   GLU  92           HA       GLU  92  79.266   9.384  -3.500
  745    HB2  GLU  92           HB2      GLU  92  79.375  11.738  -4.437
  746    HB3  GLU  92           HB3      GLU  92  78.619  11.105  -5.900
  747    HG2  GLU  92           HG2      GLU  92  76.750  10.220  -4.482
  748    HG3  GLU  92           HG3      GLU  92  77.477  11.029  -3.094
  749    H    ASP  93           H        ASP  93  79.252   9.262  -7.076
  750    HA   ASP  93           HA       ASP  93  76.956   7.662  -7.339
  751    HB2  ASP  93           HB2      ASP  93  79.388   7.841  -9.134
  752    HB3  ASP  93           HB1      ASP  93  77.852   7.104  -9.583
  753    H    LEU  94           H        LEU  94  80.394   6.779  -7.140
  754    HA   LEU  94           HA       LEU  94  80.081   3.996  -7.401
  755    HB2  LEU  94           HB2      LEU  94  82.277   5.044  -7.565
  756    HB3  LEU  94           HB3      LEU  94  82.165   5.581  -5.890
  757    HG   LEU  94           HG       LEU  94  82.136   3.279  -5.104
  758   HD11  LEU  94          HD11      LEU  94  81.027   2.014  -6.718
  759   HD12  LEU  94          HD12      LEU  94  82.701   1.537  -6.993
  760   HD13  LEU  94          HD13      LEU  94  81.939   2.726  -8.049
  761   HD21  LEU  94          HD21      LEU  94  84.322   4.415  -5.568
  762   HD22  LEU  94          HD22      LEU  94  84.337   3.647  -7.156
  763   HD23  LEU  94          HD23      LEU  94  84.406   2.659  -5.698
  764    H    ILE  95           H        ILE  95  79.868   6.150  -4.640
  765    HA   ILE  95           HA       ILE  95  79.678   4.032  -2.726
  766    HB   ILE  95           HB       ILE  95  79.358   7.011  -2.620
  767   HG12  ILE  95          HG12      ILE  95  81.060   5.412  -0.767
  768   HG13  ILE  95          HG13      ILE  95  81.525   5.390  -2.461
  769   HG21  ILE  95          HG21      ILE  95  79.114   6.483  -0.038
  770   HG22  ILE  95          HG22      ILE  95  78.422   4.970  -0.621
  771   HG23  ILE  95          HG23      ILE  95  77.684   6.507  -1.069
  772   HD11  ILE  95          HD11      ILE  95  80.880   8.075  -1.403
  773   HD12  ILE  95          HD12      ILE  95  82.211   7.551  -2.431
  774   HD13  ILE  95          HD13      ILE  95  82.302   7.316  -0.691
  775    H    ALA  96           H        ALA  96  77.465   5.845  -4.692
  776    HA   ALA  96           HA       ALA  96  75.084   5.282  -3.249
  777    HB1  ALA  96           HB1      ALA  96  75.280   7.008  -5.047
  778    HB2  ALA  96           HB2      ALA  96  73.925   5.906  -5.288
  779    HB3  ALA  96           HB3      ALA  96  75.402   5.707  -6.231
  780    H    TYR  97           H        TYR  97  76.976   3.568  -5.660
  781    HA   TYR  97           HA       TYR  97  75.043   1.462  -6.021
  782    HB2  TYR  97           HB2      TYR  97  76.550   1.916  -7.851
  783    HB3  TYR  97           HB3      TYR  97  77.955   1.693  -6.808
  784    HD1  TYR  97           HD1      TYR  97  75.001  -0.060  -8.257
  785    HD2  TYR  97           HD2      TYR  97  78.847  -0.474  -6.392
  786    HE1  TYR  97           HE1      TYR  97  74.964  -2.494  -8.722
  787    HE2  TYR  97           HE2      TYR  97  78.810  -2.909  -6.859
  788    HH   TYR  97           HH       TYR  97  76.228  -4.619  -7.487
  789    H    LEU  98           H        LEU  98  78.136   1.829  -4.288
  790    HA   LEU  98           HA       LEU  98  78.340  -0.758  -3.263
  791    HB2  LEU  98           HB2      LEU  98  79.251   1.918  -2.222
  792    HB3  LEU  98           HB3      LEU  98  79.554   0.440  -1.315
  793    HG   LEU  98           HG       LEU  98  80.293   0.606  -4.236
  794   HD11  LEU  98          HD11      LEU  98  82.449   1.472  -3.723
  795   HD12  LEU  98          HD12      LEU  98  82.182   1.309  -1.990
  796   HD13  LEU  98          HD13      LEU  98  81.314   2.542  -2.904
  797   HD21  LEU  98          HD21      LEU  98  81.974  -0.802  -2.250
  798   HD22  LEU  98          HD22      LEU  98  81.404  -1.342  -3.827
  799   HD23  LEU  98          HD23      LEU  98  80.344  -1.454  -2.422
  800    H    LYS  99           H        LYS  99  76.181   1.821  -2.460
  801    HA   LYS  99           HA       LYS  99  75.439   0.795   0.138
  802    HB2  LYS  99           HB2      LYS  99  74.557   3.037  -1.630
  803    HB3  LYS  99           HB3      LYS  99  73.423   2.465  -0.408
  804    HG2  LYS  99           HG2      LYS  99  75.487   2.664   1.212
  805    HG3  LYS  99           HG3      LYS  99  76.128   3.734  -0.034
  806    HD2  LYS  99           HD2      LYS  99  73.415   4.050   1.288
  807    HD3  LYS  99           HD3      LYS  99  74.858   4.962   1.727
  808    HE2  LYS  99           HE2      LYS  99  73.506   4.966  -0.988
  809    HE3  LYS  99           HE3      LYS  99  73.477   6.277   0.189
  810    HZ1  LYS  99           HZ1      LYS  99  75.994   6.188   0.037
  811    HZ2  LYS  99           HZ2      LYS  99  75.164   6.842  -1.294
  812    HZ3  LYS  99           HZ3      LYS  99  75.776   5.258  -1.364
  813    H    LYS 100           H        LYS 100  73.900   0.921  -3.074
  814    HA   LYS 100           HA       LYS 100  71.667  -0.690  -2.233
  815    HB2  LYS 100           HB2      LYS 100  72.624   0.230  -4.948
  816    HB3  LYS 100           HB3      LYS 100  71.156  -0.718  -4.702
  817    HG2  LYS 100           HG2      LYS 100  70.211   1.011  -3.283
  818    HG3  LYS 100           HG3      LYS 100  71.715   1.931  -3.339
  819    HD2  LYS 100           HD2      LYS 100  71.451   2.375  -5.687
  820    HD3  LYS 100           HD3      LYS 100  70.102   1.244  -5.807
  821    HE2  LYS 100           HE2      LYS 100  70.068   3.723  -4.065
  822    HE3  LYS 100           HE3      LYS 100  69.398   3.660  -5.695
  823    HZ1  LYS 100           HZ1      LYS 100  68.117   1.643  -4.817
  824    HZ2  LYS 100           HZ2      LYS 100  67.595   3.189  -4.346
  825    HZ3  LYS 100           HZ3      LYS 100  68.502   2.232  -3.275
  826    H    ALA 101           H        ALA 101  74.850  -1.333  -3.302
  827    HA   ALA 101           HA       ALA 101  74.255  -3.992  -4.327
  828    HB1  ALA 101           HB1      ALA 101  76.067  -2.581  -5.308
  829    HB2  ALA 101           HB2      ALA 101  76.638  -4.151  -4.743
  830    HB3  ALA 101           HB3      ALA 101  76.940  -2.704  -3.781
  831    H    THR 102           H        THR 102  75.446  -2.465  -1.410
  832    HA   THR 102           HA       THR 102  76.143  -5.033  -0.191
  833    HB   THR 102           HB       THR 102  76.779  -3.596   1.757
  834    HG1  THR 102           HG1      THR 102  76.875  -1.266   0.675
  835   HG21  THR 102          HG21      THR 102  78.660  -2.443   0.528
  836   HG22  THR 102          HG22      THR 102  77.887  -2.936  -0.978
  837   HG23  THR 102          HG23      THR 102  78.476  -4.155   0.149
  838    H    ASN 103           H        ASN 103  73.395  -3.321  -0.731
  839    HA   ASN 103           HA       ASN 103  72.117  -3.942   1.840
  840    HB2  ASN 103           HB2      ASN 103  71.381  -2.257  -0.539
  841    HB3  ASN 103           HB1      ASN 103  70.162  -2.739   0.633
  842   HD21  ASN 103          HD21      ASN 103  73.498  -2.160   1.623
  843   HD22  ASN 103          HD22      ASN 103  73.176  -0.731   2.479
  844    H    GLU 104           H        GLU 104  72.326  -5.001  -1.449
  845    HA   GLU 104           HA       GLU 104  70.731  -7.346  -0.847
  846    HB2  GLU 104           HB2      GLU 104  69.219  -6.991  -2.814
  847    HB3  GLU 104           HB3      GLU 104  68.942  -5.855  -1.493
  848    HG2  GLU 104           HG2      GLU 104  70.259  -4.146  -2.634
  849    HG3  GLU 104           HG3      GLU 104  70.662  -5.280  -3.922
  850    HHA  HEC 201           HA       HEC 105  89.241  -3.479   3.257
  851    HHB  HEC 201           HB       HEC 105  85.530   0.083  -0.420
  852    HHC  HEC 201           HC       HEC 105  88.802  -1.791  -5.502
  853    HHD  HEC 201           HD       HEC 105  92.087  -5.810  -1.887
  854   HMA1  HEC 201          HMA1      HEC 105  85.030  -0.410   3.265
  855   HMA2  HEC 201          HMA2      HEC 105  84.589  -0.115   1.587
  856   HMA3  HEC 201          HMA3      HEC 105  85.750   0.941   2.390
  857   HAA1  HEC 201          HAA1      HEC 105  86.809  -0.886   4.516
  858   HAA2  HEC 201          HAA2      HEC 105  88.328  -1.759   4.491
  859   HBA1  HEC 201          HBA1      HEC 105  87.300  -3.834   4.686
  860   HBA2  HEC 201          HBA2      HEC 105  85.772  -3.259   4.027
  861   HMB1  HEC 201          HMB1      HEC 105  85.161   1.608  -2.291
  862   HMB2  HEC 201          HMB2      HEC 105  84.130   0.233  -2.680
  863   HMB3  HEC 201          HMB3      HEC 105  84.822   1.206  -3.971
  864    HAB  HEC 201           HAB      HEC 105  87.352  -0.550  -6.175
  865   HBB1  HEC 201          HBB1      HEC 105  88.005   1.664  -5.886
  866   HBB2  HEC 201          HBB2      HEC 105  86.373   1.869  -6.519
  867   HBB3  HEC 201          HBB3      HEC 105  86.677   2.021  -4.792
  868   HMC1  HEC 201          HMC1      HEC 105  91.132  -4.406  -6.842
  869   HMC2  HEC 201          HMC2      HEC 105  91.354  -2.677  -6.586
  870   HMC3  HEC 201          HMC3      HEC 105  89.737  -3.334  -6.821
  871    HAC  HEC 201           HAC      HEC 105  92.571  -6.227  -3.802
  872   HBC1  HEC 201          HBC1      HEC 105  93.160  -4.104  -5.811
  873   HBC2  HEC 201          HBC2      HEC 105  93.695  -5.738  -6.200
  874   HBC3  HEC 201          HBC3      HEC 105  94.252  -4.956  -4.722
  875   HMD1  HEC 201          HMD1      HEC 105  93.152  -6.540   1.628
  876   HMD2  HEC 201          HMD2      HEC 105  93.284  -6.352  -0.116
  877   HMD3  HEC 201          HMD3      HEC 105  92.156  -7.527   0.560
  878   HAD1  HEC 201          HAD1      HEC 105  91.731  -6.317   3.276
  879   HAD2  HEC 201          HAD2      HEC 105  90.239  -5.532   3.753
  880   HBD1  HEC 201          HBD1      HEC 105  91.516  -3.362   3.877
  881   HBD2  HEC 201          HBD2      HEC 105  92.991  -4.294   3.629
  882    H1   HOH 301           H2       HOH 200  83.059   2.999  -1.441
  883    H2   HOH 301           H1       HOH 200  82.429   4.031  -0.535
  884    H1   HOH 302           H2       HOH 201  85.242   4.913   6.610
  885    H2   HOH 302           H1       HOH 201  86.748   4.892   6.458
  886    H1   HOH 303           H2       HOH 202  81.930  -5.911   4.858
  887    H2   HOH 303           H1       HOH 202  83.221  -5.550   5.564
  888    H1   HOH 304           H2       HOH 203  82.541 -10.937  -0.097
  889    H2   HOH 304           H1       HOH 203  83.547 -10.003  -0.736
  Start of MODEL    3
    1    H1   GLY   1           H1       GLY   1  74.783  11.885  -8.616
    2    H2   GLY   1           H2       GLY   1  76.218  11.207  -8.012
    3    H3   GLY   1           H3       GLY   1  75.280  12.231  -7.033
    4    HA2  GLY   1           HA2      GLY   1  75.156   9.649  -6.758
    5    HA3  GLY   1           HA3      GLY   1  73.714  10.653  -6.593
    6    H    ASP   2           H        ASP   2  75.312   8.238  -8.462
    7    HA   ASP   2           HA       ASP   2  72.879   7.782 -10.006
    8    HB2  ASP   2           HB2      ASP   2  75.542   8.320 -11.338
    9    HB3  ASP   2           HB1      ASP   2  74.105   7.707 -12.152
   10    H    VAL   3           H        VAL   3  72.779   5.864  -8.792
   11    HA   VAL   3           HA       VAL   3  74.732   3.982  -8.354
   12    HB   VAL   3           HB       VAL   3  72.525   3.726  -7.405
   13   HG11  VAL   3          HG11      VAL   3  71.639   3.386 -10.285
   14   HG12  VAL   3          HG12      VAL   3  71.179   4.684  -9.183
   15   HG13  VAL   3          HG13      VAL   3  70.617   3.038  -8.891
   16   HG21  VAL   3          HG21      VAL   3  72.707   1.415  -9.327
   17   HG22  VAL   3          HG22      VAL   3  72.352   1.399  -7.600
   18   HG23  VAL   3          HG23      VAL   3  73.998   1.682  -8.158
   19    H    GLU   4           H        GLU   4  73.421   4.981 -11.356
   20    HA   GLU   4           HA       GLU   4  73.888   2.564 -12.821
   21    HB2  GLU   4           HB2      GLU   4  73.476   5.437 -13.647
   22    HB3  GLU   4           HB3      GLU   4  73.760   4.146 -14.816
   23    HG2  GLU   4           HG2      GLU   4  71.580   4.004 -12.724
   24    HG3  GLU   4           HG3      GLU   4  71.313   4.669 -14.334
   25    H    LYS   5           H        LYS   5  75.614   5.695 -12.819
   26    HA   LYS   5           HA       LYS   5  77.883   4.605 -14.191
   27    HB2  LYS   5           HB2      LYS   5  77.306   7.210 -12.791
   28    HB3  LYS   5           HB3      LYS   5  78.938   6.829 -13.343
   29    HG2  LYS   5           HG2      LYS   5  78.275   6.718 -15.610
   30    HG3  LYS   5           HG3      LYS   5  76.567   6.581 -15.196
   31    HD2  LYS   5           HD2      LYS   5  78.054   9.038 -14.327
   32    HD3  LYS   5           HD3      LYS   5  77.577   8.897 -16.018
   33    HE2  LYS   5           HE2      LYS   5  75.271   8.755 -15.470
   34    HE3  LYS   5           HE3      LYS   5  75.612   8.430 -13.771
   35    HZ1  LYS   5           HZ1      LYS   5  76.606  10.673 -13.642
   36    HZ2  LYS   5           HZ2      LYS   5  74.945  10.696 -14.004
   37    HZ3  LYS   5           HZ3      LYS   5  76.090  10.970 -15.231
   38    H    GLY   6           H        GLY   6  76.822   4.734 -10.932
   39    HA2  GLY   6           HA2      GLY   6  79.375   4.482  -9.659
   40    HA3  GLY   6           HA3      GLY   6  77.809   4.100  -8.939
   41    H    LYS   7           H        LYS   7  77.034   2.336 -11.097
   42    HA   LYS   7           HA       LYS   7  78.112  -0.113 -10.105
   43    HB2  LYS   7           HB2      LYS   7  75.787   0.233 -11.067
   44    HB3  LYS   7           HB3      LYS   7  76.544   0.274 -12.660
   45    HG2  LYS   7           HG2      LYS   7  77.609  -1.964 -12.079
   46    HG3  LYS   7           HG3      LYS   7  76.543  -2.009 -10.677
   47    HD2  LYS   7           HD2      LYS   7  75.463  -3.229 -12.465
   48    HD3  LYS   7           HD3      LYS   7  74.589  -1.716 -12.231
   49    HE2  LYS   7           HE2      LYS   7  76.816  -1.576 -14.183
   50    HE3  LYS   7           HE3      LYS   7  75.462  -2.597 -14.663
   51    HZ1  LYS   7           HZ1      LYS   7  75.511   0.030 -15.025
   52    HZ2  LYS   7           HZ2      LYS   7  74.766  -0.030 -13.499
   53    HZ3  LYS   7           HZ3      LYS   7  74.078  -0.852 -14.818
   54    H    LYS   8           H        LYS   8  78.495   1.734 -13.129
   55    HA   LYS   8           HA       LYS   8  80.177  -0.077 -14.461
   56    HB2  LYS   8           HB2      LYS   8  79.195   1.784 -15.643
   57    HB3  LYS   8           HB3      LYS   8  80.028   2.940 -14.607
   58    HG2  LYS   8           HG2      LYS   8  81.812   0.982 -15.931
   59    HG3  LYS   8           HG3      LYS   8  80.980   2.072 -17.038
   60    HD2  LYS   8           HD2      LYS   8  82.337   3.168 -14.582
   61    HD3  LYS   8           HD3      LYS   8  83.276   2.811 -16.029
   62    HE2  LYS   8           HE2      LYS   8  81.778   4.262 -17.358
   63    HE3  LYS   8           HE3      LYS   8  80.854   4.633 -15.904
   64    HZ1  LYS   8           HZ1      LYS   8  83.494   5.551 -16.713
   65    HZ2  LYS   8           HZ2      LYS   8  83.287   5.217 -15.060
   66    HZ3  LYS   8           HZ3      LYS   8  82.288   6.354 -15.832
   67    H    ILE   9           H        ILE   9  80.960   2.611 -12.274
   68    HA   ILE   9           HA       ILE   9  83.781   2.303 -12.452
   69    HB   ILE   9           HB       ILE   9  82.096   3.562 -10.277
   70   HG12  ILE   9          HG12      ILE   9  83.582   4.918 -12.539
   71   HG13  ILE   9          HG13      ILE   9  81.889   4.444 -12.679
   72   HG21  ILE   9          HG21      ILE   9  85.050   3.630 -10.923
   73   HG22  ILE   9          HG22      ILE   9  84.285   3.167  -9.405
   74   HG23  ILE   9          HG23      ILE   9  84.269   4.853  -9.920
   75   HD11  ILE   9          HD11      ILE   9  81.327   5.804 -10.709
   76   HD12  ILE   9          HD12      ILE   9  82.109   6.798 -11.938
   77   HD13  ILE   9          HD13      ILE   9  83.022   6.259 -10.529
   78    H    PHE  10           H        PHE  10  81.322   0.667 -10.651
   79    HA   PHE  10           HA       PHE  10  83.124  -0.349  -8.627
   80    HB2  PHE  10           HB2      PHE  10  80.978  -0.195  -7.775
   81    HB3  PHE  10           HB1      PHE  10  80.227  -0.700  -9.289
   82    HD1  PHE  10           HD1      PHE  10  80.130  -3.068  -9.923
   83    HD2  PHE  10           HD2      PHE  10  81.837  -1.832  -6.187
   84    HE1  PHE  10           HE1      PHE  10  80.046  -5.408  -9.118
   85    HE2  PHE  10           HE2      PHE  10  81.761  -4.178  -5.380
   86    HZ   PHE  10           HZ       PHE  10  80.863  -5.965  -6.847
   87    H    VAL  11           H        VAL  11  81.326  -1.821 -11.346
   88    HA   VAL  11           HA       VAL  11  82.292  -4.415 -11.107
   89    HB   VAL  11           HB       VAL  11  81.783  -4.652 -13.519
   90   HG11  VAL  11          HG11      VAL  11  79.685  -2.955 -12.168
   91   HG12  VAL  11          HG12      VAL  11  80.030  -4.606 -11.656
   92   HG13  VAL  11          HG13      VAL  11  79.443  -4.293 -13.290
   93   HG21  VAL  11          HG21      VAL  11  81.360  -1.659 -13.324
   94   HG22  VAL  11          HG22      VAL  11  80.899  -2.651 -14.706
   95   HG23  VAL  11          HG23      VAL  11  82.600  -2.470 -14.278
   96    H    GLN  12           H        GLN  12  83.806  -1.585 -12.504
   97    HA   GLN  12           HA       GLN  12  86.008  -3.220 -13.550
   98    HB2  GLN  12           HB2      GLN  12  86.727  -1.250 -14.696
   99    HB3  GLN  12           HB1      GLN  12  84.982  -1.392 -14.908
  100    HG2  GLN  12           HG2      GLN  12  84.724   0.159 -12.911
  101    HG3  GLN  12           HG1      GLN  12  86.463   0.441 -13.009
  102   HE21  GLN  12          HE21      GLN  12  85.724  -0.093 -16.136
  103   HE22  GLN  12          HE22      GLN  12  85.342   1.480 -16.637
  104    H    LYS  13           H        LYS  13  85.325  -1.083 -10.864
  105    HA   LYS  13           HA       LYS  13  88.202  -0.899 -10.266
  106    HB2  LYS  13           HB2      LYS  13  86.597   1.118 -10.294
  107    HB3  LYS  13           HB3      LYS  13  86.057   0.522  -8.724
  108    HG2  LYS  13           HG2      LYS  13  87.787   1.959  -8.101
  109    HG3  LYS  13           HG3      LYS  13  88.640   0.421  -8.200
  110    HD2  LYS  13           HD2      LYS  13  90.057   1.741  -9.477
  111    HD3  LYS  13           HD3      LYS  13  88.970   1.167 -10.741
  112    HE2  LYS  13           HE2      LYS  13  89.213   3.570 -10.976
  113    HE3  LYS  13           HE3      LYS  13  87.582   3.232 -10.397
  114    HZ1  LYS  13           HZ1      LYS  13  88.023   4.081  -8.358
  115    HZ2  LYS  13           HZ2      LYS  13  89.124   5.016  -9.253
  116    HZ3  LYS  13           HZ3      LYS  13  89.664   3.653  -8.395
  117    H    CYS  14           H        CYS  14  85.285  -1.355  -8.197
  118    HA   CYS  14           HA       CYS  14  86.945  -2.630  -6.201
  119    HB2  CYS  14           HB2      CYS  14  83.965  -2.528  -6.034
  120    HB3  CYS  14           HB1      CYS  14  85.151  -2.422  -4.738
  121    H    ALA  15           H        ALA  15  84.455  -3.783  -8.450
  122    HA   ALA  15           HA       ALA  15  83.926  -6.263  -7.399
  123    HB1  ALA  15           HB1      ALA  15  83.885  -7.010  -9.899
  124    HB2  ALA  15           HB2      ALA  15  84.206  -5.308 -10.226
  125    HB3  ALA  15           HB3      ALA  15  82.750  -5.777  -9.349
  126    H    GLN  16           H        GLN  16  86.886  -5.130  -8.822
  127    HA   GLN  16           HA       GLN  16  88.202  -7.398  -9.606
  128    HB2  GLN  16           HB2      GLN  16  89.237  -5.006  -8.093
  129    HB3  GLN  16           HB1      GLN  16  90.294  -6.259  -8.740
  130    HG2  GLN  16           HG2      GLN  16  89.320  -5.868 -10.999
  131    HG3  GLN  16           HG1      GLN  16  88.356  -4.552 -10.329
  132   HE21  GLN  16          HE21      GLN  16  91.815  -5.490  -9.868
  133   HE22  GLN  16          HE22      GLN  16  92.428  -3.961 -10.277
  134    H    CYS  17           H        CYS  17  88.521  -6.077  -6.281
  135    HA   CYS  17           HA       CYS  17  88.887  -8.867  -5.343
  136    HB2  CYS  17           HB2      CYS  17  90.123  -6.748  -3.704
  137    HB3  CYS  17           HB1      CYS  17  90.764  -8.311  -4.201
  138    H    HIS  18           H        HSD  18  86.327  -7.972  -5.358
  139    HA   HIS  18           HA       HSD  18  85.742  -7.889  -2.507
  140    HB2  HIS  18           HB2      HSD  18  85.127  -5.594  -4.341
  141    HB3  HIS  18           HB1      HSD  18  84.034  -5.967  -3.012
  142    HD1  HIS  18           HD1      HSD  18  84.965  -5.703  -0.580
  143    HD2  HIS  18           HD2      HSD  18  87.636  -4.550  -3.558
  144    HE1  HIS  18           HE1      HSD  18  86.818  -4.420   0.578
  145    H    THR  19           H        THR  19  83.146  -7.600  -2.376
  146    HA   THR  19           HA       THR  19  81.910  -9.279  -4.456
  147    HB   THR  19           HB       THR  19  81.152  -9.862  -1.642
  148    HG1  THR  19           HG1      THR  19  83.071 -11.434  -1.886
  149   HG21  THR  19          HG21      THR  19  80.702 -11.983  -2.504
  150   HG22  THR  19          HG22      THR  19  81.899 -11.822  -3.788
  151   HG23  THR  19          HG23      THR  19  80.373 -10.947  -3.892
  152    H    VAL  20           H        VAL  20  81.460  -7.232  -1.609
  153    HA   VAL  20           HA       VAL  20  79.675  -5.974  -0.889
  154    HB   VAL  20           HB       VAL  20  78.966  -4.301  -2.482
  155   HG11  VAL  20          HG11      VAL  20  81.860  -5.125  -2.861
  156   HG12  VAL  20          HG12      VAL  20  81.229  -4.072  -1.597
  157   HG13  VAL  20          HG13      VAL  20  81.200  -3.545  -3.276
  158   HG21  VAL  20          HG21      VAL  20  80.371  -5.889  -4.628
  159   HG22  VAL  20          HG22      VAL  20  79.347  -4.470  -4.825
  160   HG23  VAL  20          HG23      VAL  20  78.635  -6.010  -4.354
  161    H    GLU  21           H        GLU  21  78.981  -8.739  -1.736
  162    HA   GLU  21           HA       GLU  21  76.119  -8.247  -2.326
  163    HB2  GLU  21           HB2      GLU  21  75.993 -10.156  -3.678
  164    HB3  GLU  21           HB3      GLU  21  77.536  -9.443  -4.141
  165    HG2  GLU  21           HG2      GLU  21  78.602 -10.968  -2.384
  166    HG3  GLU  21           HG3      GLU  21  77.053 -11.809  -2.325
  167    H    LYS  22           H        LYS  22  74.873  -8.703  -0.652
  168    HA   LYS  22           HA       LYS  22  75.724  -9.824   1.745
  169    HB2  LYS  22           HB2      LYS  22  73.601  -8.481   1.289
  170    HB3  LYS  22           HB3      LYS  22  72.883  -9.993   0.738
  171    HG2  LYS  22           HG2      LYS  22  72.280 -10.024   2.986
  172    HG3  LYS  22           HG3      LYS  22  73.799 -10.917   3.042
  173    HD2  LYS  22           HD2      LYS  22  75.009  -8.916   3.717
  174    HD3  LYS  22           HD3      LYS  22  73.558  -7.931   3.522
  175    HE2  LYS  22           HE2      LYS  22  73.834 -10.237   5.471
  176    HE3  LYS  22           HE3      LYS  22  73.973  -8.533   5.901
  177    HZ1  LYS  22           HZ1      LYS  22  71.595  -9.969   4.880
  178    HZ2  LYS  22           HZ2      LYS  22  71.701  -8.273   4.879
  179    HZ3  LYS  22           HZ3      LYS  22  71.763  -9.129   6.345
  180    H    GLY  23           H        GLY  23  75.801 -11.843   2.587
  181    HA2  GLY  23           HA2      GLY  23  75.788 -14.140   2.700
  182    HA3  GLY  23           HA3      GLY  23  74.458 -14.110   1.547
  183    H    GLY  24           H        GLY  24  77.509 -12.610   0.771
  184    HA2  GLY  24           HA2      GLY  24  77.866 -14.496  -1.436
  185    HA3  GLY  24           HA3      GLY  24  78.729 -12.979  -1.206
  186    H    LYS  25           H        LYS  25  80.803 -13.694  -1.338
  187    HA   LYS  25           HA       LYS  25  81.810 -15.195   0.947
  188    HB2  LYS  25           HB2      LYS  25  83.180 -16.641  -0.714
  189    HB3  LYS  25           HB3      LYS  25  81.501 -17.082  -0.410
  190    HG2  LYS  25           HG2      LYS  25  80.764 -16.219  -2.471
  191    HG3  LYS  25           HG3      LYS  25  82.199 -15.213  -2.670
  192    HD2  LYS  25           HD2      LYS  25  83.573 -17.283  -2.913
  193    HD3  LYS  25           HD3      LYS  25  82.095 -18.240  -2.826
  194    HE2  LYS  25           HE2      LYS  25  81.357 -17.543  -4.913
  195    HE3  LYS  25           HE3      LYS  25  82.236 -16.016  -4.833
  196    HZ1  LYS  25           HZ1      LYS  25  84.246 -17.068  -5.318
  197    HZ2  LYS  25           HZ2      LYS  25  83.135 -17.793  -6.379
  198    HZ3  LYS  25           HZ3      LYS  25  83.639 -18.615  -4.980
  199    H    HIS  26           H        HIS  26  83.316 -13.837   1.674
  200    HA   HIS  26           HA       HIS  26  84.577 -11.814   0.243
  201    HB2  HIS  26           HB2      HIS  26  86.397 -12.128   2.113
  202    HB3  HIS  26           HB1      HIS  26  84.779 -11.578   2.543
  203    HD1  HIS  26           HD1      HIS  26  86.987 -14.634   2.635
  204    HD2  HIS  26           HD2      HIS  26  83.256 -13.425   4.050
  205    HE1  HIS  26           HE1      HIS  26  86.223 -16.422   4.258
  206    HE2  HIS  26           HE2      HIS  26  83.951 -15.697   5.133
  207    H    LYS  27           H        LYS  27  85.965 -11.876  -1.364
  208    HA   LYS  27           HA       LYS  27  87.953 -14.062  -1.485
  209    HB2  LYS  27           HB2      LYS  27  87.654 -14.266  -3.866
  210    HB3  LYS  27           HB3      LYS  27  86.068 -14.428  -3.112
  211    HG2  LYS  27           HG2      LYS  27  85.883 -11.853  -3.488
  212    HG3  LYS  27           HG3      LYS  27  87.198 -12.088  -4.640
  213    HD2  LYS  27           HD2      LYS  27  85.722 -13.992  -5.612
  214    HD3  LYS  27           HD3      LYS  27  84.408 -13.231  -4.714
  215    HE2  LYS  27           HE2      LYS  27  84.312 -12.223  -6.855
  216    HE3  LYS  27           HE3      LYS  27  85.146 -11.036  -5.853
  217    HZ1  LYS  27           HZ1      LYS  27  86.645 -13.078  -7.371
  218    HZ2  LYS  27           HZ2      LYS  27  87.193 -11.588  -6.762
  219    HZ3  LYS  27           HZ3      LYS  27  86.155 -11.630  -8.107
  220    H    THR  28           H        THR  28  89.954 -13.280  -1.509
  221    HA   THR  28           HA       THR  28  91.680 -11.757  -1.579
  222    HB   THR  28           HB       THR  28  90.411 -10.641  -4.068
  223    HG1  THR  28           HG1      THR  28  91.063 -12.462  -5.159
  224   HG21  THR  28          HG21      THR  28  93.246 -11.373  -3.276
  225   HG22  THR  28          HG22      THR  28  92.579  -9.742  -3.344
  226   HG23  THR  28          HG23      THR  28  92.771 -10.678  -4.826
  227    H    GLY  29           H        GLY  29  89.145 -10.984  -0.249
  228    HA2  GLY  29           HA2      GLY  29  89.752  -8.460   0.654
  229    HA3  GLY  29           HA3      GLY  29  88.680  -8.198  -0.717
  230    HA   PRO  30           HA       PRO  30  86.313  -9.541   3.209
  231    HB2  PRO  30           HB2      PRO  30  85.714  -7.153   4.369
  232    HB3  PRO  30           HB1      PRO  30  87.200  -8.049   4.740
  233    HG2  PRO  30           HG2      PRO  30  86.805  -5.703   2.944
  234    HG3  PRO  30           HG1      PRO  30  88.130  -6.056   4.066
  235    HD2  PRO  30           HD2      PRO  30  88.296  -6.478   1.350
  236    HD3  PRO  30           HD1      PRO  30  89.240  -7.391   2.549
  237    H    ASN  31           H        ASN  31  83.998  -8.808   3.787
  238    HA   ASN  31           HA       ASN  31  82.613  -8.085   1.285
  239    HB2  ASN  31           HB2      ASN  31  80.693  -9.198   2.184
  240    HB3  ASN  31           HB1      ASN  31  82.075 -10.251   2.474
  241   HD21  ASN  31          HD21      ASN  31  82.667 -10.680   4.663
  242   HD22  ASN  31          HD22      ASN  31  81.806 -10.064   5.990
  243    H    LEU  32           H        LEU  32  81.782  -6.122   1.093
  244    HA   LEU  32           HA       LEU  32  81.742  -4.291   3.319
  245    HB2  LEU  32           HB2      LEU  32  80.537  -3.741   0.619
  246    HB3  LEU  32           HB3      LEU  32  81.279  -2.611   1.745
  247    HG   LEU  32           HG       LEU  32  82.653  -4.689   0.032
  248   HD11  LEU  32          HD11      LEU  32  83.513  -1.839   0.264
  249   HD12  LEU  32          HD12      LEU  32  81.999  -2.151  -0.582
  250   HD13  LEU  32          HD13      LEU  32  83.493  -2.896  -1.147
  251   HD21  LEU  32          HD21      LEU  32  83.621  -3.197   2.465
  252   HD22  LEU  32          HD22      LEU  32  84.745  -3.674   1.197
  253   HD23  LEU  32          HD23      LEU  32  83.825  -4.901   2.066
  254    H    HIS  33           H        HIS  33  79.911  -6.604   3.481
  255    HA   HIS  33           HA       HIS  33  77.245  -5.895   2.940
  256    HB2  HIS  33           HB2      HIS  33  78.330  -7.592   5.204
  257    HB3  HIS  33           HB1      HIS  33  76.650  -7.549   4.672
  258    HD1  HIS  33           HD1      HIS  33  77.933 -10.235   4.458
  259    HD2  HIS  33           HD2      HIS  33  78.254  -7.419   1.401
  260    HE1  HIS  33           HE1      HIS  33  78.472 -11.527   2.350
  261    HE2  HIS  33           HE2      HIS  33  78.667  -9.826   0.474
  262    H    GLY  34           H        GLY  34  75.778  -4.604   3.978
  263    HA2  GLY  34           HA2      GLY  34  75.198  -2.731   5.250
  264    HA3  GLY  34           HA3      GLY  34  75.507  -3.863   6.565
  265    H    LEU  35           H        LEU  35  78.013  -2.847   4.395
  266    HA   LEU  35           HA       LEU  35  79.972  -2.237   6.167
  267    HB2  LEU  35           HB2      LEU  35  80.376  -2.283   3.795
  268    HB3  LEU  35           HB3      LEU  35  79.320  -0.901   3.535
  269    HG   LEU  35           HG       LEU  35  81.022   0.262   5.239
  270   HD11  LEU  35          HD11      LEU  35  82.895  -1.596   3.803
  271   HD12  LEU  35          HD12      LEU  35  82.224  -2.055   5.365
  272   HD13  LEU  35          HD13      LEU  35  83.204  -0.595   5.218
  273   HD21  LEU  35          HD21      LEU  35  81.785  -0.245   2.351
  274   HD22  LEU  35          HD22      LEU  35  82.202   1.163   3.327
  275   HD23  LEU  35          HD23      LEU  35  80.528   0.887   2.848
  276    H    PHE  36           H        PHE  36  77.801   0.209   4.765
  277    HA   PHE  36           HA       PHE  36  78.663   2.389   6.249
  278    HB2  PHE  36           HB2      PHE  36  75.791   1.948   5.425
  279    HB3  PHE  36           HB1      PHE  36  76.642   3.481   5.606
  280    HD1  PHE  36           HD2      PHE  36  76.491   0.351   3.587
  281    HD2  PHE  36           HD1      PHE  36  77.961   4.384   3.825
  282    HE1  PHE  36           HE2      PHE  36  77.230   0.224   1.228
  283    HE2  PHE  36           HE1      PHE  36  78.687   4.256   1.467
  284    HZ   PHE  36           HZ       PHE  36  78.326   2.178   0.163
  285    H    GLY  37           H        GLY  37  79.040   1.903   8.432
  286    HA2  GLY  37           HA2      GLY  37  77.554   2.616  10.427
  287    HA3  GLY  37           HA3      GLY  37  76.686   1.140  10.042
  288    H    ARG  38           H        ARG  38  79.294  -0.225   9.320
  289    HA   ARG  38           HA       ARG  38  79.877  -1.111  12.030
  290    HB2  ARG  38           HB2      ARG  38  80.317  -2.140   9.301
  291    HB3  ARG  38           HB3      ARG  38  81.596  -2.522  10.452
  292    HG2  ARG  38           HG2      ARG  38  79.725  -3.299  12.035
  293    HG3  ARG  38           HG3      ARG  38  78.660  -3.225  10.631
  294    HD2  ARG  38           HD2      ARG  38  81.258  -4.688  10.353
  295    HD3  ARG  38           HD3      ARG  38  79.965  -5.463  11.258
  296    HE   ARG  38           HE       ARG  38  78.612  -4.852   9.088
  297   HH11  ARG  38          HH21      ARG  38  81.906  -5.939   9.333
  298   HH12  ARG  38          HH22      ARG  38  81.899  -6.711   7.784
  299   HH21  ARG  38          HH11      ARG  38  78.614  -5.887   7.075
  300   HH22  ARG  38          HH12      ARG  38  80.043  -6.690   6.517
  301    H    LYS  39           H        LYS  39  81.979  -1.281  12.922
  302    HA   LYS  39           HA       LYS  39  83.588   1.073  12.509
  303    HB2  LYS  39           HB2      LYS  39  83.103   0.117  14.754
  304    HB3  LYS  39           HB3      LYS  39  84.053  -1.299  14.325
  305    HG2  LYS  39           HG2      LYS  39  85.580   0.036  15.515
  306    HG3  LYS  39           HG3      LYS  39  85.969   0.389  13.840
  307    HD2  LYS  39           HD2      LYS  39  85.866   2.475  15.096
  308    HD3  LYS  39           HD3      LYS  39  84.516   2.421  13.969
  309    HE2  LYS  39           HE2      LYS  39  82.951   2.228  15.645
  310    HE3  LYS  39           HE3      LYS  39  84.024   1.289  16.683
  311    HZ1  LYS  39           HZ1      LYS  39  85.067   3.170  17.461
  312    HZ2  LYS  39           HZ2      LYS  39  83.464   3.713  17.303
  313    HZ3  LYS  39           HZ3      LYS  39  84.621   4.116  16.125
  314    H    THR  40           H        THR  40  85.855   1.082  12.032
  315    HA   THR  40           HA       THR  40  86.620  -0.368   9.790
  316    HB   THR  40           HB       THR  40  88.994   0.361  10.521
  317    HG1  THR  40           HG1      THR  40  87.372   1.730  12.402
  318   HG21  THR  40          HG21      THR  40  87.747   1.606   8.870
  319   HG22  THR  40          HG22      THR  40  88.420   2.759  10.021
  320   HG23  THR  40          HG23      THR  40  86.717   2.313  10.113
  321    H    GLY  41           H        GLY  41  87.897  -2.127   9.403
  322    HA2  GLY  41           HA2      GLY  41  88.641  -4.271   9.752
  323    HA3  GLY  41           HA3      GLY  41  89.494  -3.566  11.122
  324    H    GLN  42           H        GLN  42  86.052  -4.188  10.448
  325    HA   GLN  42           HA       GLN  42  85.931  -5.713  12.988
  326    HB2  GLN  42           HB2      GLN  42  84.705  -3.433  12.813
  327    HB3  GLN  42           HB1      GLN  42  83.556  -4.302  11.795
  328    HG2  GLN  42           HG2      GLN  42  83.457  -6.041  13.691
  329    HG3  GLN  42           HG1      GLN  42  84.265  -4.830  14.684
  330   HE21  GLN  42          HE21      GLN  42  81.279  -5.478  12.842
  331   HE22  GLN  42          HE22      GLN  42  80.356  -4.281  13.611
  332    H    ALA  43           H        ALA  43  85.545  -5.824   9.618
  333    HA   ALA  43           HA       ALA  43  83.453  -7.732   9.422
  334    HB1  ALA  43           HB1      ALA  43  84.981  -8.202   7.203
  335    HB2  ALA  43           HB2      ALA  43  85.472  -6.563   7.633
  336    HB3  ALA  43           HB3      ALA  43  83.774  -6.922   7.332
  337    HA   PRO  44           HA       PRO  44  86.024 -11.115  10.936
  338    HB2  PRO  44           HB2      PRO  44  84.060 -12.953  11.217
  339    HB3  PRO  44           HB1      PRO  44  84.226 -11.583  12.333
  340    HG2  PRO  44           HG2      PRO  44  82.349 -11.939  10.044
  341    HG3  PRO  44           HG1      PRO  44  82.053 -11.247  11.649
  342    HD2  PRO  44           HD2      PRO  44  82.505  -9.739   9.376
  343    HD3  PRO  44           HD1      PRO  44  82.815  -9.164  11.031
  344    H    GLY  45           H        GLY  45  87.323 -12.073   9.455
  345    HA2  GLY  45           HA2      GLY  45  86.836 -14.288   7.995
  346    HA3  GLY  45           HA3      GLY  45  86.285 -13.014   6.911
  347    H    PHE  46           H        PHE  46  87.833 -11.357   6.287
  348    HA   PHE  46           HA       PHE  46  90.369 -12.475   5.598
  349    HB2  PHE  46           HB2      PHE  46  88.948 -10.688   4.345
  350    HB3  PHE  46           HB1      PHE  46  89.738  -9.539   5.423
  351    HD1  PHE  46           HD2      PHE  46  90.227 -11.943   2.677
  352    HD2  PHE  46           HD1      PHE  46  92.148  -9.138   5.302
  353    HE1  PHE  46           HE2      PHE  46  92.251 -11.991   1.245
  354    HE2  PHE  46           HE1      PHE  46  94.172  -9.186   3.872
  355    HZ   PHE  46           HZ       PHE  46  94.224 -10.611   1.843
  356    H    THR  47           H        THR  47  92.454 -11.700   6.198
  357    HA   THR  47           HA       THR  47  92.683 -11.113   9.008
  358    HB   THR  47           HB       THR  47  94.877 -11.162   6.929
  359    HG1  THR  47           HG1      THR  47  93.686 -13.094   6.914
  360   HG21  THR  47          HG21      THR  47  96.268 -11.764   8.883
  361   HG22  THR  47          HG22      THR  47  94.855 -11.613   9.927
  362   HG23  THR  47          HG23      THR  47  95.497 -10.193   9.101
  363    H    TYR  48           H        TYR  48  91.627  -9.053   9.105
  364    HA   TYR  48           HA       TYR  48  92.376  -6.783   7.634
  365    HB2  TYR  48           HB2      TYR  48  90.974  -7.270  10.220
  366    HB3  TYR  48           HB3      TYR  48  91.534  -5.631   9.895
  367    HD1  TYR  48           HD1      TYR  48  90.667  -4.344   8.024
  368    HD2  TYR  48           HD2      TYR  48  89.250  -8.315   8.829
  369    HE1  TYR  48           HE1      TYR  48  88.748  -3.962   6.514
  370    HE2  TYR  48           HE2      TYR  48  87.324  -7.935   7.313
  371    HH   TYR  48           HH       TYR  48  86.433  -4.874   6.227
  372    H    THR  49           H        THR  49  93.662  -4.985   8.204
  373    HA   THR  49           HA       THR  49  96.139  -5.736   9.529
  374    HB   THR  49           HB       THR  49  96.984  -3.611   8.703
  375    HG1  THR  49           HG1      THR  49  94.935  -2.516   9.104
  376   HG21  THR  49          HG21      THR  49  95.255  -5.135   6.741
  377   HG22  THR  49          HG22      THR  49  96.972  -5.375   7.068
  378   HG23  THR  49          HG23      THR  49  96.426  -3.910   6.252
  379    H    ASP  50           H        ASP  50  97.074  -4.575  11.276
  380    HA   ASP  50           HA       ASP  50  95.480  -4.119  13.472
  381    HB2  ASP  50           HB2      ASP  50  97.994  -2.523  13.065
  382    HB3  ASP  50           HB1      ASP  50  97.368  -3.247  14.545
  383    H    ALA  51           H        ALA  51  96.540  -1.771  11.036
  384    HA   ALA  51           HA       ALA  51  95.646   0.580  12.208
  385    HB1  ALA  51           HB1      ALA  51  95.608  -0.233   9.294
  386    HB2  ALA  51           HB2      ALA  51  96.902   0.613  10.142
  387    HB3  ALA  51           HB3      ALA  51  95.354   1.414   9.873
  388    H    ASN  52           H        ASN  52  93.820  -1.505   9.950
  389    HA   ASN  52           HA       ASN  52  91.357  -0.128  10.308
  390    HB2  ASN  52           HB2      ASN  52  92.178  -2.767   9.142
  391    HB3  ASN  52           HB1      ASN  52  90.469  -2.454   9.431
  392   HD21  ASN  52          HD21      ASN  52  90.188  -2.469   7.036
  393   HD22  ASN  52          HD22      ASN  52  90.610  -1.088   6.139
  394    H    LYS  53           H        LYS  53  93.023  -2.594  12.067
  395    HA   LYS  53           HA       LYS  53  90.747  -3.492  13.587
  396    HB2  LYS  53           HB2      LYS  53  93.136  -4.613  12.969
  397    HB3  LYS  53           HB3      LYS  53  93.508  -3.973  14.569
  398    HG2  LYS  53           HG2      LYS  53  91.399  -5.071  15.395
  399    HG3  LYS  53           HG3      LYS  53  91.280  -5.866  13.824
  400    HD2  LYS  53           HD2      LYS  53  93.687  -6.675  14.235
  401    HD3  LYS  53           HD3      LYS  53  93.446  -6.175  15.909
  402    HE2  LYS  53           HE2      LYS  53  92.862  -8.497  15.814
  403    HE3  LYS  53           HE3      LYS  53  91.341  -7.609  15.908
  404    HZ1  LYS  53           HZ1      LYS  53  90.818  -8.087  13.767
  405    HZ2  LYS  53           HZ2      LYS  53  91.754  -9.464  14.107
  406    HZ3  LYS  53           HZ3      LYS  53  92.433  -8.161  13.254
  407    H    ASN  54           H        ASN  54  92.956  -0.910  13.678
  408    HA   ASN  54           HA       ASN  54  93.154  -0.472  16.461
  409    HB2  ASN  54           HB2      ASN  54  94.265   1.440  15.882
  410    HB3  ASN  54           HB1      ASN  54  94.375   0.593  14.345
  411   HD21  ASN  54          HD21      ASN  54  91.636   1.001  13.486
  412   HD22  ASN  54          HD22      ASN  54  91.433   2.658  13.184
  413    H    LYS  55           H        LYS  55  90.615  -0.019  14.241
  414    HA   LYS  55           HA       LYS  55  88.476   0.823  14.445
  415    HB2  LYS  55           HB2      LYS  55  89.019   0.855  17.421
  416    HB3  LYS  55           HB3      LYS  55  87.452   0.785  16.620
  417    HG2  LYS  55           HG2      LYS  55  88.438  -1.399  15.517
  418    HG3  LYS  55           HG3      LYS  55  89.532  -1.362  16.899
  419    HD2  LYS  55           HD2      LYS  55  87.412  -1.079  18.342
  420    HD3  LYS  55           HD3      LYS  55  86.521  -1.583  16.906
  421    HE2  LYS  55           HE2      LYS  55  86.872  -3.638  17.941
  422    HE3  LYS  55           HE3      LYS  55  88.282  -3.559  16.886
  423    HZ1  LYS  55           HZ1      LYS  55  89.673  -3.188  18.615
  424    HZ2  LYS  55           HZ2      LYS  55  88.474  -4.044  19.461
  425    HZ3  LYS  55           HZ3      LYS  55  88.518  -2.347  19.530
  426    H    GLY  56           H        GLY  56  89.845   2.746  13.530
  427    HA2  GLY  56           HA2      GLY  56  90.085   5.003  15.349
  428    HA3  GLY  56           HA3      GLY  56  90.507   4.986  13.640
  429    H    ILE  57           H        ILE  57  88.076   4.073  12.568
  430    HA   ILE  57           HA       ILE  57  86.019   5.947  13.484
  431    HB   ILE  57           HB       ILE  57  85.741   6.928  11.256
  432   HG12  ILE  57          HG12      ILE  57  87.953   6.499   9.779
  433   HG13  ILE  57          HG13      ILE  57  87.894   4.946  10.609
  434   HG21  ILE  57          HG21      ILE  57  87.631   8.400  11.346
  435   HG22  ILE  57          HG22      ILE  57  88.632   7.170  12.116
  436   HG23  ILE  57          HG23      ILE  57  87.300   7.906  13.006
  437   HD11  ILE  57          HD11      ILE  57  85.781   4.404   9.693
  438   HD12  ILE  57          HD12      ILE  57  86.641   5.154   8.354
  439   HD13  ILE  57          HD13      ILE  57  85.442   6.078   9.254
  440    H    THR  58           H        THR  58  84.112   5.750  11.735
  441    HA   THR  58           HA       THR  58  83.692   2.853  11.300
  442    HB   THR  58           HB       THR  58  81.916   4.980  12.428
  443    HG1  THR  58           HG1      THR  58  81.873   2.250  13.023
  444   HG21  THR  58          HG21      THR  58  80.028   3.232  12.005
  445   HG22  THR  58          HG22      THR  58  81.063   2.672  10.694
  446   HG23  THR  58          HG23      THR  58  80.470   4.330  10.700
  447    H    TRP  59           H        TRP  59  82.848   2.184   9.383
  448    HA   TRP  59           HA       TRP  59  83.166   3.830   7.104
  449    HB2  TRP  59           HB2      TRP  59  81.406   1.387   7.159
  450    HB3  TRP  59           HB1      TRP  59  82.400   2.001   5.838
  451    HD1  TRP  59           HD1      TRP  59  85.129   2.392   7.271
  452    HE1  TRP  59           HE1      TRP  59  86.486   0.350   8.084
  453    HE3  TRP  59           HE3      TRP  59  81.415  -1.093   7.569
  454    HZ2  TRP  59           HZ2      TRP  59  86.042  -2.379   8.808
  455    HZ3  TRP  59           HZ3      TRP  59  81.908  -3.402   8.318
  456    HH2  TRP  59           HH2      TRP  59  84.215  -4.047   8.936
  457    H    LYS  60           H        LYS  60  81.767   5.047   5.960
  458    HA   LYS  60           HA       LYS  60  78.904   4.936   6.431
  459    HB2  LYS  60           HB2      LYS  60  80.537   7.383   7.159
  460    HB3  LYS  60           HB3      LYS  60  78.783   7.377   6.984
  461    HG2  LYS  60           HG2      LYS  60  78.772   5.462   8.692
  462    HG3  LYS  60           HG3      LYS  60  80.453   5.885   9.013
  463    HD2  LYS  60           HD2      LYS  60  78.310   8.004   9.090
  464    HD3  LYS  60           HD3      LYS  60  78.594   6.967  10.486
  465    HE2  LYS  60           HE2      LYS  60  80.718   8.635   9.110
  466    HE3  LYS  60           HE3      LYS  60  79.905   9.073  10.611
  467    HZ1  LYS  60           HZ1      LYS  60  81.850   8.043  11.302
  468    HZ2  LYS  60           HZ2      LYS  60  81.768   6.839  10.107
  469    HZ3  LYS  60           HZ3      LYS  60  80.698   6.805  11.426
  470    H    GLU  61           H        GLU  61  78.305   7.441   5.252
  471    HA   GLU  61           HA       GLU  61  78.796   6.791   2.493
  472    HB2  GLU  61           HB2      GLU  61  76.648   7.752   3.291
  473    HB3  GLU  61           HB3      GLU  61  77.492   9.251   3.682
  474    HG2  GLU  61           HG2      GLU  61  78.150   9.523   1.337
  475    HG3  GLU  61           HG3      GLU  61  77.379   7.992   0.926
  476    H    GLU  62           H        GLU  62  79.487   9.708   4.447
  477    HA   GLU  62           HA       GLU  62  81.219  10.842   2.492
  478    HB2  GLU  62           HB2      GLU  62  81.096  11.453   5.453
  479    HB3  GLU  62           HB3      GLU  62  81.745  12.493   4.185
  480    HG2  GLU  62           HG2      GLU  62  79.483  12.524   3.118
  481    HG3  GLU  62           HG3      GLU  62  78.862  11.608   4.490
  482    H    THR  63           H        THR  63  81.806   9.007   5.476
  483    HA   THR  63           HA       THR  63  84.581   9.220   5.587
  484    HB   THR  63           HB       THR  63  84.539   7.095   6.821
  485    HG1  THR  63           HG1      THR  63  82.193   6.325   7.001
  486   HG21  THR  63          HG21      THR  63  83.873   9.052   8.050
  487   HG22  THR  63          HG22      THR  63  82.785   7.739   8.500
  488   HG23  THR  63          HG23      THR  63  82.247   8.984   7.372
  489    H    LEU  64           H        LEU  64  82.519   7.136   3.650
  490    HA   LEU  64           HA       LEU  64  84.604   5.508   2.607
  491    HB2  LEU  64           HB2      LEU  64  81.741   5.845   2.186
  492    HB3  LEU  64           HB3      LEU  64  82.589   5.555   0.675
  493    HG   LEU  64           HG       LEU  64  82.958   3.841   3.147
  494   HD11  LEU  64          HD11      LEU  64  80.876   3.847   1.045
  495   HD12  LEU  64          HD12      LEU  64  80.837   3.157   2.665
  496   HD13  LEU  64          HD13      LEU  64  81.616   2.277   1.351
  497   HD21  LEU  64          HD21      LEU  64  83.943   3.775   0.303
  498   HD22  LEU  64          HD22      LEU  64  83.681   2.251   1.149
  499   HD23  LEU  64          HD23      LEU  64  84.820   3.430   1.793
  500    H    MET  65           H        MET  65  83.125   8.561   1.594
  501    HA   MET  65           HA       MET  65  84.233   8.745  -0.974
  502    HB2  MET  65           HB2      MET  65  83.701  10.977   0.998
  503    HB3  MET  65           HB1      MET  65  83.969  11.184  -0.733
  504    HG2  MET  65           HG2      MET  65  81.983   9.929  -1.264
  505    HG3  MET  65           HG1      MET  65  81.769   9.460   0.420
  506    HE1  MET  65           HE1      MET  65  80.121  12.984  -1.707
  507    HE2  MET  65           HE2      MET  65  80.175  11.260  -2.066
  508    HE3  MET  65           HE3      MET  65  81.635  12.232  -2.230
  509    H    GLU  66           H        GLU  66  85.510  10.179   2.039
  510    HA   GLU  66           HA       GLU  66  87.942  11.072   0.960
  511    HB2  GLU  66           HB2      GLU  66  87.267  10.193   3.777
  512    HB3  GLU  66           HB3      GLU  66  88.744  11.042   3.325
  513    HG2  GLU  66           HG2      GLU  66  86.454  12.439   2.237
  514    HG3  GLU  66           HG3      GLU  66  86.225  12.189   3.965
  515    H    TYR  67           H        TYR  67  86.901   7.951   2.105
  516    HA   TYR  67           HA       TYR  67  89.539   6.784   2.166
  517    HB2  TYR  67           HB2      TYR  67  87.905   5.850   3.641
  518    HB3  TYR  67           HB3      TYR  67  86.750   5.648   2.330
  519    HD1  TYR  67           HD2      TYR  67  87.005   3.866   0.669
  520    HD2  TYR  67           HD1      TYR  67  89.785   4.315   3.913
  521    HE1  TYR  67           HE2      TYR  67  87.891   1.593   0.225
  522    HE2  TYR  67           HE1      TYR  67  90.669   2.041   3.470
  523    HH   TYR  67           HH       TYR  67  90.553   0.487   0.946
  524    H    LEU  68           H        LEU  68  87.004   7.206  -0.176
  525    HA   LEU  68           HA       LEU  68  87.947   5.171  -1.974
  526    HB2  LEU  68           HB2      LEU  68  85.856   7.316  -2.079
  527    HB3  LEU  68           HB3      LEU  68  86.364   6.542  -3.574
  528    HG   LEU  68           HG       LEU  68  85.337   5.091  -1.117
  529   HD11  LEU  68          HD11      LEU  68  83.320   4.732  -2.314
  530   HD12  LEU  68          HD12      LEU  68  84.015   5.321  -3.823
  531   HD13  LEU  68          HD13      LEU  68  83.671   6.449  -2.513
  532   HD21  LEU  68          HD21      LEU  68  86.648   4.212  -3.616
  533   HD22  LEU  68          HD22      LEU  68  85.162   3.358  -3.218
  534   HD23  LEU  68          HD23      LEU  68  86.495   3.387  -2.067
  535    H    GLU  69           H        GLU  69  88.738   8.502  -1.412
  536    HA   GLU  69           HA       GLU  69  90.098   8.689  -4.017
  537    HB2  GLU  69           HB2      GLU  69  90.534  11.070  -3.262
  538    HB3  GLU  69           HB3      GLU  69  88.843  10.649  -3.534
  539    HG2  GLU  69           HG2      GLU  69  88.323  10.696  -1.284
  540    HG3  GLU  69           HG3      GLU  69  89.954  10.255  -0.789
  541    H    ASN  70           H        ASN  70  90.724   7.725  -0.892
  542    HA   ASN  70           HA       ASN  70  93.526   7.461  -1.377
  543    HB2  ASN  70           HB2      ASN  70  94.345   8.878   0.439
  544    HB3  ASN  70           HB1      ASN  70  93.500   9.844  -0.763
  545   HD21  ASN  70          HD21      ASN  70  93.257   8.526   2.531
  546   HD22  ASN  70          HD22      ASN  70  91.957   9.509   3.006
  547    HA   PRO  71           HA       PRO  71  91.225   4.494   1.480
  548    HB2  PRO  71           HB2      PRO  71  93.017   2.696  -0.099
  549    HB3  PRO  71           HB1      PRO  71  91.325   2.465   0.376
  550    HG2  PRO  71           HG2      PRO  71  91.995   3.123  -2.117
  551    HG3  PRO  71           HG1      PRO  71  90.524   3.749  -1.353
  552    HD2  PRO  71           HD2      PRO  71  93.092   5.160  -1.926
  553    HD3  PRO  71           HD1      PRO  71  91.437   5.805  -1.859
  554    H    LYS  72           H        LYS  72  94.628   4.743   0.520
  555    HA   LYS  72           HA       LYS  72  95.614   3.401   2.869
  556    HB2  LYS  72           HB2      LYS  72  96.799   3.400   0.678
  557    HB3  LYS  72           HB3      LYS  72  97.115   5.120   0.888
  558    HG2  LYS  72           HG2      LYS  72  98.922   4.643   2.152
  559    HG3  LYS  72           HG3      LYS  72  97.888   3.816   3.315
  560    HD2  LYS  72           HD2      LYS  72  98.878   2.481   0.785
  561    HD3  LYS  72           HD3      LYS  72  99.764   2.413   2.307
  562    HE2  LYS  72           HE2      LYS  72  96.925   1.444   1.853
  563    HE3  LYS  72           HE3      LYS  72  98.347   0.430   2.089
  564    HZ1  LYS  72           HZ1      LYS  72  97.015   2.207   4.035
  565    HZ2  LYS  72           HZ2      LYS  72  98.621   1.700   4.257
  566    HZ3  LYS  72           HZ3      LYS  72  97.370   0.555   4.179
  567    H    LYS  73           H        LYS  73  95.596   6.793   1.754
  568    HA   LYS  73           HA       LYS  73  96.924   7.824   4.019
  569    HB2  LYS  73           HB2      LYS  73  96.320   8.891   1.662
  570    HB3  LYS  73           HB3      LYS  73  94.942   9.521   2.564
  571    HG2  LYS  73           HG2      LYS  73  96.572  10.370   4.297
  572    HG3  LYS  73           HG3      LYS  73  97.878   9.907   3.206
  573    HD2  LYS  73           HD2      LYS  73  97.586  12.122   2.573
  574    HD3  LYS  73           HD3      LYS  73  96.478  11.331   1.453
  575    HE2  LYS  73           HE2      LYS  73  94.595  11.780   2.965
  576    HE3  LYS  73           HE3      LYS  73  95.692  12.525   4.129
  577    HZ1  LYS  73           HZ1      LYS  73  94.777  14.281   2.902
  578    HZ2  LYS  73           HZ2      LYS  73  94.978  13.478   1.419
  579    HZ3  LYS  73           HZ3      LYS  73  96.331  14.070   2.260
  580    H    TYR  74           H        TYR  74  93.559   7.024   3.455
  581    HA   TYR  74           HA       TYR  74  92.463   8.559   5.576
  582    HB2  TYR  74           HB2      TYR  74  91.323   7.243   3.576
  583    HB3  TYR  74           HB3      TYR  74  91.227   5.953   4.773
  584    HD1  TYR  74           HD1      TYR  74  90.701   9.680   4.649
  585    HD2  TYR  74           HD2      TYR  74  89.256   5.871   6.020
  586    HE1  TYR  74           HE1      TYR  74  88.746  10.794   5.687
  587    HE2  TYR  74           HE2      TYR  74  87.302   6.989   7.059
  588    HH   TYR  74           HH       TYR  74  86.270   8.911   7.435
  589    H    ILE  75           H        ILE  75  93.183   5.064   5.407
  590    HA   ILE  75           HA       ILE  75  93.674   5.114   8.327
  591    HB   ILE  75           HB       ILE  75  92.324   2.897   6.764
  592   HG12  ILE  75          HG12      ILE  75  91.115   4.604   8.946
  593   HG13  ILE  75          HG13      ILE  75  91.029   5.086   7.254
  594   HG21  ILE  75          HG21      ILE  75  91.880   2.144   9.218
  595   HG22  ILE  75          HG22      ILE  75  93.218   3.216   9.631
  596   HG23  ILE  75          HG23      ILE  75  93.482   1.856   8.541
  597   HD11  ILE  75          HD11      ILE  75  89.898   3.001   6.676
  598   HD12  ILE  75          HD12      ILE  75  89.020   3.802   7.979
  599   HD13  ILE  75          HD13      ILE  75  90.062   2.424   8.335
  600    HA   PRO  76           HA       PRO  76  97.473   3.910   5.803
  601    HB2  PRO  76           HB2      PRO  76  98.450   4.707   8.530
  602    HB3  PRO  76           HB1      PRO  76  99.183   5.006   6.941
  603    HG2  PRO  76           HG2      PRO  76  97.833   6.910   8.230
  604    HG3  PRO  76           HG1      PRO  76  97.771   6.754   6.465
  605    HD2  PRO  76           HD2      PRO  76  95.665   6.154   8.466
  606    HD3  PRO  76           HD1      PRO  76  95.500   6.535   6.740
  607    H    GLY  77           H        GLY  77  98.317   1.895   5.786
  608    HA2  GLY  77           HA2      GLY  77  99.277  -0.018   6.907
  609    HA3  GLY  77           HA3      GLY  77  98.146   0.240   8.231
  610    H    THR  78           H        THR  78  95.946   0.802   6.295
  611    HA   THR  78           HA       THR  78  94.752  -1.713   6.186
  612    HB   THR  78           HB       THR  78  93.595   0.509   5.945
  613    HG1  THR  78           HG1      THR  78  93.182  -1.766   4.435
  614   HG21  THR  78          HG21      THR  78  93.584   1.624   3.847
  615   HG22  THR  78          HG22      THR  78  94.379   0.270   3.041
  616   HG23  THR  78          HG23      THR  78  95.280   1.273   4.178
  617    H    LYS  79           H        LYS  79  94.576  -3.299   4.614
  618    HA   LYS  79           HA       LYS  79  96.708  -3.278   2.609
  619    HB2  LYS  79           HB2      LYS  79  95.964  -5.252   4.222
  620    HB3  LYS  79           HB3      LYS  79  94.830  -5.584   2.916
  621    HG2  LYS  79           HG2      LYS  79  97.840  -5.341   2.635
  622    HG3  LYS  79           HG3      LYS  79  96.913  -6.840   2.573
  623    HD2  LYS  79           HD2      LYS  79  95.617  -5.801   0.631
  624    HD3  LYS  79           HD3      LYS  79  96.855  -4.543   0.606
  625    HE2  LYS  79           HE2      LYS  79  97.438  -6.299  -0.995
  626    HE3  LYS  79           HE3      LYS  79  98.597  -6.298   0.334
  627    HZ1  LYS  79           HZ1      LYS  79  97.674  -8.527  -0.362
  628    HZ2  LYS  79           HZ2      LYS  79  96.201  -8.037   0.329
  629    HZ3  LYS  79           HZ3      LYS  79  97.595  -8.167   1.293
  630    H    MET  80           H        MET  80  95.951  -1.840   1.065
  631    HA   MET  80           HA       MET  80  94.335  -2.912  -0.984
  632    HB2  MET  80           HB2      MET  80  92.434  -2.465   0.434
  633    HB3  MET  80           HB1      MET  80  93.007  -0.828   0.764
  634    HG2  MET  80           HG2      MET  80  92.610  -0.125  -1.477
  635    HG3  MET  80           HG1      MET  80  92.422  -1.784  -2.044
  636    HE1  MET  80           HE1      MET  80  89.048   0.596  -1.976
  637    HE2  MET  80           HE2      MET  80  90.279  -0.020  -3.075
  638    HE3  MET  80           HE3      MET  80  90.716   1.170  -1.853
  639    H    ILE  81           H        ILE  81  95.971  -2.233  -2.317
  640    HA   ILE  81           HA       ILE  81  96.185   0.689  -2.720
  641    HB   ILE  81           HB       ILE  81  98.463  -1.303  -2.883
  642   HG12  ILE  81          HG12      ILE  81  99.244   0.388  -0.970
  643   HG13  ILE  81          HG13      ILE  81  97.507   0.592  -0.756
  644   HG21  ILE  81          HG21      ILE  81  99.805   0.826  -3.103
  645   HG22  ILE  81          HG22      ILE  81  98.282   1.694  -3.296
  646   HG23  ILE  81          HG23      ILE  81  98.761   0.480  -4.482
  647   HD11  ILE  81          HD11      ILE  81  97.742  -1.219   0.617
  648   HD12  ILE  81          HD12      ILE  81  99.221  -1.756  -0.175
  649   HD13  ILE  81          HD13      ILE  81  97.654  -2.125  -0.893
  650    H    PHE  82           H        PHE  82  94.808   0.687  -4.486
  651    HA   PHE  82           HA       PHE  82  95.802  -0.755  -6.876
  652    HB2  PHE  82           HB2      PHE  82  93.708  -1.765  -6.065
  653    HB3  PHE  82           HB1      PHE  82  92.916  -0.192  -6.142
  654    HD1  PHE  82           HD2      PHE  82  94.888  -2.562  -8.278
  655    HD2  PHE  82           HD1      PHE  82  91.814   0.434  -8.113
  656    HE1  PHE  82           HE2      PHE  82  94.395  -2.935 -10.679
  657    HE2  PHE  82           HE1      PHE  82  91.322   0.061 -10.514
  658    HZ   PHE  82           HZ       PHE  82  92.611  -1.623 -11.797
  659    H    ALA  83           H        ALA  83  93.302   1.707  -6.269
  660    HA   ALA  83           HA       ALA  83  94.747   3.891  -7.326
  661    HB1  ALA  83           HB1      ALA  83  93.464   4.095  -9.491
  662    HB2  ALA  83           HB2      ALA  83  92.942   2.427  -9.260
  663    HB3  ALA  83           HB3      ALA  83  94.655   2.796  -9.460
  664    H    GLY  84           H        GLY  84  93.824   5.345  -6.019
  665    HA2  GLY  84           HA2      GLY  84  91.190   5.224  -5.019
  666    HA3  GLY  84           HA3      GLY  84  92.229   6.645  -4.988
  667    H    ILE  85           H        ILE  85  89.699   7.236  -5.320
  668    HA   ILE  85           HA       ILE  85  88.945   7.277  -8.130
  669    HB   ILE  85           HB       ILE  85  87.674   8.377  -5.621
  670   HG12  ILE  85          HG12      ILE  85  87.733   5.830  -6.289
  671   HG13  ILE  85          HG13      ILE  85  86.223   6.548  -5.742
  672   HG21  ILE  85          HG21      ILE  85  85.680   8.720  -7.204
  673   HG22  ILE  85          HG22      ILE  85  86.853   8.617  -8.516
  674   HG23  ILE  85          HG23      ILE  85  86.991   9.895  -7.309
  675   HD11  ILE  85          HD11      ILE  85  86.878   6.562  -8.674
  676   HD12  ILE  85          HD12      ILE  85  85.303   6.592  -7.883
  677   HD13  ILE  85          HD13      ILE  85  86.239   5.099  -7.927
  678    H    LYS  86           H        LYS  86  88.414   9.326  -9.217
  679    HA   LYS  86           HA       LYS  86  90.483  11.327  -8.666
  680    HB2  LYS  86           HB2      LYS  86  90.016  10.233 -10.968
  681    HB3  LYS  86           HB3      LYS  86  88.650  11.344 -11.050
  682    HG2  LYS  86           HG2      LYS  86  90.171  13.251 -10.682
  683    HG3  LYS  86           HG3      LYS  86  91.541  12.146 -10.596
  684    HD2  LYS  86           HD2      LYS  86  89.734  12.117 -13.007
  685    HD3  LYS  86           HD3      LYS  86  91.005  13.331 -12.872
  686    HE2  LYS  86           HE2      LYS  86  92.656  11.474 -12.495
  687    HE3  LYS  86           HE3      LYS  86  91.363  10.321 -12.823
  688    HZ1  LYS  86           HZ1      LYS  86  91.142  11.940 -14.924
  689    HZ2  LYS  86           HZ2      LYS  86  92.095  10.532 -14.919
  690    HZ3  LYS  86           HZ3      LYS  86  92.811  12.048 -14.646
  691    H    LYS  87           H        LYS  87  87.117  11.582  -9.864
  692    HA   LYS  87           HA       LYS  87  86.874  14.158  -8.495
  693    HB2  LYS  87           HB2      LYS  87  84.895  12.781 -10.319
  694    HB3  LYS  87           HB3      LYS  87  84.873  14.469  -9.808
  695    HG2  LYS  87           HG2      LYS  87  87.335  14.443 -10.842
  696    HG3  LYS  87           HG3      LYS  87  86.671  13.105 -11.777
  697    HD2  LYS  87           HD2      LYS  87  86.120  14.906 -13.146
  698    HD3  LYS  87           HD3      LYS  87  84.658  14.777 -12.169
  699    HE2  LYS  87           HE2      LYS  87  85.486  16.527 -10.659
  700    HE3  LYS  87           HE3      LYS  87  86.989  16.627 -11.575
  701    HZ1  LYS  87           HZ1      LYS  87  84.981  16.884 -13.432
  702    HZ2  LYS  87           HZ2      LYS  87  85.980  18.123 -12.837
  703    HZ3  LYS  87           HZ3      LYS  87  84.470  17.826 -12.117
  704    H    LYS  88           H        LYS  88  84.862  14.670  -7.336
  705    HA   LYS  88           HA       LYS  88  84.386  12.815  -5.238
  706    HB2  LYS  88           HB2      LYS  88  84.198  15.312  -5.043
  707    HB3  LYS  88           HB3      LYS  88  82.705  15.218  -5.976
  708    HG2  LYS  88           HG2      LYS  88  81.796  13.626  -4.266
  709    HG3  LYS  88           HG3      LYS  88  83.252  13.885  -3.308
  710    HD2  LYS  88           HD2      LYS  88  81.943  15.514  -2.341
  711    HD3  LYS  88           HD3      LYS  88  82.555  16.461  -3.695
  712    HE2  LYS  88           HE2      LYS  88  79.962  14.888  -3.756
  713    HE3  LYS  88           HE3      LYS  88  80.066  16.614  -3.413
  714    HZ1  LYS  88           HZ1      LYS  88  79.695  16.588  -5.665
  715    HZ2  LYS  88           HZ2      LYS  88  80.616  15.184  -5.924
  716    HZ3  LYS  88           HZ3      LYS  88  81.389  16.665  -5.616
  717    H    THR  89           H        THR  89  82.288  13.971  -7.894
  718    HA   THR  89           HA       THR  89  80.032  12.471  -7.357
  719    HB   THR  89           HB       THR  89  79.654  12.465  -9.844
  720    HG1  THR  89           HG1      THR  89  81.467  12.561 -10.904
  721   HG21  THR  89          HG21      THR  89  79.580  14.974  -9.990
  722   HG22  THR  89          HG22      THR  89  80.478  15.039  -8.475
  723   HG23  THR  89          HG23      THR  89  78.865  14.328  -8.514
  724    H    GLU  90           H        GLU  90  83.087  11.437  -8.726
  725    HA   GLU  90           HA       GLU  90  82.209   8.909  -9.682
  726    HB2  GLU  90           HB2      GLU  90  84.892  10.032  -8.904
  727    HB3  GLU  90           HB3      GLU  90  84.715   8.331  -9.326
  728    HG2  GLU  90           HG2      GLU  90  83.855   8.898 -11.510
  729    HG3  GLU  90           HG3      GLU  90  83.781  10.608 -11.089
  730    H    ARG  91           H        ARG  91  83.263  10.151  -6.585
  731    HA   ARG  91           HA       ARG  91  83.366   7.574  -5.290
  732    HB2  ARG  91           HB2      ARG  91  83.179  10.329  -4.044
  733    HB3  ARG  91           HB3      ARG  91  83.677   8.841  -3.240
  734    HG2  ARG  91           HG2      ARG  91  85.586   8.662  -4.828
  735    HG3  ARG  91           HG3      ARG  91  85.117  10.212  -5.526
  736    HD2  ARG  91           HD2      ARG  91  85.201  10.686  -2.764
  737    HD3  ARG  91           HD3      ARG  91  86.610   9.680  -3.082
  738    HE   ARG  91           HE       ARG  91  86.728  11.556  -5.054
  739   HH11  ARG  91          HH21      ARG  91  86.372  11.657  -1.609
  740   HH12  ARG  91          HH22      ARG  91  87.153  13.192  -1.438
  741   HH21  ARG  91          HH11      ARG  91  87.756  13.567  -4.831
  742   HH22  ARG  91          HH12      ARG  91  87.937  14.273  -3.260
  743    H    GLU  92           H        GLU  92  81.134  10.357  -5.265
  744    HA   GLU  92           HA       GLU  92  79.232   9.291  -3.500
  745    HB2  GLU  92           HB2      GLU  92  79.317  11.663  -4.360
  746    HB3  GLU  92           HB3      GLU  92  78.624  11.071  -5.871
  747    HG2  GLU  92           HG2      GLU  92  76.667  10.218  -4.669
  748    HG3  GLU  92           HG3      GLU  92  77.363  10.734  -3.134
  749    H    ASP  93           H        ASP  93  79.242   9.244  -7.079
  750    HA   ASP  93           HA       ASP  93  76.963   7.635  -7.393
  751    HB2  ASP  93           HB2      ASP  93  79.432   7.909  -9.123
  752    HB3  ASP  93           HB1      ASP  93  77.977   7.042  -9.615
  753    H    LEU  94           H        LEU  94  80.407   6.718  -7.300
  754    HA   LEU  94           HA       LEU  94  80.113   3.952  -7.514
  755    HB2  LEU  94           HB2      LEU  94  82.309   5.017  -7.616
  756    HB3  LEU  94           HB3      LEU  94  82.149   5.544  -5.943
  757    HG   LEU  94           HG       LEU  94  82.131   3.243  -5.161
  758   HD11  LEU  94          HD11      LEU  94  81.045   1.982  -6.797
  759   HD12  LEU  94          HD12      LEU  94  82.725   1.495  -7.027
  760   HD13  LEU  94          HD13      LEU  94  81.994   2.682  -8.108
  761   HD21  LEU  94          HD21      LEU  94  84.324   4.542  -5.974
  762   HD22  LEU  94          HD22      LEU  94  84.399   3.195  -7.109
  763   HD23  LEU  94          HD23      LEU  94  84.399   2.887  -5.375
  764    H    ILE  95           H        ILE  95  79.836   6.087  -4.740
  765    HA   ILE  95           HA       ILE  95  79.619   3.957  -2.846
  766    HB   ILE  95           HB       ILE  95  79.221   6.932  -2.683
  767   HG12  ILE  95          HG12      ILE  95  81.145   5.183  -1.155
  768   HG13  ILE  95          HG13      ILE  95  81.486   5.653  -2.816
  769   HG21  ILE  95          HG21      ILE  95  79.194   6.259  -0.102
  770   HG22  ILE  95          HG22      ILE  95  78.471   4.781  -0.737
  771   HG23  ILE  95          HG23      ILE  95  77.700   6.338  -1.034
  772   HD11  ILE  95          HD11      ILE  95  80.696   7.775  -0.862
  773   HD12  ILE  95          HD12      ILE  95  81.732   7.889  -2.284
  774   HD13  ILE  95          HD13      ILE  95  82.337   7.140  -0.811
  775    H    ALA  96           H        ALA  96  77.419   5.799  -4.800
  776    HA   ALA  96           HA       ALA  96  75.035   5.253  -3.373
  777    HB1  ALA  96           HB1      ALA  96  75.300   5.594  -6.363
  778    HB2  ALA  96           HB2      ALA  96  75.330   6.944  -5.229
  779    HB3  ALA  96           HB3      ALA  96  73.889   5.937  -5.362
  780    H    TYR  97           H        TYR  97  76.880   3.501  -5.806
  781    HA   TYR  97           HA       TYR  97  74.924   1.409  -6.109
  782    HB2  TYR  97           HB2      TYR  97  76.359   1.758  -7.984
  783    HB3  TYR  97           HB3      TYR  97  77.805   1.682  -6.978
  784    HD1  TYR  97           HD1      TYR  97  74.997  -0.317  -8.371
  785    HD2  TYR  97           HD2      TYR  97  78.779  -0.416  -6.339
  786    HE1  TYR  97           HE1      TYR  97  75.111  -2.769  -8.705
  787    HE2  TYR  97           HE2      TYR  97  78.891  -2.870  -6.673
  788    HH   TYR  97           HH       TYR  97  77.900  -4.545  -8.338
  789    H    LEU  98           H        LEU  98  78.090   1.715  -4.490
  790    HA   LEU  98           HA       LEU  98  78.316  -0.822  -3.417
  791    HB2  LEU  98           HB2      LEU  98  79.149   1.881  -2.389
  792    HB3  LEU  98           HB3      LEU  98  79.460   0.428  -1.445
  793    HG   LEU  98           HG       LEU  98  80.257   0.554  -4.351
  794   HD11  LEU  98          HD11      LEU  98  81.232   2.535  -3.160
  795   HD12  LEU  98          HD12      LEU  98  82.437   1.397  -3.745
  796   HD13  LEU  98          HD13      LEU  98  82.004   1.420  -2.036
  797   HD21  LEU  98          HD21      LEU  98  81.358  -1.385  -3.891
  798   HD22  LEU  98          HD22      LEU  98  80.304  -1.468  -2.480
  799   HD23  LEU  98          HD23      LEU  98  81.929  -0.803  -2.330
  800    H    LYS  99           H        LYS  99  76.115   1.729  -2.593
  801    HA   LYS  99           HA       LYS  99  75.361   0.634  -0.028
  802    HB2  LYS  99           HB2      LYS  99  74.404   2.886  -1.762
  803    HB3  LYS  99           HB3      LYS  99  73.372   2.308  -0.454
  804    HG2  LYS  99           HG2      LYS  99  75.345   2.592   1.106
  805    HG3  LYS  99           HG3      LYS  99  76.192   3.390  -0.218
  806    HD2  LYS  99           HD2      LYS  99  73.481   4.280   0.797
  807    HD3  LYS  99           HD3      LYS  99  75.000   4.959   1.376
  808    HE2  LYS  99           HE2      LYS  99  75.541   5.410  -1.104
  809    HE3  LYS  99           HE3      LYS  99  73.831   5.102  -1.403
  810    HZ1  LYS  99           HZ1      LYS  99  74.821   7.489  -0.746
  811    HZ2  LYS  99           HZ2      LYS  99  74.401   6.901   0.792
  812    HZ3  LYS  99           HZ3      LYS  99  73.225   7.012  -0.429
  813    H    LYS 100           H        LYS 100  73.929   0.761  -3.281
  814    HA   LYS 100           HA       LYS 100  71.632  -0.802  -2.535
  815    HB2  LYS 100           HB2      LYS 100  71.800   0.880  -4.460
  816    HB3  LYS 100           HB3      LYS 100  72.657  -0.383  -5.340
  817    HG2  LYS 100           HG2      LYS 100  70.684  -1.912  -4.821
  818    HG3  LYS 100           HG3      LYS 100  69.831  -0.475  -4.264
  819    HD2  LYS 100           HD2      LYS 100  69.181  -0.682  -6.530
  820    HD3  LYS 100           HD3      LYS 100  70.437   0.553  -6.553
  821    HE2  LYS 100           HE2      LYS 100  72.035  -0.908  -7.471
  822    HE3  LYS 100           HE3      LYS 100  71.152  -2.347  -6.962
  823    HZ1  LYS 100           HZ1      LYS 100  69.514  -1.979  -8.597
  824    HZ2  LYS 100           HZ2      LYS 100  71.008  -1.789  -9.383
  825    HZ3  LYS 100           HZ3      LYS 100  70.092  -0.424  -8.951
  826    H    ALA 101           H        ALA 101  74.863  -1.512  -3.434
  827    HA   ALA 101           HA       ALA 101  74.286  -4.196  -4.394
  828    HB1  ALA 101           HB1      ALA 101  76.176  -2.733  -5.262
  829    HB2  ALA 101           HB2      ALA 101  76.627  -4.376  -4.804
  830    HB3  ALA 101           HB3      ALA 101  76.989  -3.028  -3.725
  831    H    THR 102           H        THR 102  75.437  -2.605  -1.477
  832    HA   THR 102           HA       THR 102  75.992  -5.167  -0.179
  833    HB   THR 102           HB       THR 102  76.691  -3.762   1.735
  834    HG1  THR 102           HG1      THR 102  76.665  -1.416   0.439
  835   HG21  THR 102          HG21      THR 102  78.547  -2.553   0.503
  836   HG22  THR 102          HG22      THR 102  77.764  -3.046  -0.997
  837   HG23  THR 102          HG23      THR 102  78.382  -4.266   0.114
  838    H    ASN 103           H        ASN 103  73.338  -3.349  -0.828
  839    HA   ASN 103           HA       ASN 103  71.955  -4.006   1.696
  840    HB2  ASN 103           HB2      ASN 103  71.398  -2.032  -0.514
  841    HB3  ASN 103           HB1      ASN 103  70.181  -2.468   0.676
  842   HD21  ASN 103          HD21      ASN 103  73.606  -2.327   1.527
  843   HD22  ASN 103          HD22      ASN 103  73.478  -0.951   2.509
  844    H    GLU 104           H        GLU 104  72.183  -4.736  -1.669
  845    HA   GLU 104           HA       GLU 104  70.857  -5.997  -3.099
  846    HB2  GLU 104           HB2      GLU 104  70.985  -7.681  -0.589
  847    HB3  GLU 104           HB3      GLU 104  70.469  -8.283  -2.165
  848    HG2  GLU 104           HG2      GLU 104  72.695  -7.423  -3.073
  849    HG3  GLU 104           HG3      GLU 104  73.187  -7.205  -1.394
  850    HHA  HEC 201           HA       HEC 105  89.349  -3.487   3.232
  851    HHB  HEC 201           HB       HEC 105  85.479  -0.018  -0.370
  852    HHC  HEC 201           HC       HEC 105  88.768  -1.712  -5.502
  853    HHD  HEC 201           HD       HEC 105  92.171  -5.715  -1.974
  854   HMA1  HEC 201          HMA1      HEC 105  85.024  -0.576   3.313
  855   HMA2  HEC 201          HMA2      HEC 105  84.567  -0.263   1.642
  856   HMA3  HEC 201          HMA3      HEC 105  85.699   0.813   2.462
  857   HAA1  HEC 201          HAA1      HEC 105  86.826  -0.991   4.544
  858   HAA2  HEC 201          HAA2      HEC 105  88.410  -1.741   4.487
  859   HBA1  HEC 201          HBA1      HEC 105  87.539  -3.902   4.653
  860   HBA2  HEC 201          HBA2      HEC 105  85.935  -3.407   4.123
  861   HMB1  HEC 201          HMB1      HEC 105  84.041   0.104  -2.752
  862   HMB2  HEC 201          HMB2      HEC 105  84.793   1.247  -3.856
  863   HMB3  HEC 201          HMB3      HEC 105  84.999   1.440  -2.118
  864    HAB  HEC 201           HAB      HEC 105  87.265  -0.497  -6.146
  865   HBB1  HEC 201          HBB1      HEC 105  86.645   2.043  -4.682
  866   HBB2  HEC 201          HBB2      HEC 105  87.921   1.707  -5.846
  867   HBB3  HEC 201          HBB3      HEC 105  86.262   1.939  -6.398
  868   HMC1  HEC 201          HMC1      HEC 105  91.120  -4.272  -6.903
  869   HMC2  HEC 201          HMC2      HEC 105  91.359  -2.550  -6.621
  870   HMC3  HEC 201          HMC3      HEC 105  89.734  -3.191  -6.849
  871    HAC  HEC 201           HAC      HEC 105  92.596  -6.137  -3.904
  872   HBC1  HEC 201          HBC1      HEC 105  93.677  -5.639  -6.318
  873   HBC2  HEC 201          HBC2      HEC 105  94.267  -4.868  -4.846
  874   HBC3  HEC 201          HBC3      HEC 105  93.160  -4.005  -5.910
  875   HMD1  HEC 201          HMD1      HEC 105  93.427  -6.230  -0.193
  876   HMD2  HEC 201          HMD2      HEC 105  92.295  -7.449   0.394
  877   HMD3  HEC 201          HMD3      HEC 105  93.257  -6.511   1.534
  878   HAD1  HEC 201          HAD1      HEC 105  91.936  -6.246   3.197
  879   HAD2  HEC 201          HAD2      HEC 105  90.404  -5.554   3.689
  880   HBD1  HEC 201          HBD1      HEC 105  91.620  -3.297   3.751
  881   HBD2  HEC 201          HBD2      HEC 105  93.110  -4.230   3.646
  882    H1   HOH 301           H2       HOH 200  81.532   3.046  -0.678
  883    H2   HOH 301           H1       HOH 200  80.296   2.193  -0.488
  884    H1   HOH 302           H2       HOH 201  86.439   4.659   5.792
  885    H2   HOH 302           H1       HOH 201  85.176   4.852   6.603
  886    H1   HOH 303           H2       HOH 202  82.356  -5.181   5.074
  887    H2   HOH 303           H1       HOH 202  83.598  -6.027   5.247
  888    H1   HOH 304           H2       HOH 203  83.541  -9.827   0.729
  889    H2   HOH 304           H1       HOH 203  82.729  -9.506  -0.506
  Start of MODEL    4
    1    H1   GLY   1           H1       GLY   1  72.701  11.081  -7.142
    2    H2   GLY   1           H2       GLY   1  73.727  11.422  -5.832
    3    H3   GLY   1           H3       GLY   1  72.475  10.285  -5.660
    4    HA2  GLY   1           HA2      GLY   1  75.043  10.029  -7.076
    5    HA3  GLY   1           HA3      GLY   1  74.286   8.917  -5.935
    6    H    ASP   2           H        ASP   2  75.282   8.228  -8.541
    7    HA   ASP   2           HA       ASP   2  72.762   7.476  -9.912
    8    HB2  ASP   2           HB2      ASP   2  75.490   7.839 -11.165
    9    HB3  ASP   2           HB1      ASP   2  73.983   7.468 -12.001
   10    H    VAL   3           H        VAL   3  72.554   5.557  -8.728
   11    HA   VAL   3           HA       VAL   3  74.457   3.636  -8.194
   12    HB   VAL   3           HB       VAL   3  72.192   3.443  -7.350
   13   HG11  VAL   3          HG11      VAL   3  70.984   4.404  -9.237
   14   HG12  VAL   3          HG12      VAL   3  70.345   2.795  -8.902
   15   HG13  VAL   3          HG13      VAL   3  71.441   3.044 -10.262
   16   HG21  VAL   3          HG21      VAL   3  73.587   1.362  -7.799
   17   HG22  VAL   3          HG22      VAL   3  72.639   1.141  -9.269
   18   HG23  VAL   3          HG23      VAL   3  71.849   1.092  -7.692
   19    H    GLU   4           H        GLU   4  73.248   4.652 -11.239
   20    HA   GLU   4           HA       GLU   4  73.773   2.230 -12.691
   21    HB2  GLU   4           HB2      GLU   4  73.473   5.086 -13.651
   22    HB3  GLU   4           HB3      GLU   4  73.512   3.663 -14.693
   23    HG2  GLU   4           HG2      GLU   4  71.537   2.758 -13.459
   24    HG3  GLU   4           HG3      GLU   4  71.465   4.260 -12.540
   25    H    LYS   5           H        LYS   5  75.440   5.396 -12.675
   26    HA   LYS   5           HA       LYS   5  77.746   4.339 -14.012
   27    HB2  LYS   5           HB2      LYS   5  77.053   6.952 -12.698
   28    HB3  LYS   5           HB3      LYS   5  78.731   6.608 -13.119
   29    HG2  LYS   5           HG2      LYS   5  78.262   6.470 -15.418
   30    HG3  LYS   5           HG3      LYS   5  76.541   6.204 -15.151
   31    HD2  LYS   5           HD2      LYS   5  77.749   8.779 -14.198
   32    HD3  LYS   5           HD3      LYS   5  77.441   8.582 -15.923
   33    HE2  LYS   5           HE2      LYS   5  75.106   8.210 -15.559
   34    HE3  LYS   5           HE3      LYS   5  75.336   8.033 -13.821
   35    HZ1  LYS   5           HZ1      LYS   5  75.354  10.231 -13.524
   36    HZ2  LYS   5           HZ2      LYS   5  74.640  10.319 -15.062
   37    HZ3  LYS   5           HZ3      LYS   5  76.319  10.520 -14.889
   38    H    GLY   6           H        GLY   6  76.639   4.393 -10.781
   39    HA2  GLY   6           HA2      GLY   6  79.179   4.264  -9.463
   40    HA3  GLY   6           HA3      GLY   6  77.622   3.798  -8.772
   41    H    LYS   7           H        LYS   7  76.898   1.980 -10.835
   42    HA   LYS   7           HA       LYS   7  78.157  -0.397  -9.895
   43    HB2  LYS   7           HB2      LYS   7  75.795  -0.223 -10.765
   44    HB3  LYS   7           HB3      LYS   7  76.470  -0.063 -12.385
   45    HG2  LYS   7           HG2      LYS   7  77.790  -2.260 -11.714
   46    HG3  LYS   7           HG3      LYS   7  76.478  -2.443 -10.554
   47    HD2  LYS   7           HD2      LYS   7  75.580  -3.556 -12.387
   48    HD3  LYS   7           HD3      LYS   7  74.957  -1.929 -12.663
   49    HE2  LYS   7           HE2      LYS   7  76.884  -1.464 -14.159
   50    HE3  LYS   7           HE3      LYS   7  77.459  -3.112 -13.908
   51    HZ1  LYS   7           HZ1      LYS   7  75.912  -3.943 -15.272
   52    HZ2  LYS   7           HZ2      LYS   7  75.790  -2.357 -15.872
   53    HZ3  LYS   7           HZ3      LYS   7  74.691  -2.915 -14.701
   54    H    LYS   8           H        LYS   8  78.399   1.538 -12.867
   55    HA   LYS   8           HA       LYS   8  80.100  -0.158 -14.320
   56    HB2  LYS   8           HB2      LYS   8  79.005   1.762 -15.346
   57    HB3  LYS   8           HB3      LYS   8  79.929   2.864 -14.327
   58    HG2  LYS   8           HG2      LYS   8  81.565   0.925 -15.866
   59    HG3  LYS   8           HG3      LYS   8  80.696   2.102 -16.848
   60    HD2  LYS   8           HD2      LYS   8  82.255   3.015 -14.436
   61    HD3  LYS   8           HD3      LYS   8  83.082   2.709 -15.960
   62    HE2  LYS   8           HE2      LYS   8  81.917   4.410 -17.083
   63    HE3  LYS   8           HE3      LYS   8  80.614   4.435 -15.894
   64    HZ1  LYS   8           HZ1      LYS   8  81.707   5.909 -14.675
   65    HZ2  LYS   8           HZ2      LYS   8  82.808   6.081 -15.957
   66    HZ3  LYS   8           HZ3      LYS   8  83.133   4.993 -14.694
   67    H    ILE   9           H        ILE   9  80.909   2.568 -12.177
   68    HA   ILE   9           HA       ILE   9  83.711   2.291 -12.395
   69    HB   ILE   9           HB       ILE   9  82.030   3.490 -10.184
   70   HG12  ILE   9          HG12      ILE   9  83.555   4.911 -12.375
   71   HG13  ILE   9          HG13      ILE   9  81.878   4.406 -12.589
   72   HG21  ILE   9          HG21      ILE   9  84.994   3.643 -10.801
   73   HG22  ILE   9          HG22      ILE   9  84.243   3.028  -9.330
   74   HG23  ILE   9          HG23      ILE   9  84.168   4.749  -9.704
   75   HD11  ILE   9          HD11      ILE   9  82.116   6.769 -11.769
   76   HD12  ILE   9          HD12      ILE   9  82.843   6.133 -10.294
   77   HD13  ILE   9          HD13      ILE   9  81.171   5.740 -10.694
   78    H    PHE  10           H        PHE  10  81.333   0.580 -10.537
   79    HA   PHE  10           HA       PHE  10  83.190  -0.414  -8.568
   80    HB2  PHE  10           HB2      PHE  10  81.020  -0.377  -7.738
   81    HB3  PHE  10           HB1      PHE  10  80.322  -0.946  -9.255
   82    HD1  PHE  10           HD2      PHE  10  82.131  -1.945  -6.200
   83    HD2  PHE  10           HD1      PHE  10  80.276  -3.305  -9.822
   84    HE1  PHE  10           HE2      PHE  10  82.247  -4.284  -5.382
   85    HE2  PHE  10           HE1      PHE  10  80.384  -5.642  -9.004
   86    HZ   PHE  10           HZ       PHE  10  81.370  -6.133  -6.784
   87    H    VAL  11           H        VAL  11  81.468  -1.926 -11.310
   88    HA   VAL  11           HA       VAL  11  82.573  -4.469 -11.100
   89    HB   VAL  11           HB       VAL  11  82.047  -4.715 -13.511
   90   HG11  VAL  11          HG11      VAL  11  79.692  -4.492 -13.236
   91   HG12  VAL  11          HG12      VAL  11  79.879  -3.163 -12.096
   92   HG13  VAL  11          HG13      VAL  11  80.328  -4.799 -11.621
   93   HG21  VAL  11          HG21      VAL  11  81.129  -2.817 -14.735
   94   HG22  VAL  11          HG22      VAL  11  82.735  -2.390 -14.146
   95   HG23  VAL  11          HG23      VAL  11  81.302  -1.786 -13.317
   96    H    GLN  12           H        GLN  12  83.937  -1.543 -12.416
   97    HA   GLN  12           HA       GLN  12  86.187  -3.041 -13.554
   98    HB2  GLN  12           HB2      GLN  12  86.832  -0.985 -14.608
   99    HB3  GLN  12           HB1      GLN  12  85.100  -1.217 -14.844
  100    HG2  GLN  12           HG2      GLN  12  84.700   0.256 -12.844
  101    HG3  GLN  12           HG1      GLN  12  86.432   0.591 -12.816
  102   HE21  GLN  12          HE21      GLN  12  85.780   0.154 -16.017
  103   HE22  GLN  12          HE22      GLN  12  85.439   1.753 -16.464
  104    H    LYS  13           H        LYS  13  85.474  -1.024 -10.766
  105    HA   LYS  13           HA       LYS  13  88.356  -0.803 -10.194
  106    HB2  LYS  13           HB2      LYS  13  85.975   0.585  -8.970
  107    HB3  LYS  13           HB3      LYS  13  87.619   0.750  -8.370
  108    HG2  LYS  13           HG2      LYS  13  88.090   1.264 -10.974
  109    HG3  LYS  13           HG3      LYS  13  86.415   1.799 -10.891
  110    HD2  LYS  13           HD2      LYS  13  86.915   3.373  -9.146
  111    HD3  LYS  13           HD3      LYS  13  88.538   2.715  -8.938
  112    HE2  LYS  13           HE2      LYS  13  89.243   3.523 -11.072
  113    HE3  LYS  13           HE3      LYS  13  87.589   3.905 -11.548
  114    HZ1  LYS  13           HZ1      LYS  13  88.667   5.163  -9.133
  115    HZ2  LYS  13           HZ2      LYS  13  87.539   5.761 -10.255
  116    HZ3  LYS  13           HZ3      LYS  13  89.194   5.744 -10.636
  117    H    CYS  14           H        CYS  14  85.474  -1.423  -8.134
  118    HA   CYS  14           HA       CYS  14  87.176  -2.742  -6.208
  119    HB2  CYS  14           HB2      CYS  14  84.208  -2.736  -5.968
  120    HB3  CYS  14           HB1      CYS  14  85.431  -2.548  -4.715
  121    H    ALA  15           H        ALA  15  84.732  -3.880  -8.517
  122    HA   ALA  15           HA       ALA  15  84.238  -6.394  -7.518
  123    HB1  ALA  15           HB1      ALA  15  84.267  -7.091 -10.040
  124    HB2  ALA  15           HB2      ALA  15  84.525  -5.369 -10.319
  125    HB3  ALA  15           HB3      ALA  15  83.078  -5.919  -9.474
  126    H    GLN  16           H        GLN  16  87.195  -5.177  -8.892
  127    HA   GLN  16           HA       GLN  16  88.548  -7.444  -9.658
  128    HB2  GLN  16           HB2      GLN  16  89.374  -4.848  -8.451
  129    HB3  GLN  16           HB1      GLN  16  90.580  -6.133  -8.520
  130    HG2  GLN  16           HG2      GLN  16  90.197  -6.377 -10.939
  131    HG3  GLN  16           HG1      GLN  16  88.970  -5.113 -10.879
  132   HE21  GLN  16          HE21      GLN  16  92.200  -5.246  -9.289
  133   HE22  GLN  16          HE22      GLN  16  92.774  -3.822 -10.012
  134    H    CYS  17           H        CYS  17  88.565  -6.090  -6.330
  135    HA   CYS  17           HA       CYS  17  89.053  -8.841  -5.348
  136    HB2  CYS  17           HB2      CYS  17  90.252  -6.660  -3.752
  137    HB3  CYS  17           HB1      CYS  17  90.894  -8.247  -4.153
  138    H    HIS  18           H        HSD  18  86.490  -8.044  -5.394
  139    HA   HIS  18           HA       HSD  18  85.857  -7.894  -2.569
  140    HB2  HIS  18           HB2      HSD  18  85.309  -5.590  -4.413
  141    HB3  HIS  18           HB1      HSD  18  84.197  -5.937  -3.092
  142    HD1  HIS  18           HD1      HSD  18  85.118  -5.703  -0.653
  143    HD2  HIS  18           HD2      HSD  18  87.823  -4.574  -3.611
  144    HE1  HIS  18           HE1      HSD  18  86.978  -4.442   0.520
  145    H    THR  19           H        THR  19  83.266  -7.535  -2.481
  146    HA   THR  19           HA       THR  19  81.995  -9.161  -4.581
  147    HB   THR  19           HB       THR  19  80.994  -9.920  -1.971
  148    HG1  THR  19           HG1      THR  19  83.282 -11.118  -1.883
  149   HG21  THR  19          HG21      THR  19  81.602 -12.177  -2.819
  150   HG22  THR  19          HG22      THR  19  82.440 -11.418  -4.174
  151   HG23  THR  19          HG23      THR  19  80.694 -11.240  -4.005
  152    H    VAL  20           H        VAL  20  81.616  -7.165  -1.688
  153    HA   VAL  20           HA       VAL  20  79.858  -5.884  -0.931
  154    HB   VAL  20           HB       VAL  20  79.204  -4.150  -2.496
  155   HG11  VAL  20          HG11      VAL  20  81.365  -3.788  -1.608
  156   HG12  VAL  20          HG12      VAL  20  81.570  -3.573  -3.342
  157   HG13  VAL  20          HG13      VAL  20  82.077  -5.077  -2.577
  158   HG21  VAL  20          HG21      VAL  20  78.885  -5.776  -4.431
  159   HG22  VAL  20          HG22      VAL  20  80.635  -5.737  -4.636
  160   HG23  VAL  20          HG23      VAL  20  79.690  -4.264  -4.837
  161    H    GLU  21           H        GLU  21  79.017  -8.562  -1.657
  162    HA   GLU  21           HA       GLU  21  76.195  -7.944  -2.263
  163    HB2  GLU  21           HB2      GLU  21  75.964  -9.760  -3.747
  164    HB3  GLU  21           HB3      GLU  21  77.466  -8.979  -4.236
  165    HG2  GLU  21           HG2      GLU  21  78.611 -10.657  -2.615
  166    HG3  GLU  21           HG3      GLU  21  77.091 -11.546  -2.711
  167    H    LYS  22           H        LYS  22  75.026  -8.447  -0.559
  168    HA   LYS  22           HA       LYS  22  75.836  -9.814   1.695
  169    HB2  LYS  22           HB2      LYS  22  73.578  -9.793   2.387
  170    HB3  LYS  22           HB3      LYS  22  73.733  -8.396   1.325
  171    HG2  LYS  22           HG2      LYS  22  71.839  -9.322   0.389
  172    HG3  LYS  22           HG3      LYS  22  73.051 -10.203  -0.534
  173    HD2  LYS  22           HD2      LYS  22  71.991 -12.074   0.208
  174    HD3  LYS  22           HD3      LYS  22  72.809 -11.769   1.738
  175    HE2  LYS  22           HE2      LYS  22  70.047 -10.779   0.966
  176    HE3  LYS  22           HE3      LYS  22  70.406 -12.067   2.117
  177    HZ1  LYS  22           HZ1      LYS  22  70.105 -10.193   3.432
  178    HZ2  LYS  22           HZ2      LYS  22  70.943  -9.174   2.362
  179    HZ3  LYS  22           HZ3      LYS  22  71.793 -10.307   3.301
  180    H    GLY  23           H        GLY  23  75.543 -11.901   2.491
  181    HA2  GLY  23           HA2      GLY  23  75.600 -14.196   2.382
  182    HA3  GLY  23           HA3      GLY  23  74.283 -14.042   1.224
  183    H    GLY  24           H        GLY  24  77.332 -12.532   0.532
  184    HA2  GLY  24           HA2      GLY  24  77.697 -14.332  -1.750
  185    HA3  GLY  24           HA3      GLY  24  78.516 -12.796  -1.490
  186    H    LYS  25           H        LYS  25  80.601 -13.456  -1.695
  187    HA   LYS  25           HA       LYS  25  81.708 -14.975   0.532
  188    HB2  LYS  25           HB2      LYS  25  83.064 -16.374  -1.136
  189    HB3  LYS  25           HB3      LYS  25  81.375 -16.822  -0.908
  190    HG2  LYS  25           HG2      LYS  25  81.807 -14.789  -3.013
  191    HG3  LYS  25           HG3      LYS  25  82.545 -16.352  -3.358
  192    HD2  LYS  25           HD2      LYS  25  80.437 -17.491  -3.105
  193    HD3  LYS  25           HD3      LYS  25  79.663 -16.034  -2.483
  194    HE2  LYS  25           HE2      LYS  25  80.915 -16.124  -5.230
  195    HE3  LYS  25           HE3      LYS  25  79.237 -16.593  -4.953
  196    HZ1  LYS  25           HZ1      LYS  25  79.417 -14.263  -5.566
  197    HZ2  LYS  25           HZ2      LYS  25  80.442 -13.972  -4.242
  198    HZ3  LYS  25           HZ3      LYS  25  78.824 -14.422  -3.986
  199    H    HIS  26           H        HIS  26  83.292 -13.717   1.247
  200    HA   HIS  26           HA       HIS  26  84.413 -11.549  -0.086
  201    HB2  HIS  26           HB2      HIS  26  86.405 -12.136   1.627
  202    HB3  HIS  26           HB1      HIS  26  84.886 -11.410   2.150
  203    HD1  HIS  26           HD1      HIS  26  85.533 -15.042   1.206
  204    HD2  HIS  26           HD2      HIS  26  84.390 -12.778   4.514
  205    HE1  HIS  26           HE1      HIS  26  84.929 -16.692   3.030
  206    HE2  HIS  26           HE2      HIS  26  84.228 -15.327   5.053
  207    H    LYS  27           H        LYS  27  85.667 -11.449  -1.811
  208    HA   LYS  27           HA       LYS  27  87.465 -13.724  -2.420
  209    HB2  LYS  27           HB2      LYS  27  86.556 -11.705  -4.456
  210    HB3  LYS  27           HB3      LYS  27  87.134 -13.352  -4.708
  211    HG2  LYS  27           HG2      LYS  27  85.047 -14.088  -3.372
  212    HG3  LYS  27           HG3      LYS  27  84.458 -12.447  -3.645
  213    HD2  LYS  27           HD2      LYS  27  83.575 -13.568  -5.496
  214    HD3  LYS  27           HD3      LYS  27  85.081 -12.932  -6.153
  215    HE2  LYS  27           HE2      LYS  27  85.955 -15.307  -5.130
  216    HE3  LYS  27           HE3      LYS  27  84.306 -15.736  -5.583
  217    HZ1  LYS  27           HZ1      LYS  27  86.188 -15.914  -7.319
  218    HZ2  LYS  27           HZ2      LYS  27  86.001 -14.231  -7.460
  219    HZ3  LYS  27           HZ3      LYS  27  84.693 -15.265  -7.786
  220    H    THR  28           H        THR  28  89.517 -13.264  -1.947
  221    HA   THR  28           HA       THR  28  91.413 -12.022  -1.477
  222    HB   THR  28           HB       THR  28  90.796 -10.539  -4.018
  223    HG1  THR  28           HG1      THR  28  91.221 -12.334  -5.169
  224   HG21  THR  28          HG21      THR  28  93.133 -10.536  -4.304
  225   HG22  THR  28          HG22      THR  28  93.360 -11.890  -3.197
  226   HG23  THR  28          HG23      THR  28  92.941 -10.296  -2.568
  227    H    GLY  29           H        GLY  29  88.841 -10.920  -0.499
  228    HA2  GLY  29           HA2      GLY  29  89.774  -8.480   0.555
  229    HA3  GLY  29           HA3      GLY  29  88.680  -8.133  -0.782
  230    HA   PRO  30           HA       PRO  30  86.364  -9.326   3.220
  231    HB2  PRO  30           HB2      PRO  30  85.835  -6.876   4.288
  232    HB3  PRO  30           HB1      PRO  30  87.307  -7.792   4.672
  233    HG2  PRO  30           HG2      PRO  30  86.934  -5.525   2.771
  234    HG3  PRO  30           HG1      PRO  30  88.263  -5.842   3.899
  235    HD2  PRO  30           HD2      PRO  30  88.416  -6.400   1.214
  236    HD3  PRO  30           HD1      PRO  30  89.323  -7.301   2.450
  237    H    ASN  31           H        ASN  31  84.071  -8.948   3.616
  238    HA   ASN  31           HA       ASN  31  82.668  -8.100   1.190
  239    HB2  ASN  31           HB2      ASN  31  80.792  -9.284   2.042
  240    HB3  ASN  31           HB1      ASN  31  82.192 -10.286   2.418
  241   HD21  ASN  31          HD21      ASN  31  82.665 -10.683   4.632
  242   HD22  ASN  31          HD22      ASN  31  81.744 -10.047   5.908
  243    H    LEU  32           H        LEU  32  81.929  -6.079   1.036
  244    HA   LEU  32           HA       LEU  32  81.846  -4.325   3.308
  245    HB2  LEU  32           HB2      LEU  32  80.672  -3.675   0.619
  246    HB3  LEU  32           HB3      LEU  32  81.417  -2.591   1.787
  247    HG   LEU  32           HG       LEU  32  82.775  -4.612  -0.005
  248   HD11  LEU  32          HD11      LEU  32  82.227  -1.883  -0.270
  249   HD12  LEU  32          HD12      LEU  32  83.418  -2.796  -1.195
  250   HD13  LEU  32          HD13      LEU  32  83.909  -1.926   0.256
  251   HD21  LEU  32          HD21      LEU  32  83.921  -4.955   2.031
  252   HD22  LEU  32          HD22      LEU  32  83.762  -3.268   2.508
  253   HD23  LEU  32          HD23      LEU  32  84.881  -3.717   1.226
  254    H    HIS  33           H        HIS  33  80.005  -6.615   3.420
  255    HA   HIS  33           HA       HIS  33  77.344  -5.874   2.869
  256    HB2  HIS  33           HB2      HIS  33  78.401  -7.631   5.101
  257    HB3  HIS  33           HB1      HIS  33  76.722  -7.554   4.569
  258    HD1  HIS  33           HD1      HIS  33  78.232 -10.217   4.344
  259    HD2  HIS  33           HD2      HIS  33  78.066  -7.415   1.262
  260    HE1  HIS  33           HE1      HIS  33  78.676 -11.487   2.198
  261    HE2  HIS  33           HE2      HIS  33  78.576  -9.793   0.310
  262    H    GLY  34           H        GLY  34  75.844  -4.669   3.977
  263    HA2  GLY  34           HA2      GLY  34  75.259  -2.809   5.270
  264    HA3  GLY  34           HA3      GLY  34  75.579  -3.963   6.561
  265    H    LEU  35           H        LEU  35  78.070  -2.855   4.407
  266    HA   LEU  35           HA       LEU  35  80.005  -2.253   6.224
  267    HB2  LEU  35           HB2      LEU  35  80.435  -2.294   3.845
  268    HB3  LEU  35           HB3      LEU  35  79.397  -0.896   3.589
  269    HG   LEU  35           HG       LEU  35  81.103   0.192   5.365
  270   HD11  LEU  35          HD11      LEU  35  83.304  -0.651   5.219
  271   HD12  LEU  35          HD12      LEU  35  82.921  -1.642   3.815
  272   HD13  LEU  35          HD13      LEU  35  82.312  -2.098   5.405
  273   HD21  LEU  35          HD21      LEU  35  80.580   0.938   3.012
  274   HD22  LEU  35          HD22      LEU  35  81.836  -0.164   2.447
  275   HD23  LEU  35          HD23      LEU  35  82.259   1.193   3.490
  276    H    PHE  36           H        PHE  36  77.840   0.174   4.784
  277    HA   PHE  36           HA       PHE  36  78.644   2.372   6.258
  278    HB2  PHE  36           HB2      PHE  36  75.791   1.839   5.410
  279    HB3  PHE  36           HB1      PHE  36  76.575   3.405   5.624
  280    HD1  PHE  36           HD2      PHE  36  76.559   0.308   3.557
  281    HD2  PHE  36           HD1      PHE  36  77.923   4.371   3.892
  282    HE1  PHE  36           HE2      PHE  36  77.350   0.238   1.210
  283    HE2  PHE  36           HE1      PHE  36  78.702   4.301   1.550
  284    HZ   PHE  36           HZ       PHE  36  78.418   2.239   0.202
  285    H    GLY  37           H        GLY  37  79.031   1.944   8.444
  286    HA2  GLY  37           HA2      GLY  37  77.535   2.639  10.433
  287    HA3  GLY  37           HA3      GLY  37  76.701   1.138  10.071
  288    H    ARG  38           H        ARG  38  79.311  -0.201   9.368
  289    HA   ARG  38           HA       ARG  38  79.961  -0.972  12.106
  290    HB2  ARG  38           HB2      ARG  38  80.303  -2.146   9.413
  291    HB3  ARG  38           HB3      ARG  38  81.577  -2.521  10.572
  292    HG2  ARG  38           HG2      ARG  38  79.736  -3.182  12.204
  293    HG3  ARG  38           HG3      ARG  38  78.610  -3.060  10.853
  294    HD2  ARG  38           HD2      ARG  38  81.050  -4.658  10.324
  295    HD3  ARG  38           HD3      ARG  38  79.946  -5.345  11.506
  296    HE   ARG  38           HE       ARG  38  78.186  -4.930   9.660
  297   HH11  ARG  38          HH21      ARG  38  81.531  -5.717   9.104
  298   HH12  ARG  38          HH22      ARG  38  81.225  -6.501   7.592
  299   HH21  ARG  38          HH11      ARG  38  77.803  -5.978   7.694
  300   HH22  ARG  38          HH12      ARG  38  79.124  -6.655   6.801
  301    H    LYS  39           H        LYS  39  82.064  -1.059  12.970
  302    HA   LYS  39           HA       LYS  39  83.687   1.226  12.372
  303    HB2  LYS  39           HB2      LYS  39  83.725  -0.985  14.369
  304    HB3  LYS  39           HB3      LYS  39  85.234  -0.122  14.083
  305    HG2  LYS  39           HG2      LYS  39  82.708   1.450  14.522
  306    HG3  LYS  39           HG3      LYS  39  83.540   0.754  15.910
  307    HD2  LYS  39           HD2      LYS  39  85.655   1.874  15.114
  308    HD3  LYS  39           HD3      LYS  39  84.693   2.691  13.883
  309    HE2  LYS  39           HE2      LYS  39  84.639   3.041  16.864
  310    HE3  LYS  39           HE3      LYS  39  84.676   4.269  15.599
  311    HZ1  LYS  39           HZ1      LYS  39  82.379   2.490  16.215
  312    HZ2  LYS  39           HZ2      LYS  39  82.415   3.678  15.001
  313    HZ3  LYS  39           HZ3      LYS  39  82.499   4.127  16.638
  314    H    THR  40           H        THR  40  86.089   1.023  12.071
  315    HA   THR  40           HA       THR  40  86.658  -0.359   9.681
  316    HB   THR  40           HB       THR  40  89.059   0.291  10.232
  317    HG1  THR  40           HG1      THR  40  87.792   1.736  12.300
  318   HG21  THR  40          HG21      THR  40  87.861   1.750   8.810
  319   HG22  THR  40          HG22      THR  40  88.438   2.795  10.109
  320   HG23  THR  40          HG23      THR  40  86.764   2.242  10.101
  321    H    GLY  41           H        GLY  41  87.840  -2.158   9.215
  322    HA2  GLY  41           HA2      GLY  41  88.428  -4.361   9.514
  323    HA3  GLY  41           HA3      GLY  41  89.453  -3.706  10.787
  324    H    GLN  42           H        GLN  42  85.925  -4.095  10.456
  325    HA   GLN  42           HA       GLN  42  85.930  -5.528  13.052
  326    HB2  GLN  42           HB2      GLN  42  84.802  -3.254  12.963
  327    HB3  GLN  42           HB1      GLN  42  83.616  -3.984  11.880
  328    HG2  GLN  42           HG2      GLN  42  83.007  -5.625  13.566
  329    HG3  GLN  42           HG1      GLN  42  84.284  -5.049  14.636
  330   HE21  GLN  42          HE21      GLN  42  81.145  -4.156  13.201
  331   HE22  GLN  42          HE22      GLN  42  80.808  -2.918  14.313
  332    H    ALA  43           H        ALA  43  85.108  -5.670   9.714
  333    HA   ALA  43           HA       ALA  43  83.007  -7.542   9.787
  334    HB1  ALA  43           HB1      ALA  43  84.618  -6.275   7.804
  335    HB2  ALA  43           HB2      ALA  43  83.089  -7.124   7.585
  336    HB3  ALA  43           HB3      ALA  43  84.611  -8.006   7.470
  337    HA   PRO  44           HA       PRO  44  85.529 -11.017  11.124
  338    HB2  PRO  44           HB2      PRO  44  83.550 -12.838  11.402
  339    HB3  PRO  44           HB1      PRO  44  83.744 -11.487  12.536
  340    HG2  PRO  44           HG2      PRO  44  81.835 -11.790  10.266
  341    HG3  PRO  44           HG1      PRO  44  81.565 -11.120  11.884
  342    HD2  PRO  44           HD2      PRO  44  82.006  -9.575   9.632
  343    HD3  PRO  44           HD1      PRO  44  82.345  -9.036  11.292
  344    H    GLY  45           H        GLY  45  86.806 -11.850   9.528
  345    HA2  GLY  45           HA2      GLY  45  86.274 -14.081   8.067
  346    HA3  GLY  45           HA3      GLY  45  85.715 -12.782   7.019
  347    H    PHE  46           H        PHE  46  87.278 -11.093   6.450
  348    HA   PHE  46           HA       PHE  46  89.769 -12.223   5.633
  349    HB2  PHE  46           HB2      PHE  46  88.341 -10.343   4.524
  350    HB3  PHE  46           HB1      PHE  46  89.210  -9.269   5.621
  351    HD1  PHE  46           HD2      PHE  46  89.778 -11.992   3.112
  352    HD2  PHE  46           HD1      PHE  46  91.356  -8.498   5.050
  353    HE1  PHE  46           HE2      PHE  46  91.738 -12.037   1.595
  354    HE2  PHE  46           HE1      PHE  46  93.317  -8.543   3.531
  355    HZ   PHE  46           HZ       PHE  46  93.507 -10.312   1.804
  356    H    THR  47           H        THR  47  91.888 -11.471   6.178
  357    HA   THR  47           HA       THR  47  92.213 -11.006   9.015
  358    HB   THR  47           HB       THR  47  94.402 -11.067   6.941
  359    HG1  THR  47           HG1      THR  47  92.842 -13.121   8.045
  360   HG21  THR  47          HG21      THR  47  94.937 -10.381   9.283
  361   HG22  THR  47          HG22      THR  47  95.739 -11.877   8.804
  362   HG23  THR  47          HG23      THR  47  94.315 -11.934   9.842
  363    H    TYR  48           H        TYR  48  91.356  -8.909   9.279
  364    HA   TYR  48           HA       TYR  48  92.216  -6.642   7.801
  365    HB2  TYR  48           HB2      TYR  48  90.795  -7.070  10.403
  366    HB3  TYR  48           HB3      TYR  48  91.373  -5.458   9.997
  367    HD1  TYR  48           HD2      TYR  48  90.879  -4.742   7.469
  368    HD2  TYR  48           HD1      TYR  48  88.637  -7.634   9.712
  369    HE1  TYR  48           HE2      TYR  48  88.932  -4.383   5.982
  370    HE2  TYR  48           HE1      TYR  48  86.686  -7.271   8.225
  371    HH   TYR  48           HH       TYR  48  86.273  -4.706   6.339
  372    H    THR  49           H        THR  49  93.649  -4.981   8.382
  373    HA   THR  49           HA       THR  49  95.992  -5.902   9.841
  374    HB   THR  49           HB       THR  49  97.044  -3.868   9.042
  375    HG1  THR  49           HG1      THR  49  95.114  -2.580   9.364
  376   HG21  THR  49          HG21      THR  49  97.061  -4.395   6.775
  377   HG22  THR  49          HG22      THR  49  95.323  -4.687   6.726
  378   HG23  THR  49          HG23      THR  49  96.395  -5.877   7.464
  379    H    ASP  50           H        ASP  50  96.975  -4.647  11.558
  380    HA   ASP  50           HA       ASP  50  95.292  -4.099  13.698
  381    HB2  ASP  50           HB2      ASP  50  97.924  -2.682  13.383
  382    HB3  ASP  50           HB1      ASP  50  97.186  -3.335  14.844
  383    H    ALA  51           H        ALA  51  96.522  -1.935  11.201
  384    HA   ALA  51           HA       ALA  51  95.729   0.514  12.326
  385    HB1  ALA  51           HB1      ALA  51  97.172   0.570  10.436
  386    HB2  ALA  51           HB2      ALA  51  95.646   1.272   9.898
  387    HB3  ALA  51           HB3      ALA  51  96.055  -0.388   9.464
  388    H    ASN  52           H        ASN  52  93.967  -1.780  10.275
  389    HA   ASN  52           HA       ASN  52  91.594  -0.125  10.221
  390    HB2  ASN  52           HB2      ASN  52  92.605  -2.254   8.689
  391    HB3  ASN  52           HB1      ASN  52  91.166  -2.902   9.465
  392   HD21  ASN  52          HD21      ASN  52  90.281  -2.893   7.166
  393   HD22  ASN  52          HD22      ASN  52  89.614  -1.448   6.572
  394    H    LYS  53           H        LYS  53  92.895  -2.660  12.172
  395    HA   LYS  53           HA       LYS  53  90.356  -3.292  13.443
  396    HB2  LYS  53           HB2      LYS  53  91.567  -5.227  13.511
  397    HB3  LYS  53           HB3      LYS  53  93.107  -4.384  13.430
  398    HG2  LYS  53           HG2      LYS  53  92.971  -3.821  15.803
  399    HG3  LYS  53           HG3      LYS  53  91.364  -4.543  15.906
  400    HD2  LYS  53           HD2      LYS  53  92.494  -6.705  15.049
  401    HD3  LYS  53           HD3      LYS  53  94.016  -5.918  15.470
  402    HE2  LYS  53           HE2      LYS  53  93.398  -7.175  17.400
  403    HE3  LYS  53           HE3      LYS  53  92.995  -5.500  17.779
  404    HZ1  LYS  53           HZ1      LYS  53  91.274  -7.405  18.162
  405    HZ2  LYS  53           HZ2      LYS  53  90.960  -7.185  16.506
  406    HZ3  LYS  53           HZ3      LYS  53  90.769  -5.890  17.590
  407    H    ASN  54           H        ASN  54  92.703  -0.930  13.622
  408    HA   ASN  54           HA       ASN  54  92.896  -0.461  16.407
  409    HB2  ASN  54           HB2      ASN  54  93.991   1.493  15.826
  410    HB3  ASN  54           HB1      ASN  54  94.243   0.527  14.379
  411   HD21  ASN  54          HD21      ASN  54  91.543   0.821  13.307
  412   HD22  ASN  54          HD22      ASN  54  91.364   2.440  12.834
  413    H    LYS  55           H        LYS  55  90.410   0.014  14.133
  414    HA   LYS  55           HA       LYS  55  88.303   0.947  14.265
  415    HB2  LYS  55           HB2      LYS  55  88.877   0.671  17.222
  416    HB3  LYS  55           HB3      LYS  55  87.301   1.076  16.544
  417    HG2  LYS  55           HG2      LYS  55  87.053  -1.032  15.529
  418    HG3  LYS  55           HG3      LYS  55  88.779  -1.382  15.618
  419    HD2  LYS  55           HD2      LYS  55  88.696  -1.822  17.934
  420    HD3  LYS  55           HD3      LYS  55  87.150  -0.997  18.127
  421    HE2  LYS  55           HE2      LYS  55  87.366  -3.431  16.364
  422    HE3  LYS  55           HE3      LYS  55  87.174  -3.604  18.109
  423    HZ1  LYS  55           HZ1      LYS  55  85.032  -3.152  17.912
  424    HZ2  LYS  55           HZ2      LYS  55  85.202  -3.083  16.222
  425    HZ3  LYS  55           HZ3      LYS  55  85.365  -1.672  17.153
  426    H    GLY  56           H        GLY  56  89.756   2.849  13.438
  427    HA2  GLY  56           HA2      GLY  56  89.975   5.065  15.311
  428    HA3  GLY  56           HA3      GLY  56  90.475   5.069  13.624
  429    H    ILE  57           H        ILE  57  88.045   4.211  12.454
  430    HA   ILE  57           HA       ILE  57  86.038   6.178  13.294
  431    HB   ILE  57           HB       ILE  57  85.866   7.181  11.102
  432   HG12  ILE  57          HG12      ILE  57  87.810   6.537   9.456
  433   HG13  ILE  57          HG13      ILE  57  87.877   5.046  10.389
  434   HG21  ILE  57          HG21      ILE  57  87.927   8.414  11.077
  435   HG22  ILE  57          HG22      ILE  57  88.800   7.083  11.838
  436   HG23  ILE  57          HG23      ILE  57  87.604   7.993  12.760
  437   HD11  ILE  57          HD11      ILE  57  86.228   5.456   8.239
  438   HD12  ILE  57          HD12      ILE  57  85.147   5.842   9.573
  439   HD13  ILE  57          HD13      ILE  57  85.932   4.266   9.501
  440    H    THR  58           H        THR  58  84.075   5.982  11.718
  441    HA   THR  58           HA       THR  58  83.557   3.094  11.340
  442    HB   THR  58           HB       THR  58  81.634   5.351  11.935
  443    HG1  THR  58           HG1      THR  58  83.151   4.257  13.563
  444   HG21  THR  58          HG21      THR  58  80.564   3.682  10.525
  445   HG22  THR  58          HG22      THR  58  79.988   3.484  12.179
  446   HG23  THR  58          HG23      THR  58  81.199   2.382  11.531
  447    H    TRP  59           H        TRP  59  82.712   2.344   9.445
  448    HA   TRP  59           HA       TRP  59  83.114   3.858   7.084
  449    HB2  TRP  59           HB2      TRP  59  81.291   1.461   7.275
  450    HB3  TRP  59           HB1      TRP  59  82.244   2.011   5.894
  451    HD1  TRP  59           HD1      TRP  59  85.013   2.445   7.308
  452    HE1  TRP  59           HE1      TRP  59  86.385   0.407   8.092
  453    HE3  TRP  59           HE3      TRP  59  81.316  -1.056   7.629
  454    HZ2  TRP  59           HZ2      TRP  59  85.958  -2.337   8.801
  455    HZ3  TRP  59           HZ3      TRP  59  81.823  -3.369   8.354
  456    HH2  TRP  59           HH2      TRP  59  84.139  -4.011   8.940
  457    H    LYS  60           H        LYS  60  81.789   5.125   5.932
  458    HA   LYS  60           HA       LYS  60  78.913   5.105   6.336
  459    HB2  LYS  60           HB2      LYS  60  80.611   7.503   7.077
  460    HB3  LYS  60           HB3      LYS  60  78.863   7.556   6.861
  461    HG2  LYS  60           HG2      LYS  60  78.729   5.678   8.592
  462    HG3  LYS  60           HG3      LYS  60  80.424   6.012   8.940
  463    HD2  LYS  60           HD2      LYS  60  78.337   8.198   8.978
  464    HD3  LYS  60           HD3      LYS  60  78.684   7.217  10.402
  465    HE2  LYS  60           HE2      LYS  60  81.100   7.853  10.183
  466    HE3  LYS  60           HE3      LYS  60  80.649   8.948   8.877
  467    HZ1  LYS  60           HZ1      LYS  60  79.038   9.950  10.514
  468    HZ2  LYS  60           HZ2      LYS  60  80.685  10.240  10.816
  469    HZ3  LYS  60           HZ3      LYS  60  79.844   9.074  11.722
  470    H    GLU  61           H        GLU  61  78.351   7.550   5.099
  471    HA   GLU  61           HA       GLU  61  78.899   6.882   2.369
  472    HB2  GLU  61           HB2      GLU  61  76.796   8.002   3.245
  473    HB3  GLU  61           HB3      GLU  61  77.749   9.479   3.400
  474    HG2  GLU  61           HG2      GLU  61  78.364   9.248   0.969
  475    HG3  GLU  61           HG3      GLU  61  77.220   7.911   0.862
  476    H    GLU  62           H        GLU  62  79.683   9.785   4.308
  477    HA   GLU  62           HA       GLU  62  81.498  10.839   2.391
  478    HB2  GLU  62           HB2      GLU  62  81.405  11.414   5.362
  479    HB3  GLU  62           HB3      GLU  62  82.096  12.440   4.103
  480    HG2  GLU  62           HG2      GLU  62  79.818  12.562   3.046
  481    HG3  GLU  62           HG3      GLU  62  79.177  11.699   4.444
  482    H    THR  63           H        THR  63  82.040   9.134   5.482
  483    HA   THR  63           HA       THR  63  84.779   9.115   5.598
  484    HB   THR  63           HB       THR  63  84.584   6.896   6.705
  485    HG1  THR  63           HG1      THR  63  82.675   6.497   5.136
  486   HG21  THR  63          HG21      THR  63  84.163   8.769   8.101
  487   HG22  THR  63          HG22      THR  63  82.835   7.650   8.404
  488   HG23  THR  63          HG23      THR  63  82.586   9.055   7.367
  489    H    LEU  64           H        LEU  64  82.673   7.114   3.606
  490    HA   LEU  64           HA       LEU  64  84.749   5.491   2.523
  491    HB2  LEU  64           HB2      LEU  64  81.871   5.875   2.086
  492    HB3  LEU  64           HB3      LEU  64  82.759   5.457   0.627
  493    HG   LEU  64           HG       LEU  64  83.058   3.922   3.216
  494   HD11  LEU  64          HD11      LEU  64  80.913   3.876   1.210
  495   HD12  LEU  64          HD12      LEU  64  80.959   3.174   2.824
  496   HD13  LEU  64          HD13      LEU  64  81.659   2.298   1.462
  497   HD21  LEU  64          HD21      LEU  64  84.634   2.769   2.084
  498   HD22  LEU  64          HD22      LEU  64  84.508   3.944   0.778
  499   HD23  LEU  64          HD23      LEU  64  83.529   2.478   0.743
  500    H    MET  65           H        MET  65  83.307   8.588   1.617
  501    HA   MET  65           HA       MET  65  84.364   8.752  -0.995
  502    HB2  MET  65           HB2      MET  65  83.751  10.980   0.958
  503    HB3  MET  65           HB1      MET  65  84.048  11.195  -0.767
  504    HG2  MET  65           HG2      MET  65  82.111   9.876  -1.338
  505    HG3  MET  65           HG1      MET  65  81.880   9.409   0.342
  506    HE1  MET  65           HE1      MET  65  80.529  11.281  -2.301
  507    HE2  MET  65           HE2      MET  65  81.909  12.372  -2.211
  508    HE3  MET  65           HE3      MET  65  80.297  12.971  -1.833
  509    H    GLU  66           H        GLU  66  85.622  10.237   2.004
  510    HA   GLU  66           HA       GLU  66  88.035  11.150   0.872
  511    HB2  GLU  66           HB2      GLU  66  87.514  10.309   3.735
  512    HB3  GLU  66           HB3      GLU  66  88.829  11.344   3.177
  513    HG2  GLU  66           HG2      GLU  66  87.031  12.887   2.226
  514    HG3  GLU  66           HG3      GLU  66  85.864  11.937   3.144
  515    H    TYR  67           H        TYR  67  87.023   8.067   2.130
  516    HA   TYR  67           HA       TYR  67  89.664   6.905   2.203
  517    HB2  TYR  67           HB2      TYR  67  88.103   5.978   3.725
  518    HB3  TYR  67           HB3      TYR  67  86.866   5.831   2.486
  519    HD1  TYR  67           HD2      TYR  67  87.032   4.085   0.731
  520    HD2  TYR  67           HD1      TYR  67  89.844   4.320   3.971
  521    HE1  TYR  67           HE2      TYR  67  87.791   1.777   0.240
  522    HE2  TYR  67           HE1      TYR  67  90.601   2.011   3.481
  523    HH   TYR  67           HH       TYR  67  89.346   0.220   0.685
  524    H    LEU  68           H        LEU  68  87.095   7.259  -0.112
  525    HA   LEU  68           HA       LEU  68  88.049   5.211  -1.905
  526    HB2  LEU  68           HB2      LEU  68  85.884   7.271  -1.930
  527    HB3  LEU  68           HB3      LEU  68  86.419   6.628  -3.476
  528    HG   LEU  68           HG       LEU  68  85.480   4.954  -1.127
  529   HD11  LEU  68          HD11      LEU  68  83.622   6.143  -2.088
  530   HD12  LEU  68          HD12      LEU  68  83.550   4.482  -2.667
  531   HD13  LEU  68          HD13      LEU  68  84.149   5.762  -3.723
  532   HD21  LEU  68          HD21      LEU  68  85.318   3.383  -3.342
  533   HD22  LEU  68          HD22      LEU  68  86.696   3.392  -2.245
  534   HD23  LEU  68          HD23      LEU  68  86.747   4.336  -3.731
  535    H    GLU  69           H        GLU  69  88.707   8.559  -1.334
  536    HA   GLU  69           HA       GLU  69  89.984   8.945  -3.929
  537    HB2  GLU  69           HB2      GLU  69  88.921  10.912  -3.314
  538    HB3  GLU  69           HB3      GLU  69  89.249  10.678  -1.599
  539    HG2  GLU  69           HG2      GLU  69  91.516  11.349  -1.836
  540    HG3  GLU  69           HG3      GLU  69  91.446  11.225  -3.593
  541    H    ASN  70           H        ASN  70  90.750   7.795  -0.843
  542    HA   ASN  70           HA       ASN  70  93.498   7.390  -1.510
  543    HB2  ASN  70           HB2      ASN  70  94.467   8.742   0.317
  544    HB3  ASN  70           HB1      ASN  70  93.682   9.744  -0.900
  545   HD21  ASN  70          HD21      ASN  70  93.413   8.551   2.429
  546   HD22  ASN  70          HD22      ASN  70  92.165   9.607   2.887
  547    HA   PRO  71           HA       PRO  71  91.191   4.509   1.452
  548    HB2  PRO  71           HB2      PRO  71  92.907   2.689  -0.190
  549    HB3  PRO  71           HB1      PRO  71  91.233   2.473   0.354
  550    HG2  PRO  71           HG2      PRO  71  91.822   3.142  -2.165
  551    HG3  PRO  71           HG1      PRO  71  90.372   3.748  -1.347
  552    HD2  PRO  71           HD2      PRO  71  92.875   5.193  -2.047
  553    HD3  PRO  71           HD1      PRO  71  91.230   5.825  -1.826
  554    H    LYS  72           H        LYS  72  94.578   4.668   0.406
  555    HA   LYS  72           HA       LYS  72  95.567   3.313   2.750
  556    HB2  LYS  72           HB2      LYS  72  96.699   3.230   0.532
  557    HB3  LYS  72           HB3      LYS  72  97.090   4.938   0.707
  558    HG2  LYS  72           HG2      LYS  72  98.945   4.342   1.850
  559    HG3  LYS  72           HG3      LYS  72  97.902   3.743   3.137
  560    HD2  LYS  72           HD2      LYS  72  98.656   2.084   0.713
  561    HD3  LYS  72           HD3      LYS  72  99.557   2.048   2.228
  562    HE2  LYS  72           HE2      LYS  72  96.631   1.342   1.860
  563    HE3  LYS  72           HE3      LYS  72  97.944   0.224   2.226
  564    HZ1  LYS  72           HZ1      LYS  72  98.294   1.858   4.217
  565    HZ2  LYS  72           HZ2      LYS  72  97.138   0.616   4.304
  566    HZ3  LYS  72           HZ3      LYS  72  96.655   2.208   3.955
  567    H    LYS  73           H        LYS  73  95.653   6.693   1.592
  568    HA   LYS  73           HA       LYS  73  97.065   7.684   3.832
  569    HB2  LYS  73           HB2      LYS  73  96.495   8.759   1.472
  570    HB3  LYS  73           HB3      LYS  73  95.146   9.451   2.373
  571    HG2  LYS  73           HG2      LYS  73  96.834  10.225   4.104
  572    HG3  LYS  73           HG3      LYS  73  98.099   9.742   2.975
  573    HD2  LYS  73           HD2      LYS  73  97.854  11.965   2.366
  574    HD3  LYS  73           HD3      LYS  73  96.683  11.224   1.278
  575    HE2  LYS  73           HE2      LYS  73  95.529  13.046   2.283
  576    HE3  LYS  73           HE3      LYS  73  94.950  11.614   3.134
  577    HZ1  LYS  73           HZ1      LYS  73  96.000  12.197   5.024
  578    HZ2  LYS  73           HZ2      LYS  73  95.876  13.763   4.375
  579    HZ3  LYS  73           HZ3      LYS  73  97.325  12.889   4.223
  580    H    TYR  74           H        TYR  74  93.814   6.670   3.507
  581    HA   TYR  74           HA       TYR  74  92.726   8.397   5.545
  582    HB2  TYR  74           HB2      TYR  74  91.543   7.037   3.575
  583    HB3  TYR  74           HB3      TYR  74  91.399   5.817   4.838
  584    HD1  TYR  74           HD1      TYR  74  91.020   9.546   4.503
  585    HD2  TYR  74           HD2      TYR  74  89.443   5.886   6.111
  586    HE1  TYR  74           HE1      TYR  74  89.122  10.796   5.493
  587    HE2  TYR  74           HE2      TYR  74  87.547   7.139   7.102
  588    HH   TYR  74           HH       TYR  74  86.963   9.362   7.770
  589    H    ILE  75           H        ILE  75  93.375   4.890   5.399
  590    HA   ILE  75           HA       ILE  75  93.899   4.955   8.313
  591    HB   ILE  75           HB       ILE  75  92.516   2.728   6.795
  592   HG12  ILE  75          HG12      ILE  75  91.301   4.526   8.901
  593   HG13  ILE  75          HG13      ILE  75  91.238   4.947   7.191
  594   HG21  ILE  75          HG21      ILE  75  93.301   3.153   9.686
  595   HG22  ILE  75          HG22      ILE  75  93.697   1.789   8.640
  596   HG23  ILE  75          HG23      ILE  75  92.045   2.006   9.217
  597   HD11  ILE  75          HD11      ILE  75  90.271   2.297   8.292
  598   HD12  ILE  75          HD12      ILE  75  90.038   2.921   6.659
  599   HD13  ILE  75          HD13      ILE  75  89.215   3.683   8.021
  600    HA   PRO  76           HA       PRO  76  97.662   3.612   5.832
  601    HB2  PRO  76           HB2      PRO  76  98.684   4.437   8.532
  602    HB3  PRO  76           HB1      PRO  76  99.399   4.704   6.928
  603    HG2  PRO  76           HG2      PRO  76  98.115   6.653   8.203
  604    HG3  PRO  76           HG1      PRO  76  97.992   6.461   6.445
  605    HD2  PRO  76           HD2      PRO  76  95.955   5.890   8.539
  606    HD3  PRO  76           HD1      PRO  76  95.726   6.319   6.830
  607    H    GLY  77           H        GLY  77  98.212   1.516   5.786
  608    HA2  GLY  77           HA2      GLY  77  99.245  -0.355   7.028
  609    HA3  GLY  77           HA3      GLY  77  98.045  -0.071   8.285
  610    H    THR  78           H        THR  78  95.871   0.429   6.406
  611    HA   THR  78           HA       THR  78  94.789  -2.131   6.170
  612    HB   THR  78           HB       THR  78  93.500   0.010   6.082
  613    HG1  THR  78           HG1      THR  78  93.128  -2.239   4.749
  614   HG21  THR  78          HG21      THR  78  93.412   1.282   4.063
  615   HG22  THR  78          HG22      THR  78  94.357   0.077   3.186
  616   HG23  THR  78          HG23      THR  78  95.122   1.060   4.435
  617    H    LYS  79           H        LYS  79  94.779  -3.680   4.590
  618    HA   LYS  79           HA       LYS  79  96.863  -3.462   2.567
  619    HB2  LYS  79           HB2      LYS  79  94.985  -5.712   3.321
  620    HB3  LYS  79           HB3      LYS  79  96.190  -5.827   2.041
  621    HG2  LYS  79           HG2      LYS  79  97.737  -4.882   4.086
  622    HG3  LYS  79           HG3      LYS  79  96.555  -5.828   4.987
  623    HD2  LYS  79           HD2      LYS  79  98.155  -6.874   2.632
  624    HD3  LYS  79           HD3      LYS  79  98.552  -7.168   4.325
  625    HE2  LYS  79           HE2      LYS  79  96.434  -8.318   4.670
  626    HE3  LYS  79           HE3      LYS  79  95.919  -7.933   3.028
  627    HZ1  LYS  79           HZ1      LYS  79  97.497  -9.353   2.118
  628    HZ2  LYS  79           HZ2      LYS  79  96.918 -10.222   3.458
  629    HZ3  LYS  79           HZ3      LYS  79  98.415  -9.423   3.541
  630    H    MET  80           H        MET  80  96.094  -1.942   1.081
  631    HA   MET  80           HA       MET  80  94.446  -2.995  -0.990
  632    HB2  MET  80           HB2      MET  80  92.604  -2.407   0.483
  633    HB3  MET  80           HB1      MET  80  93.254  -0.781   0.699
  634    HG2  MET  80           HG2      MET  80  92.791  -0.170  -1.537
  635    HG3  MET  80           HG1      MET  80  92.608  -1.846  -2.051
  636    HE1  MET  80           HE1      MET  80  89.228   0.543  -2.018
  637    HE2  MET  80           HE2      MET  80  90.378  -0.180  -3.141
  638    HE3  MET  80           HE3      MET  80  90.916   1.063  -2.018
  639    H    ILE  81           H        ILE  81  96.100  -2.437  -2.349
  640    HA   ILE  81           HA       ILE  81  96.540   0.463  -2.757
  641    HB   ILE  81           HB       ILE  81  98.543  -1.803  -2.925
  642   HG12  ILE  81          HG12      ILE  81  99.782  -0.180  -1.368
  643   HG13  ILE  81          HG13      ILE  81  98.255   0.688  -1.225
  644   HG21  ILE  81          HG21      ILE  81 100.112   0.120  -3.575
  645   HG22  ILE  81          HG22      ILE  81  98.653   1.041  -3.942
  646   HG23  ILE  81          HG23      ILE  81  99.004  -0.445  -4.825
  647   HD11  ILE  81          HD11      ILE  81  97.442  -0.833   0.227
  648   HD12  ILE  81          HD12      ILE  81  99.064  -1.515   0.301
  649   HD13  ILE  81          HD13      ILE  81  97.881  -2.179  -0.823
  650    H    PHE  82           H        PHE  82  95.434   0.941  -4.562
  651    HA   PHE  82           HA       PHE  82  96.063  -0.538  -7.007
  652    HB2  PHE  82           HB2      PHE  82  94.084  -1.702  -6.279
  653    HB3  PHE  82           HB1      PHE  82  93.249  -0.184  -5.949
  654    HD1  PHE  82           HD2      PHE  82  94.892  -2.110  -8.707
  655    HD2  PHE  82           HD1      PHE  82  91.980   0.862  -7.637
  656    HE1  PHE  82           HE2      PHE  82  94.104  -2.036 -11.057
  657    HE2  PHE  82           HE1      PHE  82  91.191   0.935  -9.986
  658    HZ   PHE  82           HZ       PHE  82  92.254  -0.514 -11.697
  659    H    ALA  83           H        ALA  83  93.375   1.680  -6.404
  660    HA   ALA  83           HA       ALA  83  94.777   4.005  -7.344
  661    HB1  ALA  83           HB1      ALA  83  94.429   2.705  -9.462
  662    HB2  ALA  83           HB2      ALA  83  93.647   4.286  -9.457
  663    HB3  ALA  83           HB3      ALA  83  92.692   2.827  -9.192
  664    H    GLY  84           H        GLY  84  93.839   5.689  -6.387
  665    HA2  GLY  84           HA2      GLY  84  91.275   5.407  -5.084
  666    HA3  GLY  84           HA3      GLY  84  92.317   6.827  -5.053
  667    H    ILE  85           H        ILE  85  89.710   7.341  -5.304
  668    HA   ILE  85           HA       ILE  85  88.927   7.484  -8.100
  669    HB   ILE  85           HB       ILE  85  87.658   8.518  -5.560
  670   HG12  ILE  85          HG12      ILE  85  87.799   5.967  -6.247
  671   HG13  ILE  85          HG13      ILE  85  86.285   6.633  -5.646
  672   HG21  ILE  85          HG21      ILE  85  86.824   8.740  -8.450
  673   HG22  ILE  85          HG22      ILE  85  86.886  10.008  -7.226
  674   HG23  ILE  85          HG23      ILE  85  85.635   8.766  -7.150
  675   HD11  ILE  85          HD11      ILE  85  86.255   5.203  -7.832
  676   HD12  ILE  85          HD12      ILE  85  86.858   6.672  -8.598
  677   HD13  ILE  85          HD13      ILE  85  85.303   6.685  -7.766
  678    H    LYS  86           H        LYS  86  88.381   9.536  -9.140
  679    HA   LYS  86           HA       LYS  86  90.339  11.619  -8.430
  680    HB2  LYS  86           HB2      LYS  86  90.276  10.505 -10.738
  681    HB3  LYS  86           HB3      LYS  86  88.800  11.429 -11.012
  682    HG2  LYS  86           HG2      LYS  86  90.122  13.502 -10.337
  683    HG3  LYS  86           HG3      LYS  86  91.570  12.500 -10.436
  684    HD2  LYS  86           HD2      LYS  86  90.766  11.874 -12.801
  685    HD3  LYS  86           HD3      LYS  86  89.653  13.234 -12.652
  686    HE2  LYS  86           HE2      LYS  86  91.610  14.102 -13.717
  687    HE3  LYS  86           HE3      LYS  86  91.679  14.659 -12.045
  688    HZ1  LYS  86           HZ1      LYS  86  92.911  12.085 -12.604
  689    HZ2  LYS  86           HZ2      LYS  86  93.423  13.337 -11.576
  690    HZ3  LYS  86           HZ3      LYS  86  93.698  13.442 -13.249
  691    H    LYS  87           H        LYS  87  87.079  11.567  -9.920
  692    HA   LYS  87           HA       LYS  87  86.556  14.230  -8.870
  693    HB2  LYS  87           HB2      LYS  87  84.605  12.488 -10.366
  694    HB3  LYS  87           HB3      LYS  87  84.660  14.250 -10.277
  695    HG2  LYS  87           HG2      LYS  87  86.844  14.214 -11.472
  696    HG3  LYS  87           HG3      LYS  87  86.706  12.465 -11.628
  697    HD2  LYS  87           HD2      LYS  87  85.485  12.749 -13.505
  698    HD3  LYS  87           HD3      LYS  87  84.243  13.557 -12.552
  699    HE2  LYS  87           HE2      LYS  87  86.685  14.927 -13.715
  700    HE3  LYS  87           HE3      LYS  87  85.071  14.972 -14.427
  701    HZ1  LYS  87           HZ1      LYS  87  84.753  15.650 -11.774
  702    HZ2  LYS  87           HZ2      LYS  87  84.651  16.688 -13.116
  703    HZ3  LYS  87           HZ3      LYS  87  86.124  16.505 -12.289
  704    H    LYS  88           H        LYS  88  84.506  14.716  -7.774
  705    HA   LYS  88           HA       LYS  88  84.164  13.069  -5.460
  706    HB2  LYS  88           HB2      LYS  88  83.887  15.475  -5.284
  707    HB3  LYS  88           HB3      LYS  88  82.591  15.448  -6.480
  708    HG2  LYS  88           HG2      LYS  88  81.187  14.114  -4.992
  709    HG3  LYS  88           HG3      LYS  88  82.496  13.998  -3.815
  710    HD2  LYS  88           HD2      LYS  88  82.194  16.147  -3.061
  711    HD3  LYS  88           HD3      LYS  88  81.737  16.752  -4.653
  712    HE2  LYS  88           HE2      LYS  88  79.514  15.868  -4.447
  713    HE3  LYS  88           HE3      LYS  88  79.945  14.959  -2.999
  714    HZ1  LYS  88           HZ1      LYS  88  78.734  17.068  -2.569
  715    HZ2  LYS  88           HZ2      LYS  88  80.071  17.916  -3.184
  716    HZ3  LYS  88           HZ3      LYS  88  80.235  16.964  -1.787
  717    H    THR  89           H        THR  89  81.977  13.940  -8.151
  718    HA   THR  89           HA       THR  89  79.814  12.355  -7.457
  719    HB   THR  89           HB       THR  89  79.312  12.271  -9.904
  720    HG1  THR  89           HG1      THR  89  81.708  12.283 -10.334
  721   HG21  THR  89          HG21      THR  89  80.247  14.996  -8.971
  722   HG22  THR  89          HG22      THR  89  78.765  14.226  -8.403
  723   HG23  THR  89          HG23      THR  89  78.944  14.645 -10.107
  724    H    GLU  90           H        GLU  90  82.919  11.417  -8.698
  725    HA   GLU  90           HA       GLU  90  82.167   8.823  -9.629
  726    HB2  GLU  90           HB2      GLU  90  84.790  10.082  -8.843
  727    HB3  GLU  90           HB3      GLU  90  84.684   8.371  -9.248
  728    HG2  GLU  90           HG2      GLU  90  83.953   8.828 -11.458
  729    HG3  GLU  90           HG3      GLU  90  83.581  10.507 -11.071
  730    H    ARG  91           H        ARG  91  83.255  10.179  -6.569
  731    HA   ARG  91           HA       ARG  91  83.396   7.642  -5.211
  732    HB2  ARG  91           HB2      ARG  91  83.217  10.450  -4.075
  733    HB3  ARG  91           HB3      ARG  91  83.675   8.995  -3.189
  734    HG2  ARG  91           HG2      ARG  91  85.573   8.694  -4.806
  735    HG3  ARG  91           HG3      ARG  91  85.170  10.267  -5.492
  736    HD2  ARG  91           HD2      ARG  91  85.344  10.468  -2.608
  737    HD3  ARG  91           HD3      ARG  91  86.822   9.762  -3.254
  738    HE   ARG  91           HE       ARG  91  86.306  11.910  -4.894
  739   HH11  ARG  91          HH21      ARG  91  86.698  11.376  -1.496
  740   HH12  ARG  91          HH22      ARG  91  87.350  12.949  -1.184
  741   HH21  ARG  91          HH11      ARG  91  87.161  13.974  -4.491
  742   HH22  ARG  91          HH12      ARG  91  87.612  14.420  -2.880
  743    H    GLU  92           H        GLU  92  81.139  10.407  -5.174
  744    HA   GLU  92           HA       GLU  92  79.268   9.330  -3.387
  745    HB2  GLU  92           HB2      GLU  92  79.364  11.705  -4.302
  746    HB3  GLU  92           HB3      GLU  92  78.565  11.082  -5.746
  747    HG2  GLU  92           HG2      GLU  92  76.807  11.868  -4.342
  748    HG3  GLU  92           HG3      GLU  92  76.795  10.113  -4.173
  749    H    ASP  93           H        ASP  93  79.241   9.276  -6.965
  750    HA   ASP  93           HA       ASP  93  76.962   7.663  -7.257
  751    HB2  ASP  93           HB2      ASP  93  79.397   7.859  -9.046
  752    HB3  ASP  93           HB1      ASP  93  77.846   7.160  -9.508
  753    H    LEU  94           H        LEU  94  80.406   6.786  -7.087
  754    HA   LEU  94           HA       LEU  94  80.110   4.004  -7.375
  755    HB2  LEU  94           HB2      LEU  94  82.306   5.059  -7.505
  756    HB3  LEU  94           HB3      LEU  94  82.170   5.590  -5.831
  757    HG   LEU  94           HG       LEU  94  82.152   3.286  -5.048
  758   HD11  LEU  94          HD11      LEU  94  81.050   2.039  -6.688
  759   HD12  LEU  94          HD12      LEU  94  82.725   1.538  -6.909
  760   HD13  LEU  94          HD13      LEU  94  82.011   2.727  -7.997
  761   HD21  LEU  94          HD21      LEU  94  84.424   2.810  -5.409
  762   HD22  LEU  94          HD22      LEU  94  84.333   4.544  -5.701
  763   HD23  LEU  94          HD23      LEU  94  84.390   3.423  -7.061
  764    H    ILE  95           H        ILE  95  79.860   6.128  -4.592
  765    HA   ILE  95           HA       ILE  95  79.675   3.994  -2.700
  766    HB   ILE  95           HB       ILE  95  79.303   6.967  -2.557
  767   HG12  ILE  95          HG12      ILE  95  81.096   5.297  -0.829
  768   HG13  ILE  95          HG13      ILE  95  81.528   5.500  -2.520
  769   HG21  ILE  95          HG21      ILE  95  77.688   6.421  -0.972
  770   HG22  ILE  95          HG22      ILE  95  79.141   6.362   0.026
  771   HG23  ILE  95          HG23      ILE  95  78.435   4.870  -0.595
  772   HD11  ILE  95          HD11      ILE  95  82.000   7.724  -2.277
  773   HD12  ILE  95          HD12      ILE  95  82.295   7.235  -0.612
  774   HD13  ILE  95          HD13      ILE  95  80.755   7.964  -1.054
  775    H    ALA  96           H        ALA  96  77.457   5.802  -4.661
  776    HA   ALA  96           HA       ALA  96  75.075   5.224  -3.232
  777    HB1  ALA  96           HB1      ALA  96  75.361   6.932  -5.089
  778    HB2  ALA  96           HB2      ALA  96  73.919   5.922  -5.204
  779    HB3  ALA  96           HB3      ALA  96  75.318   5.582  -6.223
  780    H    TYR  97           H        TYR  97  76.973   3.506  -5.641
  781    HA   TYR  97           HA       TYR  97  75.042   1.391  -5.987
  782    HB2  TYR  97           HB2      TYR  97  76.492   1.782  -7.843
  783    HB3  TYR  97           HB3      TYR  97  77.929   1.707  -6.824
  784    HD1  TYR  97           HD1      TYR  97  75.098  -0.311  -8.162
  785    HD2  TYR  97           HD2      TYR  97  78.962  -0.373  -6.293
  786    HE1  TYR  97           HE1      TYR  97  75.226  -2.761  -8.512
  787    HE2  TYR  97           HE2      TYR  97  79.091  -2.824  -6.643
  788    HH   TYR  97           HH       TYR  97  76.371  -4.621  -8.068
  789    H    LEU  98           H        LEU  98  78.104   1.826  -4.225
  790    HA   LEU  98           HA       LEU  98  78.357  -0.765  -3.203
  791    HB2  LEU  98           HB2      LEU  98  79.229   1.931  -2.189
  792    HB3  LEU  98           HB3      LEU  98  79.547   0.471  -1.259
  793    HG   LEU  98           HG       LEU  98  80.291   0.606  -4.179
  794   HD11  LEU  98          HD11      LEU  98  82.069   1.475  -1.884
  795   HD12  LEU  98          HD12      LEU  98  81.306   2.580  -3.026
  796   HD13  LEU  98          HD13      LEU  98  82.502   1.421  -3.592
  797   HD21  LEU  98          HD21      LEU  98  81.384  -1.341  -3.748
  798   HD22  LEU  98          HD22      LEU  98  80.372  -1.419  -2.307
  799   HD23  LEU  98          HD23      LEU  98  82.005  -0.763  -2.205
  800    H    LYS  99           H        LYS  99  76.144   1.773  -2.422
  801    HA   LYS  99           HA       LYS  99  75.419   0.737   0.180
  802    HB2  LYS  99           HB2      LYS  99  74.442   2.951  -1.589
  803    HB3  LYS  99           HB3      LYS  99  73.418   2.393  -0.268
  804    HG2  LYS  99           HG2      LYS  99  75.441   2.693   1.260
  805    HG3  LYS  99           HG3      LYS  99  76.216   3.534  -0.082
  806    HD2  LYS  99           HD2      LYS  99  73.513   4.311   1.047
  807    HD3  LYS  99           HD3      LYS  99  75.031   5.054   1.549
  808    HE2  LYS  99           HE2      LYS  99  75.431   5.525  -0.950
  809    HE3  LYS  99           HE3      LYS  99  73.726   5.134  -1.173
  810    HZ1  LYS  99           HZ1      LYS  99  74.880   7.284   0.510
  811    HZ2  LYS  99           HZ2      LYS  99  73.251   6.811   0.594
  812    HZ3  LYS  99           HZ3      LYS  99  73.877   7.457  -0.847
  813    H    LYS 100           H        LYS 100  73.831   0.894  -3.010
  814    HA   LYS 100           HA       LYS 100  71.657  -0.794  -2.154
  815    HB2  LYS 100           HB2      LYS 100  71.617   1.008  -3.999
  816    HB3  LYS 100           HB3      LYS 100  72.381  -0.210  -5.020
  817    HG2  LYS 100           HG2      LYS 100  70.504  -1.781  -4.433
  818    HG3  LYS 100           HG3      LYS 100  69.713  -0.443  -3.599
  819    HD2  LYS 100           HD2      LYS 100  70.516  -0.417  -6.524
  820    HD3  LYS 100           HD3      LYS 100  68.885  -0.734  -5.935
  821    HE2  LYS 100           HE2      LYS 100  69.168   1.543  -4.675
  822    HE3  LYS 100           HE3      LYS 100  70.457   1.828  -5.843
  823    HZ1  LYS 100           HZ1      LYS 100  68.526   0.954  -7.444
  824    HZ2  LYS 100           HZ2      LYS 100  68.764   2.597  -7.078
  825    HZ3  LYS 100           HZ3      LYS 100  67.586   1.700  -6.244
  826    H    ALA 101           H        ALA 101  74.832  -1.313  -3.238
  827    HA   ALA 101           HA       ALA 101  74.329  -3.943  -4.380
  828    HB1  ALA 101           HB1      ALA 101  76.099  -2.439  -5.288
  829    HB2  ALA 101           HB2      ALA 101  76.721  -4.008  -4.776
  830    HB3  ALA 101           HB3      ALA 101  76.962  -2.588  -3.757
  831    H    THR 102           H        THR 102  75.476  -2.499  -1.401
  832    HA   THR 102           HA       THR 102  76.229  -5.096  -0.285
  833    HB   THR 102           HB       THR 102  76.855  -3.733   1.710
  834    HG1  THR 102           HG1      THR 102  75.384  -1.924   0.349
  835   HG21  THR 102          HG21      THR 102  78.688  -2.469   0.512
  836   HG22  THR 102          HG22      THR 102  77.912  -2.927  -1.004
  837   HG23  THR 102          HG23      THR 102  78.548  -4.170   0.068
  838    H    ASN 103           H        ASN 103  73.447  -3.383  -0.724
  839    HA   ASN 103           HA       ASN 103  72.199  -4.124   1.824
  840    HB2  ASN 103           HB2      ASN 103  71.413  -2.407  -0.512
  841    HB3  ASN 103           HB1      ASN 103  70.196  -2.973   0.623
  842   HD21  ASN 103          HD21      ASN 103  73.483  -2.319   1.710
  843   HD22  ASN 103          HD22      ASN 103  73.098  -0.925   2.597
  844    H    GLU 104           H        GLU 104  72.412  -5.107  -1.491
  845    HA   GLU 104           HA       GLU 104  70.904  -7.520  -0.916
  846    HB2  GLU 104           HB2      GLU 104  69.364  -7.209  -2.842
  847    HB3  GLU 104           HB3      GLU 104  69.089  -6.030  -1.560
  848    HG2  GLU 104           HG2      GLU 104  70.464  -4.382  -2.786
  849    HG3  GLU 104           HG3      GLU 104  70.710  -5.556  -4.077
  850    HHA  HEC 201           HA       HEC 105  89.497  -3.576   3.181
  851    HHB  HEC 201           HB       HEC 105  85.656  -0.056  -0.399
  852    HHC  HEC 201           HC       HEC 105  88.944  -1.732  -5.540
  853    HHD  HEC 201           HD       HEC 105  92.365  -5.728  -2.024
  854   HMA1  HEC 201          HMA1      HEC 105  85.560   0.686   1.777
  855   HMA2  HEC 201          HMA2      HEC 105  85.655  -0.059   3.370
  856   HMA3  HEC 201          HMA3      HEC 105  84.620  -0.763   2.131
  857   HAA1  HEC 201          HAA1      HEC 105  87.222  -0.972   4.514
  858   HAA2  HEC 201          HAA2      HEC 105  88.511  -2.153   4.449
  859   HBA1  HEC 201          HBA1      HEC 105  87.092  -3.931   4.738
  860   HBA2  HEC 201          HBA2      HEC 105  85.749  -3.139   3.918
  861   HMB1  HEC 201          HMB1      HEC 105  84.219   0.084  -2.738
  862   HMB2  HEC 201          HMB2      HEC 105  84.945   1.192  -3.897
  863   HMB3  HEC 201          HMB3      HEC 105  85.193   1.440  -2.172
  864    HAB  HEC 201           HAB      HEC 105  87.405  -0.565  -6.185
  865   HBB1  HEC 201          HBB1      HEC 105  86.793   1.981  -4.753
  866   HBB2  HEC 201          HBB2      HEC 105  87.952   1.666  -6.041
  867   HBB3  HEC 201          HBB3      HEC 105  86.240   1.840  -6.421
  868   HMC1  HEC 201          HMC1      HEC 105  89.907  -3.283  -6.898
  869   HMC2  HEC 201          HMC2      HEC 105  91.379  -4.247  -6.932
  870   HMC3  HEC 201          HMC3      HEC 105  91.470  -2.508  -6.659
  871    HAC  HEC 201           HAC      HEC 105  92.813  -6.120  -3.956
  872   HBC1  HEC 201          HBC1      HEC 105  93.379  -3.933  -5.851
  873   HBC2  HEC 201          HBC2      HEC 105  93.736  -5.538  -6.489
  874   HBC3  HEC 201          HBC3      HEC 105  94.495  -4.995  -4.994
  875   HMD1  HEC 201          HMD1      HEC 105  93.453  -6.532   1.475
  876   HMD2  HEC 201          HMD2      HEC 105  93.598  -6.269  -0.259
  877   HMD3  HEC 201          HMD3      HEC 105  92.485  -7.490   0.356
  878   HAD1  HEC 201          HAD1      HEC 105  92.086  -6.322   3.137
  879   HAD2  HEC 201          HAD2      HEC 105  90.572  -5.600   3.641
  880   HBD1  HEC 201          HBD1      HEC 105  91.714  -3.409   3.870
  881   HBD2  HEC 201          HBD2      HEC 105  93.235  -4.182   3.436
  882    H1   HOH 301           H2       HOH 200  79.963   3.498  -0.572
  883    H2   HOH 301           H1       HOH 200  80.655   2.155  -0.465
  884    H1   HOH 302           H2       HOH 201  87.137   5.042   5.976
  885    H2   HOH 302           H1       HOH 201  86.174   5.700   5.011
  886    H1   HOH 303           H2       HOH 202  82.160  -5.850   6.233
  887    H2   HOH 303           H1       HOH 202  83.523  -5.202   6.356
  888    H1   HOH 304           H2       HOH 203  82.841 -10.062   0.309
  889    H2   HOH 304           H1       HOH 203  81.614 -10.943   0.434
  Start of MODEL    5
    1    H1   GLY   1           H1       GLY   1  76.080  11.315  -7.158
    2    H2   GLY   1           H2       GLY   1  74.574  12.100  -7.163
    3    H3   GLY   1           H3       GLY   1  75.099  11.253  -8.539
    4    HA2  GLY   1           HA2      GLY   1  75.197   9.398  -6.521
    5    HA3  GLY   1           HA3      GLY   1  73.701  10.293  -6.254
    6    H    ASP   2           H        ASP   2  75.501   8.313  -8.525
    7    HA   ASP   2           HA       ASP   2  72.975   7.714  -9.944
    8    HB2  ASP   2           HB2      ASP   2  75.688   8.158 -11.213
    9    HB3  ASP   2           HB1      ASP   2  74.247   7.593 -12.056
   10    H    VAL   3           H        VAL   3  72.780   5.808  -8.736
   11    HA   VAL   3           HA       VAL   3  74.682   3.879  -8.229
   12    HB   VAL   3           HB       VAL   3  72.493   3.654  -7.285
   13   HG11  VAL   3          HG11      VAL   3  71.100   4.726  -8.888
   14   HG12  VAL   3          HG12      VAL   3  70.562   3.047  -8.864
   15   HG13  VAL   3          HG13      VAL   3  71.597   3.623 -10.171
   16   HG21  VAL   3          HG21      VAL   3  73.809   1.551  -8.070
   17   HG22  VAL   3          HG22      VAL   3  72.574   1.428  -9.322
   18   HG23  VAL   3          HG23      VAL   3  72.117   1.350  -7.621
   19    H    GLU   4           H        GLU   4  73.440   4.880 -11.258
   20    HA   GLU   4           HA       GLU   4  73.852   2.432 -12.693
   21    HB2  GLU   4           HB2      GLU   4  73.581   5.308 -13.584
   22    HB3  GLU   4           HB3      GLU   4  73.763   3.961 -14.708
   23    HG2  GLU   4           HG2      GLU   4  71.726   2.942 -13.955
   24    HG3  GLU   4           HG3      GLU   4  71.607   4.050 -12.588
   25    H    LYS   5           H        LYS   5  75.668   5.512 -12.700
   26    HA   LYS   5           HA       LYS   5  77.930   4.322 -14.012
   27    HB2  LYS   5           HB2      LYS   5  77.478   6.985 -12.655
   28    HB3  LYS   5           HB3      LYS   5  79.037   6.527 -13.342
   29    HG2  LYS   5           HG2      LYS   5  78.118   6.326 -15.541
   30    HG3  LYS   5           HG3      LYS   5  76.465   6.419 -14.932
   31    HD2  LYS   5           HD2      LYS   5  78.321   8.705 -14.356
   32    HD3  LYS   5           HD3      LYS   5  77.653   8.558 -15.981
   33    HE2  LYS   5           HE2      LYS   5  75.418   8.727 -15.199
   34    HE3  LYS   5           HE3      LYS   5  75.896   8.426 -13.529
   35    HZ1  LYS   5           HZ1      LYS   5  76.212  10.582 -13.232
   36    HZ2  LYS   5           HZ2      LYS   5  75.644  10.878 -14.806
   37    HZ3  LYS   5           HZ3      LYS   5  77.305  10.650 -14.527
   38    H    GLY   6           H        GLY   6  76.796   4.513 -10.800
   39    HA2  GLY   6           HA2      GLY   6  79.302   4.338  -9.433
   40    HA3  GLY   6           HA3      GLY   6  77.721   3.921  -8.766
   41    H    LYS   7           H        LYS   7  76.997   2.061 -10.791
   42    HA   LYS   7           HA       LYS   7  78.221  -0.300  -9.762
   43    HB2  LYS   7           HB2      LYS   7  75.857  -0.140 -10.616
   44    HB3  LYS   7           HB3      LYS   7  76.513  -0.025 -12.246
   45    HG2  LYS   7           HG2      LYS   7  77.550  -2.282 -10.611
   46    HG3  LYS   7           HG3      LYS   7  75.850  -2.390 -11.053
   47    HD2  LYS   7           HD2      LYS   7  78.109  -1.904 -13.023
   48    HD3  LYS   7           HD3      LYS   7  77.363  -3.470 -12.725
   49    HE2  LYS   7           HE2      LYS   7  76.315  -1.134 -14.227
   50    HE3  LYS   7           HE3      LYS   7  76.017  -2.854 -14.469
   51    HZ1  LYS   7           HZ1      LYS   7  74.825  -1.150 -12.349
   52    HZ2  LYS   7           HZ2      LYS   7  74.579  -2.824 -12.509
   53    HZ3  LYS   7           HZ3      LYS   7  74.025  -1.761 -13.714
   54    H    LYS   8           H        LYS   8  78.449   1.509 -12.816
   55    HA   LYS   8           HA       LYS   8  80.114  -0.252 -14.217
   56    HB2  LYS   8           HB2      LYS   8  79.065   1.649 -15.305
   57    HB3  LYS   8           HB3      LYS   8  79.992   2.770 -14.311
   58    HG2  LYS   8           HG2      LYS   8  81.621   0.774 -15.778
   59    HG3  LYS   8           HG3      LYS   8  80.770   1.926 -16.803
   60    HD2  LYS   8           HD2      LYS   8  82.310   2.908 -14.406
   61    HD3  LYS   8           HD3      LYS   8  83.155   2.540 -15.908
   62    HE2  LYS   8           HE2      LYS   8  82.007   4.204 -17.109
   63    HE3  LYS   8           HE3      LYS   8  80.703   4.292 -15.924
   64    HZ1  LYS   8           HZ1      LYS   8  83.492   5.021 -15.254
   65    HZ2  LYS   8           HZ2      LYS   8  82.071   5.401 -14.405
   66    HZ3  LYS   8           HZ3      LYS   8  82.398   6.148 -15.895
   67    H    ILE   9           H        ILE   9  80.985   2.479 -12.108
   68    HA   ILE   9           HA       ILE   9  83.782   2.148 -12.354
   69    HB   ILE   9           HB       ILE   9  82.173   3.399 -10.119
   70   HG12  ILE   9          HG12      ILE   9  83.621   4.782 -12.385
   71   HG13  ILE   9          HG13      ILE   9  81.937   4.279 -12.535
   72   HG21  ILE   9          HG21      ILE   9  84.318   4.631  -9.700
   73   HG22  ILE   9          HG22      ILE   9  85.108   3.571 -10.866
   74   HG23  ILE   9          HG23      ILE   9  84.438   2.902  -9.379
   75   HD11  ILE   9          HD11      ILE   9  82.210   6.653 -11.757
   76   HD12  ILE   9          HD12      ILE   9  82.984   6.035 -10.297
   77   HD13  ILE   9          HD13      ILE   9  81.298   5.642 -10.636
   78    H    PHE  10           H        PHE  10  81.376   0.556 -10.416
   79    HA   PHE  10           HA       PHE  10  83.229  -0.474  -8.469
   80    HB2  PHE  10           HB2      PHE  10  81.088  -0.381  -7.592
   81    HB3  PHE  10           HB1      PHE  10  80.336  -0.900  -9.101
   82    HD1  PHE  10           HD1      PHE  10  80.270  -3.258  -9.740
   83    HD2  PHE  10           HD2      PHE  10  82.060  -2.002  -6.049
   84    HE1  PHE  10           HE1      PHE  10  80.300  -5.610  -8.960
   85    HE2  PHE  10           HE2      PHE  10  82.098  -4.355  -5.267
   86    HZ   PHE  10           HZ       PHE  10  81.215  -6.162  -6.725
   87    H    VAL  11           H        VAL  11  81.431  -1.975 -11.168
   88    HA   VAL  11           HA       VAL  11  82.448  -4.546 -10.942
   89    HB   VAL  11           HB       VAL  11  81.925  -4.788 -13.359
   90   HG11  VAL  11          HG11      VAL  11  79.792  -3.159 -11.977
   91   HG12  VAL  11          HG12      VAL  11  80.195  -4.798 -11.467
   92   HG13  VAL  11          HG13      VAL  11  79.581  -4.506 -13.094
   93   HG21  VAL  11          HG21      VAL  11  81.286  -1.835 -13.170
   94   HG22  VAL  11          HG22      VAL  11  81.064  -2.860 -14.586
   95   HG23  VAL  11          HG23      VAL  11  82.690  -2.496 -14.006
   96    H    GLN  12           H        GLN  12  83.913  -1.681 -12.286
   97    HA   GLN  12           HA       GLN  12  86.122  -3.263 -13.392
   98    HB2  GLN  12           HB2      GLN  12  86.830  -1.244 -14.475
   99    HB3  GLN  12           HB1      GLN  12  85.094  -1.430 -14.715
  100    HG2  GLN  12           HG2      GLN  12  84.721   0.089 -12.752
  101    HG3  GLN  12           HG1      GLN  12  86.462   0.367 -12.700
  102   HE21  GLN  12          HE21      GLN  12  85.862  -0.093 -15.903
  103   HE22  GLN  12          HE22      GLN  12  85.578   1.508 -16.379
  104    H    LYS  13           H        LYS  13  85.465  -1.163 -10.648
  105    HA   LYS  13           HA       LYS  13  88.352  -1.022 -10.075
  106    HB2  LYS  13           HB2      LYS  13  86.021   0.481  -8.894
  107    HB3  LYS  13           HB3      LYS  13  87.673   0.613  -8.306
  108    HG2  LYS  13           HG2      LYS  13  88.087   0.997 -10.976
  109    HG3  LYS  13           HG3      LYS  13  86.473   1.680 -10.805
  110    HD2  LYS  13           HD2      LYS  13  87.234   3.185  -9.058
  111    HD3  LYS  13           HD3      LYS  13  88.829   2.430  -9.052
  112    HE2  LYS  13           HE2      LYS  13  89.185   3.139 -11.382
  113    HE3  LYS  13           HE3      LYS  13  87.586   3.882 -11.405
  114    HZ1  LYS  13           HZ1      LYS  13  89.708   5.274 -10.838
  115    HZ2  LYS  13           HZ2      LYS  13  89.454   4.645  -9.280
  116    HZ3  LYS  13           HZ3      LYS  13  88.241   5.565 -10.037
  117    H    CYS  14           H        CYS  14  85.445  -1.501  -8.014
  118    HA   CYS  14           HA       CYS  14  87.102  -2.809  -6.039
  119    HB2  CYS  14           HB2      CYS  14  84.133  -2.714  -5.828
  120    HB3  CYS  14           HB1      CYS  14  85.346  -2.543  -4.569
  121    H    ALA  15           H        ALA  15  84.660  -3.930  -8.347
  122    HA   ALA  15           HA       ALA  15  84.064  -6.404  -7.304
  123    HB1  ALA  15           HB1      ALA  15  82.937  -5.977  -9.277
  124    HB2  ALA  15           HB2      ALA  15  84.144  -7.133  -9.840
  125    HB3  ALA  15           HB3      ALA  15  84.386  -5.407 -10.103
  126    H    GLN  16           H        GLN  16  87.082  -5.316  -8.640
  127    HA   GLN  16           HA       GLN  16  88.371  -7.618  -9.378
  128    HB2  GLN  16           HB2      GLN  16  89.494  -5.306  -7.794
  129    HB3  GLN  16           HB1      GLN  16  90.466  -6.526  -8.613
  130    HG2  GLN  16           HG2      GLN  16  89.240  -5.918 -10.747
  131    HG3  GLN  16           HG1      GLN  16  88.553  -4.549  -9.874
  132   HE21  GLN  16          HE21      GLN  16  91.698  -5.982 -10.846
  133   HE22  GLN  16          HE22      GLN  16  92.542  -4.510 -10.833
  134    H    CYS  17           H        CYS  17  88.665  -6.272  -6.057
  135    HA   CYS  17           HA       CYS  17  88.994  -9.060  -5.097
  136    HB2  CYS  17           HB2      CYS  17  90.123  -6.916  -3.412
  137    HB3  CYS  17           HB1      CYS  17  90.811  -8.470  -3.874
  138    H    HIS  18           H        HSD  18  86.405  -8.087  -5.224
  139    HA   HIS  18           HA       HSD  18  85.707  -8.125  -2.402
  140    HB2  HIS  18           HB2      HSD  18  85.180  -5.725  -4.140
  141    HB3  HIS  18           HB1      HSD  18  84.146  -6.102  -2.766
  142    HD1  HIS  18           HD1      HSD  18  86.608  -7.234  -0.993
  143    HD2  HIS  18           HD2      HSD  18  86.379  -3.513  -2.847
  144    HE1  HIS  18           HE1      HSD  18  88.200  -5.709   0.255
  145    H    THR  19           H        THR  19  83.107  -7.648  -2.388
  146    HA   THR  19           HA       THR  19  81.858  -9.136  -4.598
  147    HB   THR  19           HB       THR  19  80.657 -10.071  -2.202
  148    HG1  THR  19           HG1      THR  19  82.972 -11.112  -1.735
  149   HG21  THR  19          HG21      THR  19  81.683 -12.249  -2.976
  150   HG22  THR  19          HG22      THR  19  82.519 -11.330  -4.227
  151   HG23  THR  19          HG23      THR  19  80.758 -11.393  -4.208
  152    H    VAL  20           H        VAL  20  81.508  -7.189  -1.683
  153    HA   VAL  20           HA       VAL  20  79.788  -5.866  -0.911
  154    HB   VAL  20           HB       VAL  20  79.147  -4.123  -2.457
  155   HG11  VAL  20          HG11      VAL  20  81.987  -5.081  -2.920
  156   HG12  VAL  20          HG12      VAL  20  81.438  -4.044  -1.607
  157   HG13  VAL  20          HG13      VAL  20  81.400  -3.454  -3.265
  158   HG21  VAL  20          HG21      VAL  20  80.425  -5.757  -4.652
  159   HG22  VAL  20          HG22      VAL  20  79.512  -4.263  -4.815
  160   HG23  VAL  20          HG23      VAL  20  78.688  -5.752  -4.364
  161    H    GLU  21           H        GLU  21  78.935  -8.570  -1.751
  162    HA   GLU  21           HA       GLU  21  76.103  -7.913  -2.305
  163    HB2  GLU  21           HB2      GLU  21  75.858  -9.783  -3.727
  164    HB3  GLU  21           HB3      GLU  21  77.360  -9.018  -4.239
  165    HG2  GLU  21           HG2      GLU  21  78.485 -10.655  -2.543
  166    HG3  GLU  21           HG3      GLU  21  76.975 -11.553  -2.664
  167    H    LYS  22           H        LYS  22  74.994  -8.265  -0.518
  168    HA   LYS  22           HA       LYS  22  75.792  -9.677   1.725
  169    HB2  LYS  22           HB2      LYS  22  73.231  -8.641   0.668
  170    HB3  LYS  22           HB3      LYS  22  73.068  -9.953   1.831
  171    HG2  LYS  22           HG2      LYS  22  74.907  -7.634   2.403
  172    HG3  LYS  22           HG3      LYS  22  73.178  -7.497   2.716
  173    HD2  LYS  22           HD2      LYS  22  74.676  -9.895   3.746
  174    HD3  LYS  22           HD3      LYS  22  74.782  -8.366   4.617
  175    HE2  LYS  22           HE2      LYS  22  72.313  -8.279   4.757
  176    HE3  LYS  22           HE3      LYS  22  72.214  -9.822   3.912
  177    HZ1  LYS  22           HZ1      LYS  22  73.956 -10.342   5.905
  178    HZ2  LYS  22           HZ2      LYS  22  72.297 -10.705   5.940
  179    HZ3  LYS  22           HZ3      LYS  22  72.871  -9.276   6.657
  180    H    GLY  23           H        GLY  23  76.081 -11.767   2.140
  181    HA2  GLY  23           HA2      GLY  23  75.644 -14.053   2.170
  182    HA3  GLY  23           HA3      GLY  23  74.353 -13.798   1.003
  183    H    GLY  24           H        GLY  24  77.533 -12.507   0.407
  184    HA2  GLY  24           HA2      GLY  24  77.811 -14.324  -1.889
  185    HA3  GLY  24           HA3      GLY  24  78.674 -12.807  -1.656
  186    H    LYS  25           H        LYS  25  80.743 -13.575  -1.863
  187    HA   LYS  25           HA       LYS  25  81.786 -15.045   0.425
  188    HB2  LYS  25           HB2      LYS  25  82.814 -16.801  -0.821
  189    HB3  LYS  25           HB3      LYS  25  81.123 -16.763  -1.316
  190    HG2  LYS  25           HG2      LYS  25  81.922 -15.194  -3.216
  191    HG3  LYS  25           HG3      LYS  25  83.541 -15.771  -2.821
  192    HD2  LYS  25           HD2      LYS  25  82.665 -18.131  -3.075
  193    HD3  LYS  25           HD3      LYS  25  81.170 -17.437  -3.703
  194    HE2  LYS  25           HE2      LYS  25  82.237 -16.565  -5.618
  195    HE3  LYS  25           HE3      LYS  25  83.840 -16.692  -4.895
  196    HZ1  LYS  25           HZ1      LYS  25  82.293 -18.679  -6.289
  197    HZ2  LYS  25           HZ2      LYS  25  82.954 -19.239  -4.827
  198    HZ3  LYS  25           HZ3      LYS  25  83.967 -18.593  -6.028
  199    H    HIS  26           H        HIS  26  83.577 -14.057   1.063
  200    HA   HIS  26           HA       HIS  26  84.742 -11.890  -0.221
  201    HB2  HIS  26           HB2      HIS  26  86.790 -12.610   1.299
  202    HB3  HIS  26           HB1      HIS  26  85.306 -11.983   2.014
  203    HD1  HIS  26           HD1      HIS  26  85.908 -15.478   0.635
  204    HD2  HIS  26           HD2      HIS  26  85.054 -13.603   4.259
  205    HE1  HIS  26           HE1      HIS  26  85.485 -17.326   2.316
  206    HE2  HIS  26           HE2      HIS  26  84.966 -16.198   4.532
  207    H    LYS  27           H        LYS  27  85.864 -11.752  -2.013
  208    HA   LYS  27           HA       LYS  27  87.462 -14.080  -2.909
  209    HB2  LYS  27           HB2      LYS  27  86.046 -11.901  -4.451
  210    HB3  LYS  27           HB3      LYS  27  87.270 -12.938  -5.183
  211    HG2  LYS  27           HG2      LYS  27  85.974 -14.894  -4.862
  212    HG3  LYS  27           HG3      LYS  27  84.916 -14.101  -3.696
  213    HD2  LYS  27           HD2      LYS  27  83.860 -14.393  -5.953
  214    HD3  LYS  27           HD3      LYS  27  83.949 -12.710  -5.435
  215    HE2  LYS  27           HE2      LYS  27  85.763 -12.239  -6.880
  216    HE3  LYS  27           HE3      LYS  27  86.125 -13.947  -7.119
  217    HZ1  LYS  27           HZ1      LYS  27  83.720 -13.987  -8.062
  218    HZ2  LYS  27           HZ2      LYS  27  85.003 -13.443  -9.034
  219    HZ3  LYS  27           HZ3      LYS  27  83.970 -12.324  -8.281
  220    H    THR  28           H        THR  28  89.404 -13.611  -1.935
  221    HA   THR  28           HA       THR  28  91.438 -12.592  -1.627
  222    HB   THR  28           HB       THR  28  90.715 -11.033  -4.121
  223    HG1  THR  28           HG1      THR  28  92.367 -13.149  -4.424
  224   HG21  THR  28          HG21      THR  28  93.199 -11.440  -2.515
  225   HG22  THR  28          HG22      THR  28  92.675 -10.033  -3.440
  226   HG23  THR  28          HG23      THR  28  93.363 -11.426  -4.270
  227    H    GLY  29           H        GLY  29  88.932 -11.463  -0.522
  228    HA2  GLY  29           HA2      GLY  29  89.925  -9.268   0.848
  229    HA3  GLY  29           HA3      GLY  29  89.063  -8.619  -0.542
  230    HA   PRO  30           HA       PRO  30  86.178 -10.029   3.048
  231    HB2  PRO  30           HB2      PRO  30  85.807  -7.625   4.324
  232    HB3  PRO  30           HB1      PRO  30  87.038  -8.810   4.802
  233    HG2  PRO  30           HG2      PRO  30  87.333  -6.334   3.168
  234    HG3  PRO  30           HG1      PRO  30  88.399  -6.993   4.422
  235    HD2  PRO  30           HD2      PRO  30  88.930  -7.280   1.766
  236    HD3  PRO  30           HD1      PRO  30  89.405  -8.497   2.972
  237    H    ASN  31           H        ASN  31  83.921  -9.169   3.413
  238    HA   ASN  31           HA       ASN  31  82.902  -7.988   0.912
  239    HB2  ASN  31           HB2      ASN  31  80.749  -8.905   1.576
  240    HB3  ASN  31           HB1      ASN  31  81.974 -10.167   1.664
  241   HD21  ASN  31          HD21      ASN  31  82.128 -11.266   3.633
  242   HD22  ASN  31          HD22      ASN  31  81.446 -10.726   5.091
  243    H    LEU  32           H        LEU  32  81.984  -6.036   0.851
  244    HA   LEU  32           HA       LEU  32  82.070  -4.365   3.210
  245    HB2  LEU  32           HB2      LEU  32  80.882  -3.596   0.549
  246    HB3  LEU  32           HB3      LEU  32  81.611  -2.550   1.765
  247    HG   LEU  32           HG       LEU  32  83.016  -4.534  -0.041
  248   HD11  LEU  32          HD11      LEU  32  83.541  -1.589   0.445
  249   HD12  LEU  32          HD12      LEU  32  82.474  -2.173  -0.830
  250   HD13  LEU  32          HD13      LEU  32  84.185  -2.596  -0.852
  251   HD21  LEU  32          HD21      LEU  32  85.088  -3.700   1.206
  252   HD22  LEU  32          HD22      LEU  32  84.061  -4.829   2.089
  253   HD23  LEU  32          HD23      LEU  32  83.982  -3.103   2.441
  254    H    HIS  33           H        HIS  33  80.203  -6.600   3.292
  255    HA   HIS  33           HA       HIS  33  77.539  -5.840   2.819
  256    HB2  HIS  33           HB2      HIS  33  78.672  -7.667   4.953
  257    HB3  HIS  33           HB1      HIS  33  76.967  -7.557   4.519
  258    HD1  HIS  33           HD1      HIS  33  78.474 -10.217   4.125
  259    HD2  HIS  33           HD2      HIS  33  78.085  -7.329   1.143
  260    HE1  HIS  33           HE1      HIS  33  78.780 -11.420   1.918
  261    HE2  HIS  33           HE2      HIS  33  78.541  -9.674   0.091
  262    H    GLY  34           H        GLY  34  76.075  -4.645   3.949
  263    HA2  GLY  34           HA2      GLY  34  75.465  -2.858   5.312
  264    HA3  GLY  34           HA3      GLY  34  75.857  -4.025   6.572
  265    H    LEU  35           H        LEU  35  78.268  -2.810   4.374
  266    HA   LEU  35           HA       LEU  35  80.195  -2.152   6.204
  267    HB2  LEU  35           HB2      LEU  35  80.588  -2.211   3.795
  268    HB3  LEU  35           HB3      LEU  35  79.591  -0.777   3.577
  269    HG   LEU  35           HG       LEU  35  81.280   0.287   5.320
  270   HD11  LEU  35          HD11      LEU  35  82.857  -2.001   4.112
  271   HD12  LEU  35          HD12      LEU  35  82.506  -1.759   5.821
  272   HD13  LEU  35          HD13      LEU  35  83.573  -0.640   4.973
  273   HD21  LEU  35          HD21      LEU  35  80.932   0.945   2.934
  274   HD22  LEU  35          HD22      LEU  35  82.118  -0.267   2.460
  275   HD23  LEU  35          HD23      LEU  35  82.609   1.106   3.452
  276    H    PHE  36           H        PHE  36  77.944   0.192   4.720
  277    HA   PHE  36           HA       PHE  36  78.676   2.424   6.197
  278    HB2  PHE  36           HB2      PHE  36  75.855   1.769   5.322
  279    HB3  PHE  36           HB1      PHE  36  76.542   3.370   5.605
  280    HD1  PHE  36           HD2      PHE  36  76.615   0.399   3.393
  281    HD2  PHE  36           HD1      PHE  36  77.987   4.431   3.975
  282    HE1  PHE  36           HE2      PHE  36  77.446   0.457   1.058
  283    HE2  PHE  36           HE1      PHE  36  78.814   4.486   1.649
  284    HZ   PHE  36           HZ       PHE  36  78.544   2.502   0.187
  285    H    GLY  37           H        GLY  37  79.133   1.785   8.320
  286    HA2  GLY  37           HA2      GLY  37  77.724   2.415  10.409
  287    HA3  GLY  37           HA3      GLY  37  76.866   0.935   9.998
  288    H    ARG  38           H        ARG  38  79.445  -0.253   8.992
  289    HA   ARG  38           HA       ARG  38  80.237  -1.480  11.470
  290    HB2  ARG  38           HB2      ARG  38  81.111  -1.757   8.601
  291    HB3  ARG  38           HB3      ARG  38  82.012  -2.533   9.899
  292    HG2  ARG  38           HG2      ARG  38  79.322  -3.166  10.441
  293    HG3  ARG  38           HG3      ARG  38  79.468  -3.315   8.692
  294    HD2  ARG  38           HD2      ARG  38  80.758  -4.918  10.844
  295    HD3  ARG  38           HD3      ARG  38  80.190  -5.423   9.256
  296    HE   ARG  38           HE       ARG  38  82.846  -4.613   9.924
  297   HH11  ARG  38          HH21      ARG  38  80.424  -4.524   7.451
  298   HH12  ARG  38          HH22      ARG  38  81.562  -4.375   6.154
  299   HH21  ARG  38          HH11      ARG  38  84.338  -4.412   8.230
  300   HH22  ARG  38          HH12      ARG  38  83.776  -4.304   6.596
  301    H    LYS  39           H        LYS  39  82.334  -1.497  12.375
  302    HA   LYS  39           HA       LYS  39  83.707   1.072  12.161
  303    HB2  LYS  39           HB2      LYS  39  83.353  -0.968  14.197
  304    HB3  LYS  39           HB3      LYS  39  85.056  -0.565  14.010
  305    HG2  LYS  39           HG2      LYS  39  82.927   1.568  14.268
  306    HG3  LYS  39           HG3      LYS  39  83.703   0.851  15.678
  307    HD2  LYS  39           HD2      LYS  39  85.937   1.448  14.443
  308    HD3  LYS  39           HD3      LYS  39  84.926   2.556  13.518
  309    HE2  LYS  39           HE2      LYS  39  85.488   2.555  16.478
  310    HE3  LYS  39           HE3      LYS  39  85.673   3.875  15.322
  311    HZ1  LYS  39           HZ1      LYS  39  83.319   2.975  16.738
  312    HZ2  LYS  39           HZ2      LYS  39  83.066   3.318  15.093
  313    HZ3  LYS  39           HZ3      LYS  39  83.697   4.511  16.125
  314    H    THR  40           H        THR  40  85.750   1.343  11.354
  315    HA   THR  40           HA       THR  40  86.767  -0.119   9.326
  316    HB   THR  40           HB       THR  40  89.053   0.731  10.022
  317    HG1  THR  40           HG1      THR  40  87.953   2.353  11.910
  318   HG21  THR  40          HG21      THR  40  86.607   2.461   9.757
  319   HG22  THR  40          HG22      THR  40  87.884   2.161   8.578
  320   HG23  THR  40          HG23      THR  40  88.195   3.198   9.970
  321    H    GLY  41           H        GLY  41  87.622  -2.069   9.016
  322    HA2  GLY  41           HA2      GLY  41  88.467  -4.163   9.431
  323    HA3  GLY  41           HA3      GLY  41  89.368  -3.420  10.748
  324    H    GLN  42           H        GLN  42  85.878  -3.951  10.192
  325    HA   GLN  42           HA       GLN  42  85.778  -5.354  12.804
  326    HB2  GLN  42           HB2      GLN  42  84.632  -3.232  12.981
  327    HB3  GLN  42           HB1      GLN  42  83.712  -3.559  11.513
  328    HG2  GLN  42           HG2      GLN  42  82.455  -5.279  12.545
  329    HG3  GLN  42           HG1      GLN  42  83.593  -5.424  13.883
  330   HE21  GLN  42          HE21      GLN  42  81.123  -3.232  12.488
  331   HE22  GLN  42          HE22      GLN  42  80.796  -2.428  13.947
  332    H    ALA  43           H        ALA  43  85.096  -5.498   9.435
  333    HA   ALA  43           HA       ALA  43  82.981  -7.325   9.367
  334    HB1  ALA  43           HB1      ALA  43  85.015  -6.344   7.518
  335    HB2  ALA  43           HB2      ALA  43  83.331  -6.762   7.211
  336    HB3  ALA  43           HB3      ALA  43  84.567  -8.020   7.200
  337    HA   PRO  44           HA       PRO  44  85.243 -10.821  11.075
  338    HB2  PRO  44           HB2      PRO  44  83.170 -12.544  11.279
  339    HB3  PRO  44           HB1      PRO  44  83.337 -11.148  12.364
  340    HG2  PRO  44           HG2      PRO  44  81.595 -11.482   9.968
  341    HG3  PRO  44           HG1      PRO  44  81.232 -10.725  11.528
  342    HD2  PRO  44           HD2      PRO  44  81.911  -9.312   9.248
  343    HD3  PRO  44           HD1      PRO  44  82.146  -8.705  10.904
  344    H    GLY  45           H        GLY  45  86.598 -11.721   9.577
  345    HA2  GLY  45           HA2      GLY  45  86.107 -14.021   8.207
  346    HA3  GLY  45           HA3      GLY  45  85.644 -12.767   7.060
  347    H    PHE  46           H        PHE  46  87.268 -11.181   6.449
  348    HA   PHE  46           HA       PHE  46  89.797 -12.396   5.920
  349    HB2  PHE  46           HB2      PHE  46  88.542 -10.665   4.496
  350    HB3  PHE  46           HB1      PHE  46  89.185  -9.461   5.612
  351    HD1  PHE  46           HD1      PHE  46  91.682  -9.259   5.917
  352    HD2  PHE  46           HD2      PHE  46  89.921 -11.667   2.826
  353    HE1  PHE  46           HE1      PHE  46  93.848  -9.293   4.709
  354    HE2  PHE  46           HE2      PHE  46  92.087 -11.702   1.619
  355    HZ   PHE  46           HZ       PHE  46  94.050 -10.515   2.560
  356    H    THR  47           H        THR  47  91.866 -11.708   6.616
  357    HA   THR  47           HA       THR  47  91.949 -10.942   9.402
  358    HB   THR  47           HB       THR  47  94.189 -11.487   7.442
  359    HG1  THR  47           HG1      THR  47  92.972 -13.099   9.433
  360   HG21  THR  47          HG21      THR  47  95.023 -10.184   9.289
  361   HG22  THR  47          HG22      THR  47  95.481 -11.863   9.579
  362   HG23  THR  47          HG23      THR  47  94.119 -11.157  10.449
  363    H    TYR  48           H        TYR  48  91.107  -8.790   9.268
  364    HA   TYR  48           HA       TYR  48  92.179  -6.729   7.687
  365    HB2  TYR  48           HB2      TYR  48  90.677  -6.796  10.289
  366    HB3  TYR  48           HB3      TYR  48  91.293  -5.269   9.661
  367    HD1  TYR  48           HD2      TYR  48  90.575  -4.461   7.412
  368    HD2  TYR  48           HD1      TYR  48  88.794  -7.892   9.281
  369    HE1  TYR  48           HE2      TYR  48  88.660  -4.315   5.849
  370    HE2  TYR  48           HE1      TYR  48  86.876  -7.746   7.714
  371    HH   TYR  48           HH       TYR  48  86.066  -5.158   6.043
  372    H    THR  49           H        THR  49  93.650  -5.056   8.195
  373    HA   THR  49           HA       THR  49  95.959  -5.956   9.672
  374    HB   THR  49           HB       THR  49  96.931  -3.783   8.967
  375    HG1  THR  49           HG1      THR  49  95.108  -2.504   9.010
  376   HG21  THR  49          HG21      THR  49  96.736  -5.884   7.473
  377   HG22  THR  49          HG22      THR  49  97.107  -4.352   6.683
  378   HG23  THR  49          HG23      THR  49  95.466  -4.996   6.629
  379    H    ASP  50           H        ASP  50  97.034  -4.503  11.277
  380    HA   ASP  50           HA       ASP  50  95.385  -4.074  13.513
  381    HB2  ASP  50           HB2      ASP  50  98.014  -2.666  13.099
  382    HB3  ASP  50           HB1      ASP  50  97.306  -3.254  14.602
  383    H    ALA  51           H        ALA  51  96.612  -1.847  11.054
  384    HA   ALA  51           HA       ALA  51  95.764   0.560  12.225
  385    HB1  ALA  51           HB1      ALA  51  96.221  -0.292   9.374
  386    HB2  ALA  51           HB2      ALA  51  97.214   0.760  10.382
  387    HB3  ALA  51           HB3      ALA  51  95.664   1.334   9.769
  388    H    ASN  52           H        ASN  52  94.064  -1.755  10.159
  389    HA   ASN  52           HA       ASN  52  91.665  -0.133  10.058
  390    HB2  ASN  52           HB2      ASN  52  92.675  -2.554   8.771
  391    HB3  ASN  52           HB1      ASN  52  90.984  -2.710   9.237
  392   HD21  ASN  52          HD21      ASN  52  90.239  -2.559   7.008
  393   HD22  ASN  52          HD22      ASN  52  90.301  -1.092   6.154
  394    H    LYS  53           H        LYS  53  92.963  -2.683  12.025
  395    HA   LYS  53           HA       LYS  53  90.413  -3.317  13.262
  396    HB2  LYS  53           HB2      LYS  53  91.668  -5.235  13.315
  397    HB3  LYS  53           HB3      LYS  53  93.192  -4.360  13.349
  398    HG2  LYS  53           HG2      LYS  53  92.924  -3.864  15.710
  399    HG3  LYS  53           HG3      LYS  53  91.304  -4.565  15.709
  400    HD2  LYS  53           HD2      LYS  53  93.586  -6.271  14.777
  401    HD3  LYS  53           HD3      LYS  53  93.414  -5.983  16.508
  402    HE2  LYS  53           HE2      LYS  53  91.092  -6.909  14.809
  403    HE3  LYS  53           HE3      LYS  53  92.209  -8.045  15.567
  404    HZ1  LYS  53           HZ1      LYS  53  90.716  -5.937  17.030
  405    HZ2  LYS  53           HZ2      LYS  53  91.677  -7.164  17.707
  406    HZ3  LYS  53           HZ3      LYS  53  90.223  -7.556  16.923
  407    H    ASN  54           H        ASN  54  92.739  -0.937  13.479
  408    HA   ASN  54           HA       ASN  54  92.877  -0.456  16.267
  409    HB2  ASN  54           HB2      ASN  54  93.962   1.506  15.693
  410    HB3  ASN  54           HB1      ASN  54  94.246   0.533  14.257
  411   HD21  ASN  54          HD21      ASN  54  91.579   0.787  13.120
  412   HD22  ASN  54          HD22      ASN  54  91.384   2.402  12.641
  413    H    LYS  55           H        LYS  55  90.434  -0.003  13.938
  414    HA   LYS  55           HA       LYS  55  88.325   0.928  14.014
  415    HB2  LYS  55           HB2      LYS  55  88.827   0.562  16.973
  416    HB3  LYS  55           HB3      LYS  55  87.270   1.024  16.286
  417    HG2  LYS  55           HG2      LYS  55  87.091  -1.036  15.071
  418    HG3  LYS  55           HG3      LYS  55  88.767  -1.458  15.416
  419    HD2  LYS  55           HD2      LYS  55  87.621  -2.754  16.988
  420    HD3  LYS  55           HD3      LYS  55  88.005  -1.315  17.929
  421    HE2  LYS  55           HE2      LYS  55  85.702  -0.428  17.098
  422    HE3  LYS  55           HE3      LYS  55  85.370  -2.114  16.705
  423    HZ1  LYS  55           HZ1      LYS  55  85.787  -0.862  19.323
  424    HZ2  LYS  55           HZ2      LYS  55  86.242  -2.486  19.117
  425    HZ3  LYS  55           HZ3      LYS  55  84.634  -2.012  18.848
  426    H    GLY  56           H        GLY  56  89.787   2.854  13.274
  427    HA2  GLY  56           HA2      GLY  56  90.046   5.015  15.170
  428    HA3  GLY  56           HA3      GLY  56  90.408   5.087  13.449
  429    H    ILE  57           H        ILE  57  87.977   4.344  12.348
  430    HA   ILE  57           HA       ILE  57  85.951   6.138  13.476
  431    HB   ILE  57           HB       ILE  57  85.658   7.374  11.417
  432   HG12  ILE  57          HG12      ILE  57  87.526   7.016   9.631
  433   HG13  ILE  57          HG13      ILE  57  87.754   5.448  10.402
  434   HG21  ILE  57          HG21      ILE  57  87.687   8.673  11.451
  435   HG22  ILE  57          HG22      ILE  57  88.612   7.306  12.076
  436   HG23  ILE  57          HG23      ILE  57  87.402   8.091  13.091
  437   HD11  ILE  57          HD11      ILE  57  85.916   6.004   8.405
  438   HD12  ILE  57          HD12      ILE  57  84.927   6.045   9.860
  439   HD13  ILE  57          HD13      ILE  57  85.866   4.606   9.473
  440    H    THR  58           H        THR  58  83.873   5.960  12.281
  441    HA   THR  58           HA       THR  58  83.423   3.152  11.553
  442    HB   THR  58           HB       THR  58  81.523   5.374  12.317
  443    HG1  THR  58           HG1      THR  58  82.766   4.426  13.993
  444   HG21  THR  58          HG21      THR  58  81.051   2.522  11.445
  445   HG22  THR  58          HG22      THR  58  80.333   3.992  10.786
  446   HG23  THR  58          HG23      THR  58  79.870   3.427  12.392
  447    H    TRP  59           H        TRP  59  82.674   2.498   9.595
  448    HA   TRP  59           HA       TRP  59  83.055   4.151   7.333
  449    HB2  TRP  59           HB2      TRP  59  81.500   1.569   7.611
  450    HB3  TRP  59           HB1      TRP  59  81.899   2.341   6.080
  451    HD1  TRP  59           HD1      TRP  59  83.150  -0.216   8.320
  452    HE1  TRP  59           HE1      TRP  59  85.642  -0.715   7.887
  453    HE3  TRP  59           HE3      TRP  59  84.375   3.831   5.456
  454    HZ2  TRP  59           HZ2      TRP  59  87.863   0.454   6.514
  455    HZ3  TRP  59           HZ3      TRP  59  86.682   4.112   4.601
  456    HH2  TRP  59           HH2      TRP  59  88.427   2.431   5.125
  457    H    LYS  60           H        LYS  60  81.669   5.282   6.079
  458    HA   LYS  60           HA       LYS  60  78.806   5.253   6.533
  459    HB2  LYS  60           HB2      LYS  60  80.484   7.692   7.184
  460    HB3  LYS  60           HB3      LYS  60  78.732   7.718   6.989
  461    HG2  LYS  60           HG2      LYS  60  78.652   5.886   8.779
  462    HG3  LYS  60           HG3      LYS  60  80.343   6.269   9.098
  463    HD2  LYS  60           HD2      LYS  60  78.225   8.422   9.082
  464    HD3  LYS  60           HD3      LYS  60  78.566   7.478  10.531
  465    HE2  LYS  60           HE2      LYS  60  80.928   8.156  10.434
  466    HE3  LYS  60           HE3      LYS  60  80.609   9.084   8.969
  467    HZ1  LYS  60           HZ1      LYS  60  79.310   9.553  11.597
  468    HZ2  LYS  60           HZ2      LYS  60  79.086  10.474  10.186
  469    HZ3  LYS  60           HZ3      LYS  60  80.594  10.467  10.970
  470    H    GLU  61           H        GLU  61  78.208   7.655   5.233
  471    HA   GLU  61           HA       GLU  61  78.759   6.928   2.516
  472    HB2  GLU  61           HB2      GLU  61  76.622   7.979   3.259
  473    HB3  GLU  61           HB3      GLU  61  77.507   9.472   3.575
  474    HG2  GLU  61           HG2      GLU  61  78.158   9.643   1.240
  475    HG3  GLU  61           HG3      GLU  61  77.436   8.073   0.888
  476    H    GLU  62           H        GLU  62  79.504   9.876   4.403
  477    HA   GLU  62           HA       GLU  62  81.283  10.928   2.450
  478    HB2  GLU  62           HB2      GLU  62  81.427  11.626   5.376
  479    HB3  GLU  62           HB3      GLU  62  81.700  12.660   3.974
  480    HG2  GLU  62           HG2      GLU  62  79.569  13.361   4.467
  481    HG3  GLU  62           HG3      GLU  62  79.140  11.963   3.485
  482    H    THR  63           H        THR  63  81.876   9.282   5.562
  483    HA   THR  63           HA       THR  63  84.621   9.334   5.655
  484    HB   THR  63           HB       THR  63  84.491   7.165   6.847
  485    HG1  THR  63           HG1      THR  63  81.901   7.246   5.742
  486   HG21  THR  63          HG21      THR  63  82.765   7.912   8.543
  487   HG22  THR  63          HG22      THR  63  82.375   9.234   7.444
  488   HG23  THR  63          HG23      THR  63  83.991   9.113   8.140
  489    H    LEU  64           H        LEU  64  82.533   7.272   3.719
  490    HA   LEU  64           HA       LEU  64  84.619   5.625   2.694
  491    HB2  LEU  64           HB2      LEU  64  81.745   5.943   2.285
  492    HB3  LEU  64           HB3      LEU  64  82.593   5.596   0.785
  493    HG   LEU  64           HG       LEU  64  82.872   3.979   3.335
  494   HD11  LEU  64          HD11      LEU  64  80.984   3.855   1.060
  495   HD12  LEU  64          HD12      LEU  64  80.834   3.197   2.689
  496   HD13  LEU  64          HD13      LEU  64  81.755   2.322   1.464
  497   HD21  LEU  64          HD21      LEU  64  84.291   4.026   0.739
  498   HD22  LEU  64          HD22      LEU  64  83.736   2.425   1.229
  499   HD23  LEU  64          HD23      LEU  64  84.797   3.352   2.287
  500    H    MET  65           H        MET  65  83.136   8.661   1.662
  501    HA   MET  65           HA       MET  65  84.237   8.798  -0.923
  502    HB2  MET  65           HB2      MET  65  83.650  11.054   1.010
  503    HB3  MET  65           HB1      MET  65  83.958  11.248  -0.714
  504    HG2  MET  65           HG2      MET  65  82.002   9.965  -1.286
  505    HG3  MET  65           HG1      MET  65  81.754   9.503   0.395
  506    HE1  MET  65           HE1      MET  65  81.717  12.277  -2.254
  507    HE2  MET  65           HE2      MET  65  80.200  13.049  -1.802
  508    HE3  MET  65           HE3      MET  65  80.227  11.326  -2.169
  509    H    GLU  66           H        GLU  66  85.492  10.271   2.086
  510    HA   GLU  66           HA       GLU  66  87.924  11.161   1.000
  511    HB2  GLU  66           HB2      GLU  66  87.503  10.217   3.844
  512    HB3  GLU  66           HB3      GLU  66  88.682  11.396   3.268
  513    HG2  GLU  66           HG2      GLU  66  86.662  12.752   2.430
  514    HG3  GLU  66           HG3      GLU  66  85.683  11.689   3.440
  515    H    TYR  67           H        TYR  67  86.854   8.039   2.083
  516    HA   TYR  67           HA       TYR  67  89.477   6.849   2.210
  517    HB2  TYR  67           HB2      TYR  67  87.610   5.969   3.546
  518    HB3  TYR  67           HB3      TYR  67  86.729   5.591   2.067
  519    HD1  TYR  67           HD1      TYR  67  89.817   4.814   3.992
  520    HD2  TYR  67           HD2      TYR  67  87.167   3.606   0.835
  521    HE1  TYR  67           HE1      TYR  67  90.980   2.629   3.853
  522    HE2  TYR  67           HE2      TYR  67  88.332   1.421   0.694
  523    HH   TYR  67           HH       TYR  67  90.337   0.368   1.275
  524    H    LEU  68           H        LEU  68  86.975   7.279  -0.190
  525    HA   LEU  68           HA       LEU  68  88.091   5.386  -2.060
  526    HB2  LEU  68           HB2      LEU  68  85.891   7.438  -2.174
  527    HB3  LEU  68           HB3      LEU  68  86.445   6.639  -3.639
  528    HG   LEU  68           HG       LEU  68  85.372   5.260  -1.160
  529   HD11  LEU  68          HD11      LEU  68  83.673   6.413  -2.539
  530   HD12  LEU  68          HD12      LEU  68  83.499   4.659  -2.616
  531   HD13  LEU  68          HD13      LEU  68  84.241   5.533  -3.956
  532   HD21  LEU  68          HD21      LEU  68  85.349   3.368  -3.084
  533   HD22  LEU  68          HD22      LEU  68  86.702   3.579  -1.975
  534   HD23  LEU  68          HD23      LEU  68  86.771   4.272  -3.595
  535    H    GLU  69           H        GLU  69  88.600   8.713  -1.276
  536    HA   GLU  69           HA       GLU  69  89.881   9.318  -3.827
  537    HB2  GLU  69           HB2      GLU  69  88.747  11.197  -3.087
  538    HB3  GLU  69           HB3      GLU  69  89.078  10.859  -1.390
  539    HG2  GLU  69           HG2      GLU  69  91.322  11.626  -1.570
  540    HG3  GLU  69           HG3      GLU  69  91.257  11.624  -3.332
  541    H    ASN  70           H        ASN  70  90.687   8.012  -0.806
  542    HA   ASN  70           HA       ASN  70  93.430   7.678  -1.476
  543    HB2  ASN  70           HB2      ASN  70  94.410   9.049   0.320
  544    HB3  ASN  70           HB1      ASN  70  93.571  10.046  -0.865
  545   HD21  ASN  70          HD21      ASN  70  93.552   8.975   2.480
  546   HD22  ASN  70          HD22      ASN  70  92.241   9.933   2.971
  547    HA   PRO  71           HA       PRO  71  91.291   4.900   1.634
  548    HB2  PRO  71           HB2      PRO  71  92.315   2.595   0.389
  549    HB3  PRO  71           HB1      PRO  71  90.680   3.249   0.197
  550    HG2  PRO  71           HG2      PRO  71  93.011   3.448  -1.602
  551    HG3  PRO  71           HG1      PRO  71  91.282   3.467  -1.977
  552    HD2  PRO  71           HD2      PRO  71  92.873   5.704  -2.022
  553    HD3  PRO  71           HD1      PRO  71  91.124   5.754  -1.728
  554    H    LYS  72           H        LYS  72  94.539   5.114   0.356
  555    HA   LYS  72           HA       LYS  72  95.704   3.566   2.517
  556    HB2  LYS  72           HB2      LYS  72  96.686   3.540   0.246
  557    HB3  LYS  72           HB3      LYS  72  97.039   5.259   0.395
  558    HG2  LYS  72           HG2      LYS  72  99.014   4.689   1.342
  559    HG3  LYS  72           HG3      LYS  72  98.104   4.125   2.740
  560    HD2  LYS  72           HD2      LYS  72  98.652   2.400   0.309
  561    HD3  LYS  72           HD3      LYS  72  99.675   2.413   1.745
  562    HE2  LYS  72           HE2      LYS  72  96.736   1.679   1.635
  563    HE3  LYS  72           HE3      LYS  72  98.083   0.584   1.936
  564    HZ1  LYS  72           HZ1      LYS  72  96.911   2.613   3.694
  565    HZ2  LYS  72           HZ2      LYS  72  98.571   2.283   3.839
  566    HZ3  LYS  72           HZ3      LYS  72  97.433   1.041   4.056
  567    H    LYS  73           H        LYS  73  95.678   6.984   1.500
  568    HA   LYS  73           HA       LYS  73  97.226   7.875   3.718
  569    HB2  LYS  73           HB2      LYS  73  96.642   9.016   1.388
  570    HB3  LYS  73           HB3      LYS  73  95.342   9.736   2.336
  571    HG2  LYS  73           HG2      LYS  73  97.142  10.358   4.054
  572    HG3  LYS  73           HG3      LYS  73  98.320   9.937   2.812
  573    HD2  LYS  73           HD2      LYS  73  98.065  12.194   2.353
  574    HD3  LYS  73           HD3      LYS  73  96.799  11.536   1.317
  575    HE2  LYS  73           HE2      LYS  73  95.762  13.308   2.524
  576    HE3  LYS  73           HE3      LYS  73  95.221  11.831   3.318
  577    HZ1  LYS  73           HZ1      LYS  73  97.022  13.902   4.278
  578    HZ2  LYS  73           HZ2      LYS  73  97.442  12.305   4.676
  579    HZ3  LYS  73           HZ3      LYS  73  95.930  12.929   5.137
  580    H    TYR  74           H        TYR  74  94.014   6.835   3.512
  581    HA   TYR  74           HA       TYR  74  92.983   8.583   5.590
  582    HB2  TYR  74           HB2      TYR  74  91.714   7.336   3.606
  583    HB3  TYR  74           HB3      TYR  74  91.579   6.061   4.814
  584    HD1  TYR  74           HD1      TYR  74  91.260   9.807   4.654
  585    HD2  TYR  74           HD2      TYR  74  89.663   6.108   6.144
  586    HE1  TYR  74           HE1      TYR  74  89.409  11.044   5.742
  587    HE2  TYR  74           HE2      TYR  74  87.814   7.347   7.235
  588    HH   TYR  74           HH       TYR  74  87.753  10.226   8.040
  589    H    ILE  75           H        ILE  75  93.532   5.063   5.314
  590    HA   ILE  75           HA       ILE  75  94.101   5.016   8.222
  591    HB   ILE  75           HB       ILE  75  92.623   2.885   6.654
  592   HG12  ILE  75          HG12      ILE  75  91.468   4.575   8.869
  593   HG13  ILE  75          HG13      ILE  75  91.458   5.167   7.211
  594   HG21  ILE  75          HG21      ILE  75  93.490   3.170   9.537
  595   HG22  ILE  75          HG22      ILE  75  93.790   1.826   8.435
  596   HG23  ILE  75          HG23      ILE  75  92.168   2.102   9.068
  597   HD11  ILE  75          HD11      ILE  75  89.373   3.895   7.926
  598   HD12  ILE  75          HD12      ILE  75  90.380   2.448   7.978
  599   HD13  ILE  75          HD13      ILE  75  90.151   3.308   6.456
  600    HA   PRO  76           HA       PRO  76  97.769   3.612   5.628
  601    HB2  PRO  76           HB2      PRO  76  98.915   4.400   8.287
  602    HB3  PRO  76           HB1      PRO  76  99.557   4.679   6.656
  603    HG2  PRO  76           HG2      PRO  76  98.362   6.624   8.029
  604    HG3  PRO  76           HG1      PRO  76  98.179   6.477   6.273
  605    HD2  PRO  76           HD2      PRO  76  96.199   5.900   8.420
  606    HD3  PRO  76           HD1      PRO  76  95.926   6.370   6.728
  607    H    GLY  77           H        GLY  77  98.581   1.571   5.657
  608    HA2  GLY  77           HA2      GLY  77  99.492  -0.341   6.831
  609    HA3  GLY  77           HA3      GLY  77  98.362  -0.017   8.144
  610    H    THR  78           H        THR  78  96.160   0.546   6.267
  611    HA   THR  78           HA       THR  78  94.929  -1.953   6.169
  612    HB   THR  78           HB       THR  78  93.740   0.215   5.995
  613    HG1  THR  78           HG1      THR  78  92.290  -1.053   5.197
  614   HG21  THR  78          HG21      THR  78  93.786   1.489   3.979
  615   HG22  THR  78          HG22      THR  78  94.663   0.222   3.121
  616   HG23  THR  78          HG23      THR  78  95.471   1.153   4.381
  617    H    LYS  79           H        LYS  79  94.729  -3.540   4.610
  618    HA   LYS  79           HA       LYS  79  96.801  -3.528   2.549
  619    HB2  LYS  79           HB2      LYS  79  96.008  -5.510   4.143
  620    HB3  LYS  79           HB3      LYS  79  94.862  -5.785   2.835
  621    HG2  LYS  79           HG2      LYS  79  97.879  -5.631   2.557
  622    HG3  LYS  79           HG3      LYS  79  96.901  -7.094   2.452
  623    HD2  LYS  79           HD2      LYS  79  95.645  -5.955   0.541
  624    HD3  LYS  79           HD3      LYS  79  96.926  -4.743   0.551
  625    HE2  LYS  79           HE2      LYS  79  98.599  -6.592   0.273
  626    HE3  LYS  79           HE3      LYS  79  97.255  -7.719   0.090
  627    HZ1  LYS  79           HZ1      LYS  79  96.777  -6.960  -1.955
  628    HZ2  LYS  79           HZ2      LYS  79  98.395  -6.439  -1.945
  629    HZ3  LYS  79           HZ3      LYS  79  97.145  -5.348  -1.576
  630    H    MET  80           H        MET  80  96.038  -2.019   1.066
  631    HA   MET  80           HA       MET  80  94.346  -2.991  -0.976
  632    HB2  MET  80           HB2      MET  80  92.527  -2.547   0.587
  633    HB3  MET  80           HB1      MET  80  93.117  -0.907   0.847
  634    HG2  MET  80           HG2      MET  80  92.595  -0.258  -1.388
  635    HG3  MET  80           HG1      MET  80  92.355  -1.929  -1.894
  636    HE1  MET  80           HE1      MET  80  90.712   1.147  -1.410
  637    HE2  MET  80           HE2      MET  80  89.045   0.592  -1.529
  638    HE3  MET  80           HE3      MET  80  90.230   0.059  -2.719
  639    H    ILE  81           H        ILE  81  95.971  -2.291  -2.323
  640    HA   ILE  81           HA       ILE  81  96.231   0.641  -2.611
  641    HB   ILE  81           HB       ILE  81  98.460  -1.394  -2.864
  642   HG12  ILE  81          HG12      ILE  81  99.314   0.286  -0.962
  643   HG13  ILE  81          HG13      ILE  81  97.583   0.499  -0.705
  644   HG21  ILE  81          HG21      ILE  81  98.850   0.340  -4.451
  645   HG22  ILE  81          HG22      ILE  81  99.825   0.766  -3.044
  646   HG23  ILE  81          HG23      ILE  81  98.292   1.588  -3.337
  647   HD11  ILE  81          HD11      ILE  81  97.661  -2.196  -0.842
  648   HD12  ILE  81          HD12      ILE  81  97.896  -1.319   0.668
  649   HD13  ILE  81          HD13      ILE  81  99.291  -1.897  -0.241
  650    H    PHE  82           H        PHE  82  94.794   0.699  -4.332
  651    HA   PHE  82           HA       PHE  82  95.744  -0.613  -6.813
  652    HB2  PHE  82           HB2      PHE  82  93.728  -1.748  -6.206
  653    HB3  PHE  82           HB1      PHE  82  92.913  -0.232  -5.822
  654    HD1  PHE  82           HD2      PHE  82  94.831  -1.706  -8.700
  655    HD2  PHE  82           HD1      PHE  82  91.403   0.543  -7.419
  656    HE1  PHE  82           HE2      PHE  82  94.073  -1.521 -11.054
  657    HE2  PHE  82           HE1      PHE  82  90.645   0.728  -9.772
  658    HZ   PHE  82           HZ       PHE  82  91.980  -0.304 -11.590
  659    H    ALA  83           H        ALA  83  93.090   1.662  -6.289
  660    HA   ALA  83           HA       ALA  83  94.543   3.967  -7.167
  661    HB1  ALA  83           HB1      ALA  83  93.337   4.258  -9.318
  662    HB2  ALA  83           HB2      ALA  83  92.668   2.636  -9.136
  663    HB3  ALA  83           HB3      ALA  83  94.407   2.856  -9.331
  664    H    GLY  84           H        GLY  84  93.618   5.369  -5.814
  665    HA2  GLY  84           HA2      GLY  84  91.027   5.189  -4.742
  666    HA3  GLY  84           HA3      GLY  84  92.018   6.646  -4.764
  667    H    ILE  85           H        ILE  85  90.455   8.114  -5.324
  668    HA   ILE  85           HA       ILE  85  89.485   7.952  -8.095
  669    HB   ILE  85           HB       ILE  85  87.804   8.099  -5.621
  670   HG12  ILE  85          HG12      ILE  85  87.319   6.955  -8.389
  671   HG13  ILE  85          HG13      ILE  85  88.032   6.048  -7.057
  672   HG21  ILE  85          HG21      ILE  85  87.260  10.224  -6.652
  673   HG22  ILE  85          HG22      ILE  85  85.966   9.090  -7.021
  674   HG23  ILE  85          HG23      ILE  85  87.168   9.474  -8.247
  675   HD11  ILE  85          HD11      ILE  85  85.388   7.440  -6.680
  676   HD12  ILE  85          HD12      ILE  85  86.042   6.046  -5.822
  677   HD13  ILE  85          HD13      ILE  85  85.457   5.868  -7.474
  678    H    LYS  86           H        LYS  86  88.823  10.051  -8.952
  679    HA   LYS  86           HA       LYS  86  90.327  12.237  -7.654
  680    HB2  LYS  86           HB2      LYS  86  89.672  11.630 -10.529
  681    HB3  LYS  86           HB3      LYS  86  90.210  13.231 -10.019
  682    HG2  LYS  86           HG2      LYS  86  92.302  12.411  -9.260
  683    HG3  LYS  86           HG3      LYS  86  91.745  10.737  -9.275
  684    HD2  LYS  86           HD2      LYS  86  91.702  12.266 -11.855
  685    HD3  LYS  86           HD3      LYS  86  93.255  11.692 -11.251
  686    HE2  LYS  86           HE2      LYS  86  90.880   9.840 -11.411
  687    HE3  LYS  86           HE3      LYS  86  91.911  10.119 -12.815
  688    HZ1  LYS  86           HZ1      LYS  86  92.796   8.263 -11.702
  689    HZ2  LYS  86           HZ2      LYS  86  92.684   9.009 -10.180
  690    HZ3  LYS  86           HZ3      LYS  86  93.825   9.554 -11.313
  691    H    LYS  87           H        LYS  87  87.316  11.706  -9.565
  692    HA   LYS  87           HA       LYS  87  86.359  14.338  -8.765
  693    HB2  LYS  87           HB2      LYS  87  84.898  12.198 -10.315
  694    HB3  LYS  87           HB3      LYS  87  84.492  13.908 -10.224
  695    HG2  LYS  87           HG2      LYS  87  87.174  12.973 -11.257
  696    HG3  LYS  87           HG3      LYS  87  85.774  13.115 -12.318
  697    HD2  LYS  87           HD2      LYS  87  85.531  15.508 -11.488
  698    HD3  LYS  87           HD3      LYS  87  87.110  15.315 -10.726
  699    HE2  LYS  87           HE2      LYS  87  88.085  14.732 -12.930
  700    HE3  LYS  87           HE3      LYS  87  86.509  14.982 -13.680
  701    HZ1  LYS  87           HZ1      LYS  87  88.348  16.887 -13.452
  702    HZ2  LYS  87           HZ2      LYS  87  87.478  17.154 -12.019
  703    HZ3  LYS  87           HZ3      LYS  87  86.683  17.202 -13.520
  704    H    LYS  88           H        LYS  88  84.279  14.666  -7.767
  705    HA   LYS  88           HA       LYS  88  83.939  13.063  -5.423
  706    HB2  LYS  88           HB2      LYS  88  83.465  15.409  -5.262
  707    HB3  LYS  88           HB3      LYS  88  82.328  15.332  -6.606
  708    HG2  LYS  88           HG2      LYS  88  81.712  13.470  -4.383
  709    HG3  LYS  88           HG3      LYS  88  81.613  15.173  -3.947
  710    HD2  LYS  88           HD2      LYS  88  80.196  15.480  -6.067
  711    HD3  LYS  88           HD3      LYS  88  80.090  13.720  -6.118
  712    HE2  LYS  88           HE2      LYS  88  78.151  14.555  -4.933
  713    HE3  LYS  88           HE3      LYS  88  79.213  13.777  -3.762
  714    HZ1  LYS  88           HZ1      LYS  88  80.100  16.349  -3.849
  715    HZ2  LYS  88           HZ2      LYS  88  79.102  15.681  -2.646
  716    HZ3  LYS  88           HZ3      LYS  88  78.416  16.518  -3.955
  717    H    THR  89           H        THR  89  81.812  13.716  -8.223
  718    HA   THR  89           HA       THR  89  79.752  11.976  -7.620
  719    HB   THR  89           HB       THR  89  79.349  11.834 -10.055
  720    HG1  THR  89           HG1      THR  89  80.997  12.031 -11.311
  721   HG21  THR  89          HG21      THR  89  78.532  13.800  -8.936
  722   HG22  THR  89          HG22      THR  89  79.266  14.332 -10.448
  723   HG23  THR  89          HG23      THR  89  80.137  14.529  -8.927
  724    H    GLU  90           H        GLU  90  82.983  11.249  -8.691
  725    HA   GLU  90           HA       GLU  90  82.498   8.605  -9.613
  726    HB2  GLU  90           HB2      GLU  90  84.929  10.100  -8.673
  727    HB3  GLU  90           HB3      GLU  90  85.021   8.359  -8.928
  728    HG2  GLU  90           HG2      GLU  90  84.406   8.583 -11.230
  729    HG3  GLU  90           HG3      GLU  90  83.975  10.277 -11.015
  730    H    ARG  91           H        ARG  91  83.361   9.991  -6.473
  731    HA   ARG  91           HA       ARG  91  83.414   7.425  -5.143
  732    HB2  ARG  91           HB2      ARG  91  83.115  10.109  -3.790
  733    HB3  ARG  91           HB3      ARG  91  83.839   8.637  -3.151
  734    HG2  ARG  91           HG2      ARG  91  85.667   8.816  -4.795
  735    HG3  ARG  91           HG3      ARG  91  84.943  10.293  -5.434
  736    HD2  ARG  91           HD2      ARG  91  85.092  10.765  -2.689
  737    HD3  ARG  91           HD3      ARG  91  86.599   9.930  -3.054
  738    HE   ARG  91           HE       ARG  91  86.411  11.811  -5.027
  739   HH11  ARG  91          HH21      ARG  91  86.230  11.844  -1.568
  740   HH12  ARG  91          HH22      ARG  91  86.863  13.449  -1.416
  741   HH21  ARG  91          HH11      ARG  91  87.242  13.913  -4.830
  742   HH22  ARG  91          HH12      ARG  91  87.436  14.620  -3.262
  743    H    GLU  92           H        GLU  92  81.206  10.225  -5.161
  744    HA   GLU  92           HA       GLU  92  79.265   9.221  -3.432
  745    HB2  GLU  92           HB2      GLU  92  79.437  11.563  -4.456
  746    HB3  GLU  92           HB3      GLU  92  78.614  10.888  -5.864
  747    HG2  GLU  92           HG2      GLU  92  76.911  11.813  -4.446
  748    HG3  GLU  92           HG3      GLU  92  76.812  10.061  -4.283
  749    H    ASP  93           H        ASP  93  79.331   9.031  -7.012
  750    HA   ASP  93           HA       ASP  93  77.022   7.438  -7.267
  751    HB2  ASP  93           HB2      ASP  93  79.463   7.516  -9.060
  752    HB3  ASP  93           HB1      ASP  93  77.878   6.883  -9.501
  753    H    LEU  94           H        LEU  94  80.458   6.513  -7.221
  754    HA   LEU  94           HA       LEU  94  80.169   3.750  -7.373
  755    HB2  LEU  94           HB2      LEU  94  82.353   4.845  -7.508
  756    HB3  LEU  94           HB3      LEU  94  82.198   5.378  -5.836
  757    HG   LEU  94           HG       LEU  94  82.257   3.107  -5.027
  758   HD11  LEU  94          HD11      LEU  94  82.755   1.304  -6.848
  759   HD12  LEU  94          HD12      LEU  94  82.015   2.462  -7.953
  760   HD13  LEU  94          HD13      LEU  94  81.089   1.822  -6.595
  761   HD21  LEU  94          HD21      LEU  94  84.399   4.397  -5.984
  762   HD22  LEU  94          HD22      LEU  94  84.435   3.007  -7.068
  763   HD23  LEU  94          HD23      LEU  94  84.513   2.768  -5.326
  764    H    ILE  95           H        ILE  95  79.906   5.931  -4.638
  765    HA   ILE  95           HA       ILE  95  79.713   3.841  -2.693
  766    HB   ILE  95           HB       ILE  95  79.290   6.821  -2.599
  767   HG12  ILE  95          HG12      ILE  95  81.245   5.112  -1.058
  768   HG13  ILE  95          HG13      ILE  95  81.570   5.581  -2.722
  769   HG21  ILE  95          HG21      ILE  95  77.782   6.238  -0.926
  770   HG22  ILE  95          HG22      ILE  95  79.284   6.216  -0.003
  771   HG23  ILE  95          HG23      ILE  95  78.588   4.706  -0.591
  772   HD11  ILE  95          HD11      ILE  95  80.781   7.673  -0.722
  773   HD12  ILE  95          HD12      ILE  95  81.728   7.844  -2.198
  774   HD13  ILE  95          HD13      ILE  95  82.445   7.096  -0.777
  775    H    ALA  96           H        ALA  96  77.478   5.707  -4.623
  776    HA   ALA  96           HA       ALA  96  75.114   5.116  -3.171
  777    HB1  ALA  96           HB1      ALA  96  74.024   5.557  -5.457
  778    HB2  ALA  96           HB2      ALA  96  75.656   5.892  -6.033
  779    HB3  ALA  96           HB3      ALA  96  74.958   6.873  -4.746
  780    H    TYR  97           H        TYR  97  76.944   3.447  -5.661
  781    HA   TYR  97           HA       TYR  97  74.990   1.382  -6.092
  782    HB2  TYR  97           HB2      TYR  97  76.513   1.771  -7.885
  783    HB3  TYR  97           HB3      TYR  97  77.911   1.664  -6.816
  784    HD1  TYR  97           HD1      TYR  97  75.167  -0.284  -8.390
  785    HD2  TYR  97           HD2      TYR  97  78.858  -0.450  -6.200
  786    HE1  TYR  97           HE1      TYR  97  75.301  -2.725  -8.801
  787    HE2  TYR  97           HE2      TYR  97  78.990  -2.891  -6.613
  788    HH   TYR  97           HH       TYR  97  76.878  -4.497  -8.840
  789    H    LEU  98           H        LEU  98  77.841   1.842  -4.079
  790    HA   LEU  98           HA       LEU  98  78.176  -0.767  -3.116
  791    HB2  LEU  98           HB2      LEU  98  78.760   1.959  -2.004
  792    HB3  LEU  98           HB3      LEU  98  79.033   0.530  -1.015
  793    HG   LEU  98           HG       LEU  98  80.164   0.754  -3.810
  794   HD11  LEU  98          HD11      LEU  98  80.966   2.186  -1.377
  795   HD12  LEU  98          HD12      LEU  98  81.453   2.451  -3.048
  796   HD13  LEU  98          HD13      LEU  98  82.270   1.231  -2.079
  797   HD21  LEU  98          HD21      LEU  98  81.898  -0.770  -2.612
  798   HD22  LEU  98          HD22      LEU  98  80.329  -1.465  -3.011
  799   HD23  LEU  98          HD23      LEU  98  80.665  -0.942  -1.362
  800    H    LYS  99           H        LYS  99  76.225   1.933  -1.885
  801    HA   LYS  99           HA       LYS  99  75.219   0.697   0.412
  802    HB2  LYS  99           HB2      LYS  99  74.113   2.866  -1.368
  803    HB3  LYS  99           HB3      LYS  99  73.294   2.345   0.105
  804    HG2  LYS  99           HG2      LYS  99  75.453   2.781   1.352
  805    HG3  LYS  99           HG3      LYS  99  76.081   3.514  -0.121
  806    HD2  LYS  99           HD2      LYS  99  73.480   4.407   1.138
  807    HD3  LYS  99           HD3      LYS  99  75.032   5.113   1.588
  808    HE2  LYS  99           HE2      LYS  99  75.408   5.578  -0.884
  809    HE3  LYS  99           HE3      LYS  99  73.723   5.127  -1.142
  810    HZ1  LYS  99           HZ1      LYS  99  74.578   7.208   0.789
  811    HZ2  LYS  99           HZ2      LYS  99  72.999   6.872   0.259
  812    HZ3  LYS  99           HZ3      LYS  99  74.131   7.551  -0.811
  813    H    LYS 100           H        LYS 100  73.624   1.019  -2.777
  814    HA   LYS 100           HA       LYS 100  71.448  -0.685  -2.066
  815    HB2  LYS 100           HB2      LYS 100  71.509   1.088  -3.909
  816    HB3  LYS 100           HB3      LYS 100  72.365  -0.108  -4.880
  817    HG2  LYS 100           HG2      LYS 100  70.285  -1.623  -3.969
  818    HG3  LYS 100           HG3      LYS 100  69.514  -0.040  -4.045
  819    HD2  LYS 100           HD2      LYS 100  69.153  -0.872  -6.205
  820    HD3  LYS 100           HD3      LYS 100  70.606   0.101  -6.419
  821    HE2  LYS 100           HE2      LYS 100  71.824  -2.177  -5.796
  822    HE3  LYS 100           HE3      LYS 100  70.314  -2.880  -6.372
  823    HZ1  LYS 100           HZ1      LYS 100  70.800  -1.096  -8.284
  824    HZ2  LYS 100           HZ2      LYS 100  71.326  -2.710  -8.351
  825    HZ3  LYS 100           HZ3      LYS 100  72.390  -1.487  -7.841
  826    H    ALA 101           H        ALA 101  74.641  -1.273  -3.286
  827    HA   ALA 101           HA       ALA 101  74.013  -3.953  -4.227
  828    HB1  ALA 101           HB1      ALA 101  76.671  -2.537  -3.925
  829    HB2  ALA 101           HB2      ALA 101  75.707  -2.616  -5.399
  830    HB3  ALA 101           HB3      ALA 101  76.416  -4.086  -4.730
  831    H    THR 102           H        THR 102  75.159  -2.411  -1.346
  832    HA   THR 102           HA       THR 102  76.154  -4.912  -0.199
  833    HB   THR 102           HB       THR 102  76.652  -3.438   1.782
  834    HG1  THR 102           HG1      THR 102  75.250  -1.704   0.155
  835   HG21  THR 102          HG21      THR 102  77.740  -2.975  -0.974
  836   HG22  THR 102          HG22      THR 102  78.521  -3.704   0.429
  837   HG23  THR 102          HG23      THR 102  78.306  -1.955   0.349
  838    H    ASN 103           H        ASN 103  73.233  -3.638  -0.733
  839    HA   ASN 103           HA       ASN 103  72.071  -4.443   1.859
  840    HB2  ASN 103           HB2      ASN 103  71.154  -2.656  -0.379
  841    HB3  ASN 103           HB1      ASN 103  69.999  -3.326   0.766
  842   HD21  ASN 103          HD21      ASN 103  73.284  -2.556   1.780
  843   HD22  ASN 103          HD22      ASN 103  72.862  -1.223   2.740
  844    H    GLU 104           H        GLU 104  72.346  -5.260  -1.482
  845    HA   GLU 104           HA       GLU 104  70.784  -7.696  -1.033
  846    HB2  GLU 104           HB2      GLU 104  69.605  -7.327  -3.246
  847    HB3  GLU 104           HB3      GLU 104  69.070  -6.287  -1.926
  848    HG2  GLU 104           HG2      GLU 104  70.218  -4.411  -2.773
  849    HG3  GLU 104           HG3      GLU 104  71.250  -5.396  -3.809
  850    HHA  HEC 201           HA       HEC 105  89.155  -3.528   3.499
  851    HHB  HEC 201           HB       HEC 105  85.490   0.014  -0.251
  852    HHC  HEC 201           HC       HEC 105  88.869  -1.840  -5.271
  853    HHD  HEC 201           HD       HEC 105  92.093  -5.854  -1.596
  854   HMA1  HEC 201          HMA1      HEC 105  85.279   0.746   1.832
  855   HMA2  HEC 201          HMA2      HEC 105  85.477   0.204   3.494
  856   HMA3  HEC 201          HMA3      HEC 105  84.386  -0.658   2.414
  857   HAA1  HEC 201          HAA1      HEC 105  86.836  -0.887   4.741
  858   HAA2  HEC 201          HAA2      HEC 105  88.167  -2.021   4.732
  859   HBA1  HEC 201          HBA1      HEC 105  86.703  -3.897   4.688
  860   HBA2  HEC 201          HBA2      HEC 105  85.310  -2.889   4.308
  861   HMB1  HEC 201          HMB1      HEC 105  84.094   0.044  -2.737
  862   HMB2  HEC 201          HMB2      HEC 105  84.896   1.214  -3.777
  863   HMB3  HEC 201          HMB3      HEC 105  84.997   1.381  -2.028
  864    HAB  HEC 201           HAB      HEC 105  87.395  -0.645  -5.977
  865   HBB1  HEC 201          HBB1      HEC 105  88.017   1.568  -5.821
  866   HBB2  HEC 201          HBB2      HEC 105  86.337   1.782  -6.310
  867   HBB3  HEC 201          HBB3      HEC 105  86.789   1.942  -4.614
  868   HMC1  HEC 201          HMC1      HEC 105  91.275  -4.424  -6.561
  869   HMC2  HEC 201          HMC2      HEC 105  91.405  -2.686  -6.304
  870   HMC3  HEC 201          HMC3      HEC 105  89.828  -3.421  -6.579
  871    HAC  HEC 201           HAC      HEC 105  92.594  -6.283  -3.506
  872   HBC1  HEC 201          HBC1      HEC 105  93.753  -5.770  -5.898
  873   HBC2  HEC 201          HBC2      HEC 105  94.315  -5.052  -4.390
  874   HBC3  HEC 201          HBC3      HEC 105  93.253  -4.138  -5.459
  875   HMD1  HEC 201          HMD1      HEC 105  92.117  -7.546   0.628
  876   HMD2  HEC 201          HMD2      HEC 105  92.938  -6.761   1.975
  877   HMD3  HEC 201          HMD3      HEC 105  93.343  -6.318   0.319
  878   HAD1  HEC 201          HAD1      HEC 105  91.304  -6.521   3.563
  879   HAD2  HEC 201          HAD2      HEC 105  90.231  -5.250   4.102
  880   HBD1  HEC 201          HBD1      HEC 105  92.823  -4.145   3.398
  881   HBD2  HEC 201          HBD2      HEC 105  93.001  -5.448   4.566
  882    H1   HOH 301           H2       HOH 200  82.372   3.554  -1.424
  883    H2   HOH 301           H1       HOH 200  83.828   3.186  -1.253
  884    H1   HOH 302           H2       HOH 201  85.453   5.791   5.808
  885    H2   HOH 302           H1       HOH 201  86.710   6.612   5.625
  886    H1   HOH 303           H2       HOH 202  83.839  -4.726   4.513
  887    H2   HOH 303           H1       HOH 202  83.967  -6.233   4.529
  888    H1   HOH 304           H2       HOH 203  83.697 -10.317  -0.563
  889    H2   HOH 304           H1       HOH 203  84.305  -9.088   0.053
  Start of MODEL    6
    1    H1   GLY   1           H1       GLY   1  75.177   9.312  -5.514
    2    H2   GLY   1           H2       GLY   1  76.262   9.453  -6.813
    3    H3   GLY   1           H3       GLY   1  75.084   8.228  -6.816
    4    HA2  GLY   1           HA2      GLY   1  73.565  10.432  -6.548
    5    HA3  GLY   1           HA3      GLY   1  74.871  10.998  -7.588
    6    H    ASP   2           H        ASP   2  75.129   7.997  -8.368
    7    HA   ASP   2           HA       ASP   2  72.733   7.599  -9.983
    8    HB2  ASP   2           HB2      ASP   2  75.441   7.995 -11.271
    9    HB3  ASP   2           HB1      ASP   2  73.956   7.530 -12.098
   10    H    VAL   3           H        VAL   3  72.544   5.688  -8.775
   11    HA   VAL   3           HA       VAL   3  74.428   3.754  -8.265
   12    HB   VAL   3           HB       VAL   3  72.165   3.569  -7.415
   13   HG11  VAL   3          HG11      VAL   3  70.358   2.808  -9.056
   14   HG12  VAL   3          HG12      VAL   3  71.449   3.316 -10.344
   15   HG13  VAL   3          HG13      VAL   3  70.851   4.497  -9.178
   16   HG21  VAL   3          HG21      VAL   3  71.804   1.216  -7.770
   17   HG22  VAL   3          HG22      VAL   3  73.544   1.485  -7.841
   18   HG23  VAL   3          HG23      VAL   3  72.626   1.266  -9.330
   19    H    GLU   4           H        GLU   4  73.195   4.761 -11.309
   20    HA   GLU   4           HA       GLU   4  73.705   2.350 -12.769
   21    HB2  GLU   4           HB2      GLU   4  73.538   5.201 -13.774
   22    HB3  GLU   4           HB3      GLU   4  73.424   3.742 -14.758
   23    HG2  GLU   4           HG2      GLU   4  71.422   3.050 -13.451
   24    HG3  GLU   4           HG3      GLU   4  71.513   4.564 -12.552
   25    H    LYS   5           H        LYS   5  75.428   5.482 -12.722
   26    HA   LYS   5           HA       LYS   5  77.725   4.401 -14.053
   27    HB2  LYS   5           HB2      LYS   5  77.161   7.000 -12.624
   28    HB3  LYS   5           HB3      LYS   5  78.766   6.618 -13.249
   29    HG2  LYS   5           HG2      LYS   5  77.953   6.447 -15.494
   30    HG3  LYS   5           HG3      LYS   5  76.272   6.475 -14.959
   31    HD2  LYS   5           HD2      LYS   5  78.016   8.797 -14.218
   32    HD3  LYS   5           HD3      LYS   5  77.466   8.678 -15.888
   33    HE2  LYS   5           HE2      LYS   5  75.174   8.737 -15.249
   34    HE3  LYS   5           HE3      LYS   5  75.560   8.433 -13.557
   35    HZ1  LYS   5           HZ1      LYS   5  75.869  10.585 -13.202
   36    HZ2  LYS   5           HZ2      LYS   5  75.229  10.881 -14.747
   37    HZ3  LYS   5           HZ3      LYS   5  76.909  10.738 -14.533
   38    H    GLY   6           H        GLY   6  76.603   4.454 -10.823
   39    HA2  GLY   6           HA2      GLY   6  79.129   4.279  -9.493
   40    HA3  GLY   6           HA3      GLY   6  77.564   3.818  -8.817
   41    H    LYS   7           H        LYS   7  76.859   2.022 -10.922
   42    HA   LYS   7           HA       LYS   7  78.108  -0.363  -9.976
   43    HB2  LYS   7           HB2      LYS   7  75.742  -0.198 -10.817
   44    HB3  LYS   7           HB3      LYS   7  76.393  -0.021 -12.445
   45    HG2  LYS   7           HG2      LYS   7  77.694  -2.204 -11.956
   46    HG3  LYS   7           HG3      LYS   7  76.588  -2.403 -10.600
   47    HD2  LYS   7           HD2      LYS   7  75.417  -3.535 -12.254
   48    HD3  LYS   7           HD3      LYS   7  74.745  -1.916 -12.447
   49    HE2  LYS   7           HE2      LYS   7  76.715  -1.564 -14.130
   50    HE3  LYS   7           HE3      LYS   7  76.791  -3.325 -14.149
   51    HZ1  LYS   7           HZ1      LYS   7  74.789  -3.498 -15.162
   52    HZ2  LYS   7           HZ2      LYS   7  75.229  -1.973 -15.766
   53    HZ3  LYS   7           HZ3      LYS   7  74.163  -2.092 -14.448
   54    H    LYS   8           H        LYS   8  78.311   1.543 -12.972
   55    HA   LYS   8           HA       LYS   8  79.999  -0.168 -14.418
   56    HB2  LYS   8           HB2      LYS   8  78.865   1.729 -15.448
   57    HB3  LYS   8           HB3      LYS   8  79.815   2.850 -14.475
   58    HG2  LYS   8           HG2      LYS   8  81.430   0.897 -16.000
   59    HG3  LYS   8           HG3      LYS   8  80.509   2.012 -17.004
   60    HD2  LYS   8           HD2      LYS   8  82.106   3.062 -14.675
   61    HD3  LYS   8           HD3      LYS   8  82.904   2.709 -16.207
   62    HE2  LYS   8           HE2      LYS   8  81.294   4.186 -17.376
   63    HE3  LYS   8           HE3      LYS   8  80.539   4.570 -15.829
   64    HZ1  LYS   8           HZ1      LYS   8  82.973   5.168 -15.181
   65    HZ2  LYS   8           HZ2      LYS   8  82.014   6.281 -16.036
   66    HZ3  LYS   8           HZ3      LYS   8  83.175   5.348 -16.856
   67    H    ILE   9           H        ILE   9  80.842   2.590 -12.324
   68    HA   ILE   9           HA       ILE   9  83.643   2.304 -12.596
   69    HB   ILE   9           HB       ILE   9  82.031   3.530 -10.346
   70   HG12  ILE   9          HG12      ILE   9  83.396   4.896 -12.678
   71   HG13  ILE   9          HG13      ILE   9  81.699   4.418 -12.721
   72   HG21  ILE   9          HG21      ILE   9  84.313   3.097  -9.629
   73   HG22  ILE   9          HG22      ILE   9  84.151   4.821  -9.969
   74   HG23  ILE   9          HG23      ILE   9  84.948   3.765 -11.133
   75   HD11  ILE   9          HD11      ILE   9  82.018   6.790 -11.998
   76   HD12  ILE   9          HD12      ILE   9  82.920   6.208 -10.600
   77   HD13  ILE   9          HD13      ILE   9  81.213   5.805 -10.777
   78    H    PHE  10           H        PHE  10  81.283   0.680 -10.627
   79    HA   PHE  10           HA       PHE  10  83.153  -0.315  -8.682
   80    HB2  PHE  10           HB2      PHE  10  81.015  -0.239  -7.807
   81    HB3  PHE  10           HB1      PHE  10  80.267  -0.766  -9.313
   82    HD1  PHE  10           HD1      PHE  10  80.246  -3.140  -9.952
   83    HD2  PHE  10           HD2      PHE  10  81.934  -1.842  -6.225
   84    HE1  PHE  10           HE1      PHE  10  80.241  -5.480  -9.140
   85    HE2  PHE  10           HE2      PHE  10  81.930  -4.186  -5.409
   86    HZ   PHE  10           HZ       PHE  10  81.084  -6.005  -6.870
   87    H    VAL  11           H        VAL  11  81.392  -1.867 -11.386
   88    HA   VAL  11           HA       VAL  11  82.448  -4.418 -11.126
   89    HB   VAL  11           HB       VAL  11  82.004  -4.681 -13.560
   90   HG11  VAL  11          HG11      VAL  11  79.793  -3.120 -12.226
   91   HG12  VAL  11          HG12      VAL  11  80.233  -4.746 -11.709
   92   HG13  VAL  11          HG13      VAL  11  79.646  -4.469 -13.349
   93   HG21  VAL  11          HG21      VAL  11  81.233  -1.758 -13.406
   94   HG22  VAL  11          HG22      VAL  11  81.152  -2.795 -14.827
   95   HG23  VAL  11          HG23      VAL  11  82.717  -2.340 -14.156
   96    H    GLN  12           H        GLN  12  83.887  -1.543 -12.473
   97    HA   GLN  12           HA       GLN  12  86.166  -3.099 -13.476
   98    HB2  GLN  12           HB2      GLN  12  86.921  -0.951 -14.447
   99    HB3  GLN  12           HB1      GLN  12  85.312  -1.427 -14.982
  100    HG2  GLN  12           HG2      GLN  12  84.624   0.048 -12.819
  101    HG3  GLN  12           HG1      GLN  12  86.138   0.843 -13.238
  102   HE21  GLN  12          HE21      GLN  12  83.608  -0.606 -15.354
  103   HE22  GLN  12          HE22      GLN  12  83.346   0.815 -16.239
  104    H    LYS  13           H        LYS  13  85.356  -1.082 -10.750
  105    HA   LYS  13           HA       LYS  13  88.214  -0.747 -10.115
  106    HB2  LYS  13           HB2      LYS  13  85.731   0.562  -9.026
  107    HB3  LYS  13           HB3      LYS  13  87.305   0.737  -8.262
  108    HG2  LYS  13           HG2      LYS  13  87.127   1.227 -11.209
  109    HG3  LYS  13           HG3      LYS  13  86.487   2.457 -10.125
  110    HD2  LYS  13           HD2      LYS  13  89.274   1.291  -9.889
  111    HD3  LYS  13           HD3      LYS  13  88.906   2.795 -10.730
  112    HE2  LYS  13           HE2      LYS  13  87.638   3.038  -8.227
  113    HE3  LYS  13           HE3      LYS  13  89.214   2.330  -7.879
  114    HZ1  LYS  13           HZ1      LYS  13  90.012   4.146  -9.545
  115    HZ2  LYS  13           HZ2      LYS  13  89.721   4.540  -7.918
  116    HZ3  LYS  13           HZ3      LYS  13  88.565   4.914  -9.105
  117    H    CYS  14           H        CYS  14  85.317  -1.438  -8.120
  118    HA   CYS  14           HA       CYS  14  87.011  -2.769  -6.183
  119    HB2  CYS  14           HB2      CYS  14  84.048  -2.697  -5.920
  120    HB3  CYS  14           HB1      CYS  14  85.290  -2.496  -4.686
  121    H    ALA  15           H        ALA  15  84.504  -3.846  -8.460
  122    HA   ALA  15           HA       ALA  15  83.956  -6.342  -7.447
  123    HB1  ALA  15           HB1      ALA  15  84.289  -5.397 -10.279
  124    HB2  ALA  15           HB2      ALA  15  82.803  -5.770  -9.404
  125    HB3  ALA  15           HB3      ALA  15  83.870  -7.072  -9.925
  126    H    GLN  16           H        GLN  16  86.938  -5.224  -8.848
  127    HA   GLN  16           HA       GLN  16  88.201  -7.542  -9.625
  128    HB2  GLN  16           HB2      GLN  16  89.257  -5.081  -8.252
  129    HB3  GLN  16           HB1      GLN  16  90.323  -6.389  -8.758
  130    HG2  GLN  16           HG2      GLN  16  89.572  -6.167 -11.064
  131    HG3  GLN  16           HG1      GLN  16  88.393  -4.944 -10.593
  132   HE21  GLN  16          HE21      GLN  16  91.945  -5.553 -10.528
  133   HE22  GLN  16          HE22      GLN  16  92.372  -3.918 -10.694
  134    H    CYS  17           H        CYS  17  88.595  -6.133  -6.341
  135    HA   CYS  17           HA       CYS  17  88.972  -8.900  -5.341
  136    HB2  CYS  17           HB2      CYS  17  90.144  -6.702  -3.751
  137    HB3  CYS  17           HB1      CYS  17  90.810  -8.279  -4.161
  138    H    HIS  18           H        HSD  18  86.384  -7.953  -5.414
  139    HA   HIS  18           HA       HSD  18  85.770  -7.902  -2.566
  140    HB2  HIS  18           HB2      HSD  18  85.166  -5.595  -4.392
  141    HB3  HIS  18           HB1      HSD  18  84.079  -5.969  -3.059
  142    HD1  HIS  18           HD1      HSD  18  85.017  -5.703  -0.632
  143    HD2  HIS  18           HD2      HSD  18  87.683  -4.559  -3.621
  144    HE1  HIS  18           HE1      HSD  18  86.866  -4.405   0.517
  145    H    THR  19           H        THR  19  83.174  -7.590  -2.467
  146    HA   THR  19           HA       THR  19  81.932  -9.218  -4.577
  147    HB   THR  19           HB       THR  19  81.266  -9.866  -1.738
  148    HG1  THR  19           HG1      THR  19  83.112 -11.533  -2.368
  149   HG21  THR  19          HG21      THR  19  81.736 -11.763  -4.017
  150   HG22  THR  19          HG22      THR  19  80.254 -10.810  -3.953
  151   HG23  THR  19          HG23      THR  19  80.641 -11.927  -2.643
  152    H    VAL  20           H        VAL  20  81.564  -7.186  -1.724
  153    HA   VAL  20           HA       VAL  20  79.817  -5.911  -0.948
  154    HB   VAL  20           HB       VAL  20  79.064  -4.247  -2.528
  155   HG11  VAL  20          HG11      VAL  20  81.230  -3.447  -3.299
  156   HG12  VAL  20          HG12      VAL  20  81.915  -5.065  -3.163
  157   HG13  VAL  20          HG13      VAL  20  81.426  -4.189  -1.715
  158   HG21  VAL  20          HG21      VAL  20  80.368  -5.872  -4.716
  159   HG22  VAL  20          HG22      VAL  20  79.347  -4.447  -4.884
  160   HG23  VAL  20          HG23      VAL  20  78.643  -5.977  -4.373
  161    H    GLU  21           H        GLU  21  79.031  -8.654  -1.571
  162    HA   GLU  21           HA       GLU  21  76.162  -8.138  -2.070
  163    HB2  GLU  21           HB2      GLU  21  75.927 -10.023  -3.437
  164    HB3  GLU  21           HB3      GLU  21  77.452  -9.328  -3.981
  165    HG2  GLU  21           HG2      GLU  21  78.595 -10.890  -2.312
  166    HG3  GLU  21           HG3      GLU  21  77.038 -11.707  -2.168
  167    H    LYS  22           H        LYS  22  75.009  -8.598  -0.343
  168    HA   LYS  22           HA       LYS  22  75.910  -9.673   2.024
  169    HB2  LYS  22           HB2      LYS  22  73.652  -8.515   1.427
  170    HB3  LYS  22           HB3      LYS  22  73.081 -10.157   1.130
  171    HG2  LYS  22           HG2      LYS  22  72.573  -9.973   3.383
  172    HG3  LYS  22           HG3      LYS  22  74.213 -10.611   3.501
  173    HD2  LYS  22           HD2      LYS  22  75.020  -8.198   3.579
  174    HD3  LYS  22           HD3      LYS  22  73.330  -7.727   3.767
  175    HE2  LYS  22           HE2      LYS  22  74.763  -9.682   5.588
  176    HE3  LYS  22           HE3      LYS  22  74.540  -7.970   5.951
  177    HZ1  LYS  22           HZ1      LYS  22  72.674  -8.740   6.917
  178    HZ2  LYS  22           HZ2      LYS  22  72.605 -10.139   5.956
  179    HZ3  LYS  22           HZ3      LYS  22  72.055  -8.654   5.340
  180    H    GLY  23           H        GLY  23  75.804 -11.686   3.024
  181    HA2  GLY  23           HA2      GLY  23  76.171 -13.959   3.105
  182    HA3  GLY  23           HA3      GLY  23  74.711 -14.044   2.129
  183    H    GLY  24           H        GLY  24  77.638 -12.469   1.004
  184    HA2  GLY  24           HA2      GLY  24  77.754 -14.304  -1.258
  185    HA3  GLY  24           HA3      GLY  24  78.694 -12.829  -1.054
  186    H    LYS  25           H        LYS  25  80.719 -13.596  -1.391
  187    HA   LYS  25           HA       LYS  25  81.870 -15.241   0.721
  188    HB2  LYS  25           HB2      LYS  25  83.042 -16.629  -1.144
  189    HB3  LYS  25           HB3      LYS  25  81.392 -17.050  -0.684
  190    HG2  LYS  25           HG2      LYS  25  80.503 -15.773  -2.572
  191    HG3  LYS  25           HG3      LYS  25  82.130 -15.252  -3.011
  192    HD2  LYS  25           HD2      LYS  25  82.788 -17.453  -3.623
  193    HD3  LYS  25           HD3      LYS  25  81.387 -18.175  -2.830
  194    HE2  LYS  25           HE2      LYS  25  79.902 -17.051  -4.471
  195    HE3  LYS  25           HE3      LYS  25  81.324 -16.395  -5.285
  196    HZ1  LYS  25           HZ1      LYS  25  81.306 -19.266  -4.822
  197    HZ2  LYS  25           HZ2      LYS  25  81.857 -18.382  -6.164
  198    HZ3  LYS  25           HZ3      LYS  25  80.197 -18.690  -5.970
  199    H    HIS  26           H        HIS  26  83.325 -13.764   1.370
  200    HA   HIS  26           HA       HIS  26  84.594 -11.825  -0.165
  201    HB2  HIS  26           HB2      HIS  26  86.395 -11.989   1.691
  202    HB3  HIS  26           HB1      HIS  26  84.753 -11.550   2.160
  203    HD1  HIS  26           HD1      HIS  26  83.261 -13.509   3.189
  204    HD2  HIS  26           HD2      HIS  26  87.313 -14.400   2.779
  205    HE1  HIS  26           HE1      HIS  26  83.690 -15.563   4.607
  206    HE2  HIS  26           HE2      HIS  26  86.156 -16.121   4.366
  207    H    LYS  27           H        LYS  27  86.266 -11.794  -1.531
  208    HA   LYS  27           HA       LYS  27  88.106 -14.087  -1.649
  209    HB2  LYS  27           HB2      LYS  27  87.936 -13.899  -4.206
  210    HB3  LYS  27           HB3      LYS  27  86.602 -14.696  -3.370
  211    HG2  LYS  27           HG2      LYS  27  85.274 -12.658  -3.446
  212    HG3  LYS  27           HG3      LYS  27  86.622 -11.767  -4.152
  213    HD2  LYS  27           HD2      LYS  27  85.067 -12.403  -5.923
  214    HD3  LYS  27           HD3      LYS  27  86.568 -13.308  -6.113
  215    HE2  LYS  27           HE2      LYS  27  85.610 -15.311  -5.380
  216    HE3  LYS  27           HE3      LYS  27  84.316 -14.490  -4.508
  217    HZ1  LYS  27           HZ1      LYS  27  83.095 -14.220  -6.378
  218    HZ2  LYS  27           HZ2      LYS  27  83.938 -15.617  -6.850
  219    HZ3  LYS  27           HZ3      LYS  27  84.446 -14.091  -7.395
  220    H    THR  28           H        THR  28  90.171 -13.453  -1.858
  221    HA   THR  28           HA       THR  28  91.967 -12.007  -1.901
  222    HB   THR  28           HB       THR  28  90.619 -10.634  -4.216
  223    HG1  THR  28           HG1      THR  28  91.417 -13.298  -3.957
  224   HG21  THR  28          HG21      THR  28  92.836 -10.406  -5.036
  225   HG22  THR  28          HG22      THR  28  93.453 -11.640  -3.938
  226   HG23  THR  28          HG23      THR  28  92.960 -10.068  -3.310
  227    H    GLY  29           H        GLY  29  89.558 -11.233  -0.368
  228    HA2  GLY  29           HA2      GLY  29  90.268  -8.926   0.828
  229    HA3  GLY  29           HA3      GLY  29  89.372  -8.346  -0.573
  230    HA   PRO  30           HA       PRO  30  86.529  -9.877   2.967
  231    HB2  PRO  30           HB2      PRO  30  86.012  -7.529   4.271
  232    HB3  PRO  30           HB1      PRO  30  87.341  -8.614   4.722
  233    HG2  PRO  30           HG2      PRO  30  87.412  -6.108   3.109
  234    HG3  PRO  30           HG1      PRO  30  88.541  -6.685   4.347
  235    HD2  PRO  30           HD2      PRO  30  89.044  -6.915   1.665
  236    HD3  PRO  30           HD1      PRO  30  89.673  -8.062   2.868
  237    H    ASN  31           H        ASN  31  84.245  -8.874   3.446
  238    HA   ASN  31           HA       ASN  31  83.172  -7.913   0.872
  239    HB2  ASN  31           HB2      ASN  31  82.336 -10.042   2.157
  240    HB3  ASN  31           HB1      ASN  31  81.482  -8.877   3.165
  241   HD21  ASN  31          HD21      ASN  31  80.834 -10.857   0.688
  242   HD22  ASN  31          HD22      ASN  31  79.741  -9.912  -0.202
  243    H    LEU  32           H        LEU  32  81.293  -6.380   1.061
  244    HA   LEU  32           HA       LEU  32  81.834  -4.386   3.187
  245    HB2  LEU  32           HB2      LEU  32  80.600  -3.847   0.483
  246    HB3  LEU  32           HB3      LEU  32  81.168  -2.665   1.655
  247    HG   LEU  32           HG       LEU  32  82.840  -4.599   0.031
  248   HD11  LEU  32          HD11      LEU  32  81.925  -2.187  -0.713
  249   HD12  LEU  32          HD12      LEU  32  83.535  -2.747  -1.160
  250   HD13  LEU  32          HD13      LEU  32  83.330  -1.654   0.209
  251   HD21  LEU  32          HD21      LEU  32  84.733  -3.261   1.258
  252   HD22  LEU  32          HD22      LEU  32  83.976  -4.619   2.083
  253   HD23  LEU  32          HD23      LEU  32  83.495  -2.973   2.475
  254    H    HIS  33           H        HIS  33  80.113  -6.521   3.733
  255    HA   HIS  33           HA       HIS  33  77.382  -5.968   3.197
  256    HB2  HIS  33           HB2      HIS  33  78.680  -7.504   5.459
  257    HB3  HIS  33           HB1      HIS  33  76.949  -7.488   5.130
  258    HD1  HIS  33           HD1      HIS  33  78.214 -10.182   4.919
  259    HD2  HIS  33           HD2      HIS  33  78.148  -7.548   1.689
  260    HE1  HIS  33           HE1      HIS  33  78.502 -11.594   2.838
  261    HE2  HIS  33           HE2      HIS  33  78.462 -10.003   0.860
  262    H    GLY  34           H        GLY  34  75.938  -4.634   4.161
  263    HA2  GLY  34           HA2      GLY  34  75.339  -2.695   5.320
  264    HA3  GLY  34           HA3      GLY  34  75.658  -3.755   6.692
  265    H    LEU  35           H        LEU  35  78.138  -2.782   4.463
  266    HA   LEU  35           HA       LEU  35  80.098  -2.080   6.190
  267    HB2  LEU  35           HB2      LEU  35  80.478  -2.163   3.809
  268    HB3  LEU  35           HB3      LEU  35  79.393  -0.804   3.542
  269    HG   LEU  35           HG       LEU  35  81.071   0.427   5.207
  270   HD11  LEU  35          HD11      LEU  35  82.320  -1.878   5.372
  271   HD12  LEU  35          HD12      LEU  35  83.256  -0.390   5.252
  272   HD13  LEU  35          HD13      LEU  35  83.015  -1.393   3.828
  273   HD21  LEU  35          HD21      LEU  35  82.234   1.310   3.281
  274   HD22  LEU  35          HD22      LEU  35  80.574   0.971   2.794
  275   HD23  LEU  35          HD23      LEU  35  81.869  -0.136   2.340
  276    H    PHE  36           H        PHE  36  77.851   0.279   4.764
  277    HA   PHE  36           HA       PHE  36  78.683   2.507   6.205
  278    HB2  PHE  36           HB2      PHE  36  75.841   1.970   5.322
  279    HB3  PHE  36           HB1      PHE  36  76.608   3.540   5.563
  280    HD1  PHE  36           HD2      PHE  36  76.699   0.445   3.480
  281    HD2  PHE  36           HD1      PHE  36  77.926   4.551   3.843
  282    HE1  PHE  36           HE2      PHE  36  77.526   0.409   1.145
  283    HE2  PHE  36           HE1      PHE  36  78.740   4.511   1.512
  284    HZ   PHE  36           HZ       PHE  36  78.543   2.443   0.158
  285    H    GLY  37           H        GLY  37  79.063   2.029   8.393
  286    HA2  GLY  37           HA2      GLY  37  77.605   2.771  10.387
  287    HA3  GLY  37           HA3      GLY  37  76.694   1.319  10.010
  288    H    ARG  38           H        ARG  38  79.267  -0.109   9.284
  289    HA   ARG  38           HA       ARG  38  79.852  -0.987  12.003
  290    HB2  ARG  38           HB2      ARG  38  80.307  -2.055   9.261
  291    HB3  ARG  38           HB3      ARG  38  81.409  -2.583  10.532
  292    HG2  ARG  38           HG2      ARG  38  79.201  -3.036  11.885
  293    HG3  ARG  38           HG3      ARG  38  78.438  -3.012  10.297
  294    HD2  ARG  38           HD2      ARG  38  80.723  -4.620   9.969
  295    HD3  ARG  38           HD3      ARG  38  80.057  -5.095  11.524
  296    HE   ARG  38           HE       ARG  38  78.008  -5.694  10.414
  297   HH11  ARG  38          HH21      ARG  38  80.596  -4.743   8.291
  298   HH12  ARG  38          HH22      ARG  38  79.909  -5.512   6.902
  299   HH21  ARG  38          HH11      ARG  38  77.121  -6.689   8.589
  300   HH22  ARG  38          HH12      ARG  38  77.947  -6.606   7.068
  301    H    LYS  39           H        LYS  39  81.820  -0.947  13.017
  302    HA   LYS  39           HA       LYS  39  83.549   1.232  12.475
  303    HB2  LYS  39           HB2      LYS  39  83.532  -1.057  14.393
  304    HB3  LYS  39           HB3      LYS  39  85.026  -0.146  14.192
  305    HG2  LYS  39           HG2      LYS  39  82.549   1.475  14.525
  306    HG3  LYS  39           HG3      LYS  39  83.081   0.574  15.943
  307    HD2  LYS  39           HD2      LYS  39  85.308   1.591  15.797
  308    HD3  LYS  39           HD3      LYS  39  84.839   2.449  14.330
  309    HE2  LYS  39           HE2      LYS  39  82.972   2.891  16.557
  310    HE3  LYS  39           HE3      LYS  39  84.609   3.453  16.899
  311    HZ1  LYS  39           HZ1      LYS  39  84.420   5.097  15.433
  312    HZ2  LYS  39           HZ2      LYS  39  82.748   4.796  15.459
  313    HZ3  LYS  39           HZ3      LYS  39  83.720   4.104  14.250
  314    H    THR  40           H        THR  40  85.959   0.987  12.253
  315    HA   THR  40           HA       THR  40  86.599  -0.305   9.836
  316    HB   THR  40           HB       THR  40  89.019   0.193  10.652
  317    HG1  THR  40           HG1      THR  40  87.623   1.850  12.442
  318   HG21  THR  40          HG21      THR  40  87.782   1.569   9.027
  319   HG22  THR  40          HG22      THR  40  88.711   2.580  10.133
  320   HG23  THR  40          HG23      THR  40  86.970   2.405  10.351
  321    H    GLY  41           H        GLY  41  87.865  -2.087   9.358
  322    HA2  GLY  41           HA2      GLY  41  88.459  -4.290   9.577
  323    HA3  GLY  41           HA3      GLY  41  89.271  -3.746  11.041
  324    H    GLN  42           H        GLN  42  85.838  -4.136  10.128
  325    HA   GLN  42           HA       GLN  42  85.487  -5.742  12.598
  326    HB2  GLN  42           HB2      GLN  42  84.362  -3.498  12.568
  327    HB3  GLN  42           HB1      GLN  42  83.380  -4.071  11.219
  328    HG2  GLN  42           HG2      GLN  42  82.324  -5.727  12.537
  329    HG3  GLN  42           HG1      GLN  42  83.549  -5.627  13.801
  330   HE21  GLN  42          HE21      GLN  42  81.079  -3.530  12.210
  331   HE22  GLN  42          HE22      GLN  42  80.683  -2.683  13.627
  332    H    ALA  43           H        ALA  43  85.114  -5.706   9.162
  333    HA   ALA  43           HA       ALA  43  83.021  -7.565   8.882
  334    HB1  ALA  43           HB1      ALA  43  83.461  -7.417   6.665
  335    HB2  ALA  43           HB2      ALA  43  85.178  -7.751   6.878
  336    HB3  ALA  43           HB3      ALA  43  84.555  -6.123   7.148
  337    HA   PRO  44           HA       PRO  44  85.343 -11.090  10.449
  338    HB2  PRO  44           HB2      PRO  44  83.309 -12.878  10.491
  339    HB3  PRO  44           HB1      PRO  44  83.428 -11.560  11.674
  340    HG2  PRO  44           HG2      PRO  44  81.728 -11.762   9.233
  341    HG3  PRO  44           HG1      PRO  44  81.329 -11.120  10.836
  342    HD2  PRO  44           HD2      PRO  44  82.002  -9.540   8.672
  343    HD3  PRO  44           HD1      PRO  44  82.210  -9.044  10.367
  344    H    GLY  45           H        GLY  45  86.742 -12.030   9.051
  345    HA2  GLY  45           HA2      GLY  45  86.332 -14.186   7.486
  346    HA3  GLY  45           HA3      GLY  45  85.905 -12.868   6.400
  347    H    PHE  46           H        PHE  46  87.594 -11.058   6.319
  348    HA   PHE  46           HA       PHE  46  90.153 -12.284   5.703
  349    HB2  PHE  46           HB2      PHE  46  88.958 -10.521   4.284
  350    HB3  PHE  46           HB1      PHE  46  89.467  -9.353   5.503
  351    HD1  PHE  46           HD2      PHE  46  90.601 -11.673   2.874
  352    HD2  PHE  46           HD1      PHE  46  91.819  -8.783   5.810
  353    HE1  PHE  46           HE2      PHE  46  92.850 -11.564   1.834
  354    HE2  PHE  46           HE1      PHE  46  94.068  -8.674   4.769
  355    HZ   PHE  46           HZ       PHE  46  94.583 -10.065   2.781
  356    H    THR  47           H        THR  47  92.176 -11.528   6.505
  357    HA   THR  47           HA       THR  47  92.106 -10.898   9.335
  358    HB   THR  47           HB       THR  47  94.534 -11.190   7.561
  359    HG1  THR  47           HG1      THR  47  92.682 -13.007   8.392
  360   HG21  THR  47          HG21      THR  47  95.650 -11.758   9.643
  361   HG22  THR  47          HG22      THR  47  94.123 -11.687  10.521
  362   HG23  THR  47          HG23      THR  47  94.822 -10.214   9.848
  363    H    TYR  48           H        TYR  48  91.274  -8.779   9.327
  364    HA   TYR  48           HA       TYR  48  92.215  -6.621   7.825
  365    HB2  TYR  48           HB2      TYR  48  90.828  -6.895  10.462
  366    HB3  TYR  48           HB3      TYR  48  91.436  -5.313   9.989
  367    HD1  TYR  48           HD2      TYR  48  90.955  -4.735   7.402
  368    HD2  TYR  48           HD1      TYR  48  88.631  -7.383   9.854
  369    HE1  TYR  48           HE2      TYR  48  89.005  -4.390   5.920
  370    HE2  TYR  48           HE1      TYR  48  86.676  -7.026   8.376
  371    HH   TYR  48           HH       TYR  48  86.283  -4.609   6.394
  372    H    THR  49           H        THR  49  93.654  -4.934   8.296
  373    HA   THR  49           HA       THR  49  96.052  -5.791   9.684
  374    HB   THR  49           HB       THR  49  97.032  -3.739   8.816
  375    HG1  THR  49           HG1      THR  49  95.812  -2.101   8.389
  376   HG21  THR  49          HG21      THR  49  96.430  -4.068   6.358
  377   HG22  THR  49          HG22      THR  49  95.252  -5.260   6.902
  378   HG23  THR  49          HG23      THR  49  96.968  -5.511   7.215
  379    H    ASP  50           H        ASP  50  97.032  -4.673  11.427
  380    HA   ASP  50           HA       ASP  50  95.500  -4.087  13.614
  381    HB2  ASP  50           HB2      ASP  50  98.084  -2.647  13.012
  382    HB3  ASP  50           HB1      ASP  50  97.424  -3.064  14.593
  383    H    ALA  51           H        ALA  51  96.394  -1.901  11.003
  384    HA   ALA  51           HA       ALA  51  95.571   0.514  12.199
  385    HB1  ALA  51           HB1      ALA  51  95.423   1.368   9.889
  386    HB2  ALA  51           HB2      ALA  51  95.567  -0.281   9.278
  387    HB3  ALA  51           HB3      ALA  51  96.910   0.456  10.152
  388    H    ASN  52           H        ASN  52  93.792  -1.862  10.247
  389    HA   ASN  52           HA       ASN  52  91.329  -0.346  10.381
  390    HB2  ASN  52           HB2      ASN  52  92.144  -3.015   9.272
  391    HB3  ASN  52           HB1      ASN  52  90.436  -2.643   9.477
  392   HD21  ASN  52          HD21      ASN  52  90.351  -2.729   7.040
  393   HD22  ASN  52          HD22      ASN  52  90.821  -1.352   6.163
  394    H    LYS  53           H        LYS  53  92.924  -2.786  12.234
  395    HA   LYS  53           HA       LYS  53  90.534  -3.560  13.698
  396    HB2  LYS  53           HB2      LYS  53  91.845  -5.426  13.684
  397    HB3  LYS  53           HB3      LYS  53  93.323  -4.504  13.449
  398    HG2  LYS  53           HG2      LYS  53  93.373  -3.913  15.825
  399    HG3  LYS  53           HG3      LYS  53  91.839  -4.747  16.082
  400    HD2  LYS  53           HD2      LYS  53  93.019  -6.833  15.137
  401    HD3  LYS  53           HD3      LYS  53  94.521  -5.939  15.375
  402    HE2  LYS  53           HE2      LYS  53  92.618  -7.026  17.409
  403    HE3  LYS  53           HE3      LYS  53  94.380  -6.987  17.431
  404    HZ1  LYS  53           HZ1      LYS  53  94.040  -4.452  17.576
  405    HZ2  LYS  53           HZ2      LYS  53  93.816  -5.392  18.974
  406    HZ3  LYS  53           HZ3      LYS  53  92.471  -4.843  18.091
  407    H    ASN  54           H        ASN  54  92.696  -1.035  13.700
  408    HA   ASN  54           HA       ASN  54  93.044  -0.581  16.492
  409    HB2  ASN  54           HB2      ASN  54  94.078   1.377  15.861
  410    HB3  ASN  54           HB1      ASN  54  94.240   0.455  14.374
  411   HD21  ASN  54          HD21      ASN  54  91.504   0.722  13.457
  412   HD22  ASN  54          HD22      ASN  54  91.249   2.353  13.065
  413    H    LYS  55           H        LYS  55  90.439  -0.165  14.325
  414    HA   LYS  55           HA       LYS  55  88.331   0.761  14.540
  415    HB2  LYS  55           HB2      LYS  55  89.089  -0.033  17.318
  416    HB3  LYS  55           HB3      LYS  55  87.670   0.991  17.124
  417    HG2  LYS  55           HG2      LYS  55  86.797  -1.197  17.016
  418    HG3  LYS  55           HG3      LYS  55  86.919  -0.715  15.329
  419    HD2  LYS  55           HD2      LYS  55  87.864  -2.878  15.365
  420    HD3  LYS  55           HD3      LYS  55  89.259  -1.804  15.381
  421    HE2  LYS  55           HE2      LYS  55  89.681  -2.186  17.670
  422    HE3  LYS  55           HE3      LYS  55  88.050  -2.782  17.966
  423    HZ1  LYS  55           HZ1      LYS  55  88.509  -4.778  16.868
  424    HZ2  LYS  55           HZ2      LYS  55  89.880  -4.494  17.831
  425    HZ3  LYS  55           HZ3      LYS  55  89.930  -4.179  16.162
  426    H    GLY  56           H        GLY  56  89.729   2.713  13.753
  427    HA2  GLY  56           HA2      GLY  56  89.870   4.857  15.748
  428    HA3  GLY  56           HA3      GLY  56  90.531   4.909  14.117
  429    H    ILE  57           H        ILE  57  88.056   3.951  12.865
  430    HA   ILE  57           HA       ILE  57  86.101   6.043  13.491
  431    HB   ILE  57           HB       ILE  57  86.046   6.912  11.226
  432   HG12  ILE  57          HG12      ILE  57  88.225   6.108   9.843
  433   HG13  ILE  57          HG13      ILE  57  87.924   4.631  10.756
  434   HG21  ILE  57          HG21      ILE  57  88.924   6.849  12.163
  435   HG22  ILE  57          HG22      ILE  57  87.675   7.832  12.925
  436   HG23  ILE  57          HG23      ILE  57  88.125   8.125  11.246
  437   HD11  ILE  57          HD11      ILE  57  85.689   6.011   9.264
  438   HD12  ILE  57          HD12      ILE  57  85.785   4.332   9.791
  439   HD13  ILE  57          HD13      ILE  57  86.772   4.889   8.447
  440    H    THR  58           H        THR  58  84.296   5.852  11.644
  441    HA   THR  58           HA       THR  58  83.721   2.970  11.300
  442    HB   THR  58           HB       THR  58  81.862   5.197  12.143
  443    HG1  THR  58           HG1      THR  58  81.641   3.922  13.945
  444   HG21  THR  58          HG21      THR  58  80.149   3.293  12.137
  445   HG22  THR  58          HG22      THR  58  81.290   2.417  11.121
  446   HG23  THR  58          HG23      THR  58  80.605   3.941  10.561
  447    H    TRP  59           H        TRP  59  82.862   2.318   9.386
  448    HA   TRP  59           HA       TRP  59  83.252   3.942   7.097
  449    HB2  TRP  59           HB2      TRP  59  81.441   1.535   7.162
  450    HB3  TRP  59           HB1      TRP  59  82.455   2.120   5.841
  451    HD1  TRP  59           HD1      TRP  59  85.180   2.481   7.285
  452    HE1  TRP  59           HE1      TRP  59  86.502   0.432   8.128
  453    HE3  TRP  59           HE3      TRP  59  81.417  -0.950   7.603
  454    HZ2  TRP  59           HZ2      TRP  59  86.015  -2.288   8.869
  455    HZ3  TRP  59           HZ3      TRP  59  81.877  -3.261   8.370
  456    HH2  TRP  59           HH2      TRP  59  84.171  -3.930   9.005
  457    H    LYS  60           H        LYS  60  81.874   5.148   5.905
  458    HA   LYS  60           HA       LYS  60  79.014   5.126   6.375
  459    HB2  LYS  60           HB2      LYS  60  80.719   7.519   7.113
  460    HB3  LYS  60           HB3      LYS  60  78.972   7.592   6.888
  461    HG2  LYS  60           HG2      LYS  60  78.820   5.698   8.609
  462    HG3  LYS  60           HG3      LYS  60  80.510   6.038   8.975
  463    HD2  LYS  60           HD2      LYS  60  78.406   8.209   9.000
  464    HD3  LYS  60           HD3      LYS  60  78.757   7.232  10.424
  465    HE2  LYS  60           HE2      LYS  60  81.190   7.887  10.155
  466    HE3  LYS  60           HE3      LYS  60  80.669   9.035   8.922
  467    HZ1  LYS  60           HZ1      LYS  60  79.685   8.971  11.724
  468    HZ2  LYS  60           HZ2      LYS  60  79.251  10.104  10.535
  469    HZ3  LYS  60           HZ3      LYS  60  80.845  10.052  11.123
  470    H    GLU  61           H        GLU  61  78.428   7.584   5.145
  471    HA   GLU  61           HA       GLU  61  78.977   6.899   2.404
  472    HB2  GLU  61           HB2      GLU  61  76.817   7.911   3.289
  473    HB3  GLU  61           HB3      GLU  61  77.687   9.441   3.400
  474    HG2  GLU  61           HG2      GLU  61  78.234   9.310   0.998
  475    HG3  GLU  61           HG3      GLU  61  77.368   7.780   0.884
  476    H    GLU  62           H        GLU  62  79.612   9.855   4.323
  477    HA   GLU  62           HA       GLU  62  81.370  10.957   2.366
  478    HB2  GLU  62           HB2      GLU  62  81.202  11.653   5.306
  479    HB3  GLU  62           HB3      GLU  62  81.840  12.665   4.009
  480    HG2  GLU  62           HG2      GLU  62  79.580  12.618   2.932
  481    HG3  GLU  62           HG3      GLU  62  78.972  11.745   4.338
  482    H    THR  63           H        THR  63  81.861   9.061   5.307
  483    HA   THR  63           HA       THR  63  84.654   9.333   5.502
  484    HB   THR  63           HB       THR  63  84.593   7.264   6.805
  485    HG1  THR  63           HG1      THR  63  82.957   5.908   6.670
  486   HG21  THR  63          HG21      THR  63  82.663   7.920   8.354
  487   HG22  THR  63          HG22      THR  63  82.329   9.213   7.203
  488   HG23  THR  63          HG23      THR  63  83.881   9.153   8.039
  489    H    LEU  64           H        LEU  64  82.612   7.228   3.563
  490    HA   LEU  64           HA       LEU  64  84.703   5.550   2.616
  491    HB2  LEU  64           HB2      LEU  64  81.864   5.904   2.107
  492    HB3  LEU  64           HB3      LEU  64  82.749   5.622   0.616
  493    HG   LEU  64           HG       LEU  64  83.142   3.880   3.052
  494   HD11  LEU  64          HD11      LEU  64  80.911   3.975   1.122
  495   HD12  LEU  64          HD12      LEU  64  80.993   3.217   2.709
  496   HD13  LEU  64          HD13      LEU  64  81.645   2.383   1.299
  497   HD21  LEU  64          HD21      LEU  64  84.871   3.837   1.248
  498   HD22  LEU  64          HD22      LEU  64  83.613   3.426   0.084
  499   HD23  LEU  64          HD23      LEU  64  84.015   2.302   1.381
  500    H    MET  65           H        MET  65  83.297   8.592   1.495
  501    HA   MET  65           HA       MET  65  84.461   8.731  -1.036
  502    HB2  MET  65           HB2      MET  65  83.922  10.982   0.911
  503    HB3  MET  65           HB1      MET  65  84.253  11.184  -0.809
  504    HG2  MET  65           HG2      MET  65  82.264   9.969  -1.412
  505    HG3  MET  65           HG1      MET  65  81.990   9.486   0.260
  506    HE1  MET  65           HE1      MET  65  80.472  13.068  -1.878
  507    HE2  MET  65           HE2      MET  65  80.492  11.347  -2.256
  508    HE3  MET  65           HE3      MET  65  81.981  12.284  -2.362
  509    H    GLU  66           H        GLU  66  85.713  10.139   1.997
  510    HA   GLU  66           HA       GLU  66  88.190  10.970   0.967
  511    HB2  GLU  66           HB2      GLU  66  87.596  10.041   3.787
  512    HB3  GLU  66           HB3      GLU  66  88.919  11.095   3.283
  513    HG2  GLU  66           HG2      GLU  66  87.212  12.726   2.433
  514    HG3  GLU  66           HG3      GLU  66  85.955  11.704   3.125
  515    H    TYR  67           H        TYR  67  87.033   7.878   2.086
  516    HA   TYR  67           HA       TYR  67  89.632   6.623   2.188
  517    HB2  TYR  67           HB2      TYR  67  87.885   5.758   3.612
  518    HB3  TYR  67           HB3      TYR  67  86.815   5.535   2.233
  519    HD1  TYR  67           HD1      TYR  67  89.784   4.254   3.993
  520    HD2  TYR  67           HD2      TYR  67  87.131   3.700   0.660
  521    HE1  TYR  67           HE1      TYR  67  90.688   1.970   3.654
  522    HE2  TYR  67           HE2      TYR  67  88.038   1.417   0.318
  523    HH   TYR  67           HH       TYR  67  89.607  -0.047   0.928
  524    H    LEU  68           H        LEU  68  87.153   7.182  -0.169
  525    HA   LEU  68           HA       LEU  68  88.103   5.195  -2.040
  526    HB2  LEU  68           HB2      LEU  68  85.952   7.274  -2.005
  527    HB3  LEU  68           HB3      LEU  68  86.500   6.680  -3.566
  528    HG   LEU  68           HG       LEU  68  85.553   4.915  -1.290
  529   HD11  LEU  68          HD11      LEU  68  84.169   6.052  -3.715
  530   HD12  LEU  68          HD12      LEU  68  83.622   6.007  -2.044
  531   HD13  LEU  68          HD13      LEU  68  83.635   4.530  -2.998
  532   HD21  LEU  68          HD21      LEU  68  86.783   3.436  -2.529
  533   HD22  LEU  68          HD22      LEU  68  86.706   4.418  -3.988
  534   HD23  LEU  68          HD23      LEU  68  85.332   3.421  -3.524
  535    H    GLU  69           H        GLU  69  88.794   8.502  -1.286
  536    HA   GLU  69           HA       GLU  69  90.135   8.966  -3.853
  537    HB2  GLU  69           HB2      GLU  69  90.053  11.202  -3.358
  538    HB3  GLU  69           HB3      GLU  69  88.733  10.671  -2.321
  539    HG2  GLU  69           HG2      GLU  69  90.517  10.367  -0.492
  540    HG3  GLU  69           HG3      GLU  69  91.578  11.309  -1.538
  541    H    ASN  70           H        ASN  70  90.817   7.594  -0.906
  542    HA   ASN  70           HA       ASN  70  93.545   7.171  -1.442
  543    HB2  ASN  70           HB2      ASN  70  92.978   9.718  -0.256
  544    HB3  ASN  70           HB1      ASN  70  93.824   8.731   0.930
  545   HD21  ASN  70          HD21      ASN  70  95.968   7.823   0.259
  546   HD22  ASN  70          HD22      ASN  70  96.860   8.609  -0.954
  547    HA   PRO  71           HA       PRO  71  91.188   4.394   1.488
  548    HB2  PRO  71           HB2      PRO  71  93.062   2.531   0.086
  549    HB3  PRO  71           HB1      PRO  71  91.345   2.322   0.473
  550    HG2  PRO  71           HG2      PRO  71  92.153   2.883  -2.003
  551    HG3  PRO  71           HG1      PRO  71  90.646   3.543  -1.344
  552    HD2  PRO  71           HD2      PRO  71  93.252   4.914  -1.827
  553    HD3  PRO  71           HD1      PRO  71  91.602   5.573  -1.881
  554    H    LYS  72           H        LYS  72  94.632   4.714   0.767
  555    HA   LYS  72           HA       LYS  72  95.464   3.407   3.205
  556    HB2  LYS  72           HB2      LYS  72  96.795   3.318   1.112
  557    HB3  LYS  72           HB3      LYS  72  97.076   5.050   1.245
  558    HG2  LYS  72           HG2      LYS  72  98.999   4.168   2.247
  559    HG3  LYS  72           HG3      LYS  72  97.969   4.481   3.639
  560    HD2  LYS  72           HD2      LYS  72  98.981   2.247   3.806
  561    HD3  LYS  72           HD3      LYS  72  97.235   2.113   3.625
  562    HE2  LYS  72           HE2      LYS  72  97.398   1.132   1.563
  563    HE3  LYS  72           HE3      LYS  72  98.777   2.124   1.085
  564    HZ1  LYS  72           HZ1      LYS  72  99.800   0.133   1.352
  565    HZ2  LYS  72           HZ2      LYS  72  98.718  -0.410   2.543
  566    HZ3  LYS  72           HZ3      LYS  72  99.939   0.702   2.944
  567    H    LYS  73           H        LYS  73  95.525   6.770   1.995
  568    HA   LYS  73           HA       LYS  73  96.754   7.907   4.224
  569    HB2  LYS  73           HB2      LYS  73  95.949   8.907   1.875
  570    HB3  LYS  73           HB3      LYS  73  94.618   9.487   2.876
  571    HG2  LYS  73           HG2      LYS  73  96.420  10.336   4.499
  572    HG3  LYS  73           HG3      LYS  73  97.569  10.053   3.192
  573    HD2  LYS  73           HD2      LYS  73  97.008  12.262   2.757
  574    HD3  LYS  73           HD3      LYS  73  95.794  11.440   1.777
  575    HE2  LYS  73           HE2      LYS  73  94.286  11.538   3.858
  576    HE3  LYS  73           HE3      LYS  73  95.453  12.689   4.507
  577    HZ1  LYS  73           HZ1      LYS  73  94.673  13.252   1.800
  578    HZ2  LYS  73           HZ2      LYS  73  94.742  14.284   3.148
  579    HZ3  LYS  73           HZ3      LYS  73  93.375  13.309   2.890
  580    H    TYR  74           H        TYR  74  93.377   7.022   3.713
  581    HA   TYR  74           HA       TYR  74  92.339   8.428   5.954
  582    HB2  TYR  74           HB2      TYR  74  91.172   7.178   3.883
  583    HB3  TYR  74           HB3      TYR  74  91.017   5.903   5.091
  584    HD1  TYR  74           HD1      TYR  74  90.647   9.638   4.888
  585    HD2  TYR  74           HD2      TYR  74  89.076   5.933   6.393
  586    HE1  TYR  74           HE1      TYR  74  88.756  10.861   5.927
  587    HE2  TYR  74           HE2      TYR  74  87.188   7.157   7.432
  588    HH   TYR  74           HH       TYR  74  87.160  10.380   7.971
  589    H    ILE  75           H        ILE  75  93.040   4.952   5.533
  590    HA   ILE  75           HA       ILE  75  93.560   4.801   8.445
  591    HB   ILE  75           HB       ILE  75  92.267   2.638   6.764
  592   HG12  ILE  75          HG12      ILE  75  90.948   4.337   8.894
  593   HG13  ILE  75          HG13      ILE  75  90.896   4.775   7.186
  594   HG21  ILE  75          HG21      ILE  75  93.410   1.645   8.607
  595   HG22  ILE  75          HG22      ILE  75  91.732   1.788   9.130
  596   HG23  ILE  75          HG23      ILE  75  92.934   2.945   9.700
  597   HD11  ILE  75          HD11      ILE  75  90.001   2.085   8.251
  598   HD12  ILE  75          HD12      ILE  75  89.780   2.711   6.617
  599   HD13  ILE  75          HD13      ILE  75  88.905   3.437   7.965
  600    HA   PRO  76           HA       PRO  76  97.332   3.778   5.778
  601    HB2  PRO  76           HB2      PRO  76  98.369   4.507   8.499
  602    HB3  PRO  76           HB1      PRO  76  99.046   4.878   6.901
  603    HG2  PRO  76           HG2      PRO  76  97.690   6.700   8.306
  604    HG3  PRO  76           HG1      PRO  76  97.593   6.618   6.540
  605    HD2  PRO  76           HD2      PRO  76  95.540   5.900   8.553
  606    HD3  PRO  76           HD1      PRO  76  95.338   6.336   6.843
  607    H    GLY  77           H        GLY  77  98.012   1.727   5.621
  608    HA2  GLY  77           HA2      GLY  77  99.116  -0.178   6.700
  609    HA3  GLY  77           HA3      GLY  77  97.987   0.012   8.039
  610    H    THR  78           H        THR  78  95.749   0.590   6.180
  611    HA   THR  78           HA       THR  78  94.628  -1.952   5.969
  612    HB   THR  78           HB       THR  78  93.377   0.213   5.868
  613    HG1  THR  78           HG1      THR  78  93.039  -1.991   4.292
  614   HG21  THR  78          HG21      THR  78  93.327   1.492   3.869
  615   HG22  THR  78          HG22      THR  78  94.170   0.240   2.958
  616   HG23  THR  78          HG23      THR  78  95.035   1.179   4.175
  617    H    LYS  79           H        LYS  79  94.790  -3.575   4.526
  618    HA   LYS  79           HA       LYS  79  96.784  -3.385   2.449
  619    HB2  LYS  79           HB2      LYS  79  96.326  -5.445   3.839
  620    HB3  LYS  79           HB3      LYS  79  94.833  -5.642   2.925
  621    HG2  LYS  79           HG2      LYS  79  96.268  -6.952   1.654
  622    HG3  LYS  79           HG3      LYS  79  96.459  -5.401   0.838
  623    HD2  LYS  79           HD2      LYS  79  98.462  -4.929   2.213
  624    HD3  LYS  79           HD3      LYS  79  98.276  -6.491   3.010
  625    HE2  LYS  79           HE2      LYS  79  98.936  -5.951   0.111
  626    HE3  LYS  79           HE3      LYS  79  99.885  -6.852   1.292
  627    HZ1  LYS  79           HZ1      LYS  79  97.416  -7.649  -0.099
  628    HZ2  LYS  79           HZ2      LYS  79  97.800  -8.338   1.405
  629    HZ3  LYS  79           HZ3      LYS  79  98.864  -8.511   0.091
  630    H    MET  80           H        MET  80  96.035  -1.860   0.963
  631    HA   MET  80           HA       MET  80  94.458  -2.837  -1.160
  632    HB2  MET  80           HB2      MET  80  92.542  -2.516   0.285
  633    HB3  MET  80           HB1      MET  80  93.061  -0.875   0.673
  634    HG2  MET  80           HG2      MET  80  92.672  -0.122  -1.565
  635    HG3  MET  80           HG1      MET  80  92.481  -1.772  -2.158
  636    HE1  MET  80           HE1      MET  80  90.237  -0.142  -3.186
  637    HE2  MET  80           HE2      MET  80  90.778   1.096  -2.057
  638    HE3  MET  80           HE3      MET  80  89.098   0.575  -2.037
  639    H    ILE  81           H        ILE  81  96.084  -2.036  -2.446
  640    HA   ILE  81           HA       ILE  81  96.190   0.905  -2.702
  641    HB   ILE  81           HB       ILE  81  98.565  -0.973  -2.828
  642   HG12  ILE  81          HG12      ILE  81  99.190   0.756  -0.879
  643   HG13  ILE  81          HG13      ILE  81  97.438   0.844  -0.723
  644   HG21  ILE  81          HG21      ILE  81  98.924   0.792  -4.389
  645   HG22  ILE  81          HG22      ILE  81  99.784   1.278  -2.928
  646   HG23  ILE  81          HG23      ILE  81  98.218   1.992  -3.308
  647   HD11  ILE  81          HD11      ILE  81  97.805  -0.951   0.668
  648   HD12  ILE  81          HD12      ILE  81  99.280  -1.430  -0.166
  649   HD13  ILE  81          HD13      ILE  81  97.709  -1.836  -0.851
  650    H    PHE  82           H        PHE  82  94.671   0.567  -4.443
  651    HA   PHE  82           HA       PHE  82  95.872  -0.640  -6.868
  652    HB2  PHE  82           HB2      PHE  82  93.791  -1.728  -6.192
  653    HB3  PHE  82           HB1      PHE  82  92.961  -0.173  -6.171
  654    HD1  PHE  82           HD2      PHE  82  95.115  -2.215  -8.475
  655    HD2  PHE  82           HD1      PHE  82  91.751   0.429  -8.077
  656    HE1  PHE  82           HE2      PHE  82  94.653  -2.436 -10.900
  657    HE2  PHE  82           HE1      PHE  82  91.291   0.206 -10.503
  658    HZ   PHE  82           HZ       PHE  82  92.741  -1.227 -11.915
  659    H    ALA  83           H        ALA  83  93.289   1.747  -6.313
  660    HA   ALA  83           HA       ALA  83  94.739   3.970  -7.320
  661    HB1  ALA  83           HB1      ALA  83  94.552   2.707  -9.437
  662    HB2  ALA  83           HB2      ALA  83  93.647   4.219  -9.495
  663    HB3  ALA  83           HB3      ALA  83  92.798   2.692  -9.260
  664    H    GLY  84           H        GLY  84  93.818   5.499  -6.118
  665    HA2  GLY  84           HA2      GLY  84  91.196   5.336  -5.048
  666    HA3  GLY  84           HA3      GLY  84  92.228   6.764  -5.033
  667    H    ILE  85           H        ILE  85  89.687   7.345  -5.350
  668    HA   ILE  85           HA       ILE  85  88.954   7.396  -8.175
  669    HB   ILE  85           HB       ILE  85  87.592   8.449  -5.689
  670   HG12  ILE  85          HG12      ILE  85  87.798   5.883  -6.350
  671   HG13  ILE  85          HG13      ILE  85  86.270   6.533  -5.762
  672   HG21  ILE  85          HG21      ILE  85  85.620   8.630  -7.348
  673   HG22  ILE  85          HG22      ILE  85  86.851   8.601  -8.609
  674   HG23  ILE  85          HG23      ILE  85  86.851   9.892  -7.408
  675   HD11  ILE  85          HD11      ILE  85  85.331   6.624  -7.924
  676   HD12  ILE  85          HD12      ILE  85  86.204   5.092  -7.907
  677   HD13  ILE  85          HD13      ILE  85  86.905   6.497  -8.710
  678    H    LYS  86           H        LYS  86  88.406   9.445  -9.242
  679    HA   LYS  86           HA       LYS  86  90.359  11.522  -8.518
  680    HB2  LYS  86           HB2      LYS  86  90.438  10.556 -10.799
  681    HB3  LYS  86           HB3      LYS  86  88.804  11.153 -11.087
  682    HG2  LYS  86           HG2      LYS  86  89.476  13.358 -11.217
  683    HG3  LYS  86           HG3      LYS  86  90.814  13.129 -10.092
  684    HD2  LYS  86           HD2      LYS  86  92.032  11.848 -11.853
  685    HD3  LYS  86           HD3      LYS  86  90.717  12.200 -12.977
  686    HE2  LYS  86           HE2      LYS  86  91.185  14.515 -12.984
  687    HE3  LYS  86           HE3      LYS  86  92.147  14.415 -11.509
  688    HZ1  LYS  86           HZ1      LYS  86  93.019  12.840 -13.810
  689    HZ2  LYS  86           HZ2      LYS  86  93.941  13.618 -12.614
  690    HZ3  LYS  86           HZ3      LYS  86  93.253  14.517 -13.881
  691    H    LYS  87           H        LYS  87  87.162  11.658 -10.119
  692    HA   LYS  87           HA       LYS  87  86.666  14.251  -8.924
  693    HB2  LYS  87           HB2      LYS  87  85.065  12.508 -10.800
  694    HB3  LYS  87           HB3      LYS  87  84.507  14.077 -10.217
  695    HG2  LYS  87           HG2      LYS  87  86.634  15.086 -11.099
  696    HG3  LYS  87           HG3      LYS  87  87.023  13.523 -11.817
  697    HD2  LYS  87           HD2      LYS  87  84.994  13.596 -13.170
  698    HD3  LYS  87           HD3      LYS  87  84.497  15.100 -12.394
  699    HE2  LYS  87           HE2      LYS  87  87.110  14.825 -13.894
  700    HE3  LYS  87           HE3      LYS  87  85.619  15.360 -14.669
  701    HZ1  LYS  87           HZ1      LYS  87  85.534  17.265 -13.374
  702    HZ2  LYS  87           HZ2      LYS  87  87.190  17.120 -13.723
  703    HZ3  LYS  87           HZ3      LYS  87  86.597  16.654 -12.202
  704    H    LYS  88           H        LYS  88  84.600  14.743  -7.851
  705    HA   LYS  88           HA       LYS  88  84.199  13.037  -5.601
  706    HB2  LYS  88           HB2      LYS  88  83.913  15.563  -5.663
  707    HB3  LYS  88           HB3      LYS  88  82.377  15.277  -6.482
  708    HG2  LYS  88           HG2      LYS  88  81.864  13.665  -4.506
  709    HG3  LYS  88           HG3      LYS  88  83.187  14.492  -3.684
  710    HD2  LYS  88           HD2      LYS  88  81.386  15.804  -3.017
  711    HD3  LYS  88           HD3      LYS  88  81.902  16.672  -4.461
  712    HE2  LYS  88           HE2      LYS  88  80.229  14.999  -5.667
  713    HE3  LYS  88           HE3      LYS  88  79.506  14.917  -4.061
  714    HZ1  LYS  88           HZ1      LYS  88  79.044  17.175  -4.065
  715    HZ2  LYS  88           HZ2      LYS  88  78.689  16.711  -5.660
  716    HZ3  LYS  88           HZ3      LYS  88  80.145  17.512  -5.310
  717    H    THR  89           H        THR  89  82.032  13.960  -8.300
  718    HA   THR  89           HA       THR  89  79.857  12.382  -7.665
  719    HB   THR  89           HB       THR  89  79.394  12.293 -10.108
  720    HG1  THR  89           HG1      THR  89  82.062  13.055 -10.119
  721   HG21  THR  89          HG21      THR  89  78.786  14.266  -8.743
  722   HG22  THR  89          HG22      THR  89  79.210  14.726 -10.393
  723   HG23  THR  89          HG23      THR  89  80.365  14.975  -9.084
  724    H    GLU  90           H        GLU  90  82.966  11.421  -8.909
  725    HA   GLU  90           HA       GLU  90  82.205   8.819  -9.797
  726    HB2  GLU  90           HB2      GLU  90  84.842  10.048  -8.995
  727    HB3  GLU  90           HB3      GLU  90  84.706   8.351  -9.449
  728    HG2  GLU  90           HG2      GLU  90  83.858   8.937 -11.633
  729    HG3  GLU  90           HG3      GLU  90  83.751  10.638 -11.185
  730    H    ARG  91           H        ARG  91  83.251  10.219  -6.753
  731    HA   ARG  91           HA       ARG  91  83.406   7.701  -5.356
  732    HB2  ARG  91           HB2      ARG  91  83.346  10.575  -4.397
  733    HB3  ARG  91           HB3      ARG  91  83.553   9.186  -3.333
  734    HG2  ARG  91           HG2      ARG  91  85.532   8.505  -4.730
  735    HG3  ARG  91           HG3      ARG  91  85.373  10.034  -5.595
  736    HD2  ARG  91           HD2      ARG  91  85.537  10.032  -2.593
  737    HD3  ARG  91           HD3      ARG  91  87.004   9.882  -3.551
  738    HE   ARG  91           HE       ARG  91  85.503  12.266  -3.150
  739   HH11  ARG  91          HH21      ARG  91  87.287  10.471  -5.512
  740   HH12  ARG  91          HH22      ARG  91  87.739  11.867  -6.432
  741   HH21  ARG  91          HH11      ARG  91  86.098  14.099  -4.349
  742   HH22  ARG  91          HH12      ARG  91  87.067  13.920  -5.773
  743    H    GLU  92           H        GLU  92  81.146  10.465  -5.355
  744    HA   GLU  92           HA       GLU  92  79.282   9.409  -3.550
  745    HB2  GLU  92           HB2      GLU  92  79.362  11.773  -4.472
  746    HB3  GLU  92           HB3      GLU  92  78.594  11.143  -5.929
  747    HG2  GLU  92           HG2      GLU  92  76.797  10.172  -4.395
  748    HG3  GLU  92           HG3      GLU  92  77.493  11.161  -3.113
  749    H    ASP  93           H        ASP  93  79.248   9.318  -7.127
  750    HA   ASP  93           HA       ASP  93  76.969   7.705  -7.404
  751    HB2  ASP  93           HB2      ASP  93  79.414   7.871  -9.183
  752    HB3  ASP  93           HB1      ASP  93  77.868   7.158  -9.642
  753    H    LEU  94           H        LEU  94  80.408   6.822  -7.211
  754    HA   LEU  94           HA       LEU  94  80.106   4.039  -7.458
  755    HB2  LEU  94           HB2      LEU  94  82.302   5.103  -7.598
  756    HB3  LEU  94           HB3      LEU  94  82.171   5.623  -5.920
  757    HG   LEU  94           HG       LEU  94  82.133   3.308  -5.159
  758   HD11  LEU  94          HD11      LEU  94  81.990   2.797  -8.115
  759   HD12  LEU  94          HD12      LEU  94  81.061   2.059  -6.809
  760   HD13  LEU  94          HD13      LEU  94  82.743   1.596  -7.064
  761   HD21  LEU  94          HD21      LEU  94  84.409   2.799  -5.554
  762   HD22  LEU  94          HD22      LEU  94  84.320   4.550  -5.721
  763   HD23  LEU  94          HD23      LEU  94  84.384   3.529  -7.158
  764    H    ILE  95           H        ILE  95  79.867   6.194  -4.697
  765    HA   ILE  95           HA       ILE  95  79.668   4.072  -2.792
  766    HB   ILE  95           HB       ILE  95  79.339   7.049  -2.667
  767   HG12  ILE  95          HG12      ILE  95  81.099   5.427  -0.876
  768   HG13  ILE  95          HG13      ILE  95  81.534   5.481  -2.578
  769   HG21  ILE  95          HG21      ILE  95  77.704   6.529  -1.089
  770   HG22  ILE  95          HG22      ILE  95  79.151   6.487  -0.084
  771   HG23  ILE  95          HG23      ILE  95  78.447   4.983  -0.679
  772   HD11  ILE  95          HD11      ILE  95  82.321   7.345  -0.769
  773   HD12  ILE  95          HD12      ILE  95  80.847   8.096  -1.370
  774   HD13  ILE  95          HD13      ILE  95  82.139   7.671  -2.488
  775    H    ALA  96           H        ALA  96  77.461   5.874  -4.767
  776    HA   ALA  96           HA       ALA  96  75.079   5.336  -3.317
  777    HB1  ALA  96           HB1      ALA  96  75.330   5.679  -6.310
  778    HB2  ALA  96           HB2      ALA  96  75.357   7.030  -5.178
  779    HB3  ALA  96           HB3      ALA  96  73.921   6.014  -5.304
  780    H    TYR  97           H        TYR  97  76.940   3.580  -5.729
  781    HA   TYR  97           HA       TYR  97  74.981   1.480  -6.031
  782    HB2  TYR  97           HB2      TYR  97  76.390   1.867  -7.923
  783    HB3  TYR  97           HB3      TYR  97  77.850   1.774  -6.937
  784    HD1  TYR  97           HD1      TYR  97  74.993  -0.206  -8.268
  785    HD2  TYR  97           HD2      TYR  97  78.852  -0.326  -6.389
  786    HE1  TYR  97           HE1      TYR  97  75.093  -2.653  -8.634
  787    HE2  TYR  97           HE2      TYR  97  78.952  -2.776  -6.756
  788    HH   TYR  97           HH       TYR  97  76.275  -4.621  -7.583
  789    H    LEU  98           H        LEU  98  78.041   1.940  -4.291
  790    HA   LEU  98           HA       LEU  98  78.330  -0.666  -3.299
  791    HB2  LEU  98           HB2      LEU  98  79.224   2.028  -2.304
  792    HB3  LEU  98           HB3      LEU  98  79.547   0.573  -1.367
  793    HG   LEU  98           HG       LEU  98  80.256   0.717  -4.298
  794   HD11  LEU  98          HD11      LEU  98  82.492   1.455  -3.709
  795   HD12  LEU  98          HD12      LEU  98  82.067   1.493  -1.998
  796   HD13  LEU  98          HD13      LEU  98  81.329   2.637  -3.117
  797   HD21  LEU  98          HD21      LEU  98  80.325  -1.324  -2.403
  798   HD22  LEU  98          HD22      LEU  98  81.986  -0.737  -2.429
  799   HD23  LEU  98          HD23      LEU  98  81.226  -1.292  -3.917
  800    H    LYS  99           H        LYS  99  76.185   1.917  -2.407
  801    HA   LYS  99           HA       LYS  99  75.502   0.854   0.186
  802    HB2  LYS  99           HB2      LYS  99  74.438   3.049  -1.567
  803    HB3  LYS  99           HB3      LYS  99  73.503   2.506  -0.173
  804    HG2  LYS  99           HG2      LYS  99  75.590   2.857   1.230
  805    HG3  LYS  99           HG3      LYS  99  76.312   3.643  -0.173
  806    HD2  LYS  99           HD2      LYS  99  73.670   4.492   1.045
  807    HD3  LYS  99           HD3      LYS  99  75.218   5.227   1.465
  808    HE2  LYS  99           HE2      LYS  99  75.530   5.636  -1.049
  809    HE3  LYS  99           HE3      LYS  99  73.820   5.237  -1.215
  810    HZ1  LYS  99           HZ1      LYS  99  74.077   7.597  -0.963
  811    HZ2  LYS  99           HZ2      LYS  99  74.975   7.396   0.465
  812    HZ3  LYS  99           HZ3      LYS  99  73.330   6.975   0.427
  813    H    LYS 100           H        LYS 100  73.772   1.093  -2.928
  814    HA   LYS 100           HA       LYS 100  71.627  -0.595  -2.062
  815    HB2  LYS 100           HB2      LYS 100  72.448   0.175  -4.872
  816    HB3  LYS 100           HB3      LYS 100  70.888  -0.489  -4.384
  817    HG2  LYS 100           HG2      LYS 100  70.711   1.513  -2.786
  818    HG3  LYS 100           HG3      LYS 100  72.069   2.201  -3.675
  819    HD2  LYS 100           HD2      LYS 100  70.301   3.098  -4.881
  820    HD3  LYS 100           HD3      LYS 100  70.565   1.607  -5.784
  821    HE2  LYS 100           HE2      LYS 100  68.240   1.604  -5.407
  822    HE3  LYS 100           HE3      LYS 100  68.856   0.558  -4.127
  823    HZ1  LYS 100           HZ1      LYS 100  67.381   2.905  -3.858
  824    HZ2  LYS 100           HZ2      LYS 100  68.935   3.227  -3.252
  825    HZ3  LYS 100           HZ3      LYS 100  68.028   1.935  -2.627
  826    H    ALA 101           H        ALA 101  74.784  -1.176  -3.231
  827    HA   ALA 101           HA       ALA 101  74.195  -3.823  -4.289
  828    HB1  ALA 101           HB1      ALA 101  76.808  -2.360  -3.853
  829    HB2  ALA 101           HB2      ALA 101  75.936  -2.521  -5.378
  830    HB3  ALA 101           HB3      ALA 101  76.656  -3.941  -4.619
  831    H    THR 102           H        THR 102  75.368  -2.339  -1.358
  832    HA   THR 102           HA       THR 102  76.136  -4.930  -0.217
  833    HB   THR 102           HB       THR 102  76.842  -3.521   1.732
  834    HG1  THR 102           HG1      THR 102  75.633  -1.625   0.110
  835   HG21  THR 102          HG21      THR 102  78.462  -4.131   0.050
  836   HG22  THR 102          HG22      THR 102  78.731  -2.441   0.478
  837   HG23  THR 102          HG23      THR 102  77.899  -2.852  -1.023
  838    H    ASN 103           H        ASN 103  73.360  -3.321  -0.679
  839    HA   ASN 103           HA       ASN 103  72.198  -3.901   1.963
  840    HB2  ASN 103           HB2      ASN 103  71.301  -2.281  -0.412
  841    HB3  ASN 103           HB1      ASN 103  70.191  -2.717   0.881
  842   HD21  ASN 103          HD21      ASN 103  73.568  -2.181   1.649
  843   HD22  ASN 103          HD22      ASN 103  73.343  -0.697   2.440
  844    H    GLU 104           H        GLU 104  72.356  -5.036  -1.282
  845    HA   GLU 104           HA       GLU 104  70.777  -7.371  -0.599
  846    HB2  GLU 104           HB2      GLU 104  69.152  -7.132  -2.384
  847    HB3  GLU 104           HB3      GLU 104  69.057  -5.721  -1.331
  848    HG2  GLU 104           HG2      GLU 104  70.617  -4.538  -2.926
  849    HG3  GLU 104           HG3      GLU 104  70.436  -5.907  -4.020
  850    HHA  HEC 201           HA       HEC 105  89.400  -3.498   3.161
  851    HHB  HEC 201           HB       HEC 105  85.569   0.017  -0.438
  852    HHC  HEC 201           HC       HEC 105  88.819  -1.740  -5.577
  853    HHD  HEC 201           HD       HEC 105  92.217  -5.734  -2.039
  854   HMA1  HEC 201          HMA1      HEC 105  85.199  -0.437   3.286
  855   HMA2  HEC 201          HMA2      HEC 105  84.631  -0.276   1.627
  856   HMA3  HEC 201          HMA3      HEC 105  85.795   0.880   2.276
  857   HAA1  HEC 201          HAA1      HEC 105  87.107  -0.846   4.461
  858   HAA2  HEC 201          HAA2      HEC 105  88.475  -1.937   4.409
  859   HBA1  HEC 201          HBA1      HEC 105  87.182  -3.806   4.764
  860   HBA2  HEC 201          HBA2      HEC 105  85.766  -3.113   3.979
  861   HMB1  HEC 201          HMB1      HEC 105  84.133   0.172  -2.722
  862   HMB2  HEC 201          HMB2      HEC 105  84.837   1.215  -3.953
  863   HMB3  HEC 201          HMB3      HEC 105  85.145   1.534  -2.249
  864    HAB  HEC 201           HAB      HEC 105  87.274  -0.583  -6.226
  865   HBB1  HEC 201          HBB1      HEC 105  87.881   1.642  -6.065
  866   HBB2  HEC 201          HBB2      HEC 105  86.193   1.822  -6.536
  867   HBB3  HEC 201          HBB3      HEC 105  86.661   2.002  -4.846
  868   HMC1  HEC 201          HMC1      HEC 105  89.785  -3.324  -6.931
  869   HMC2  HEC 201          HMC2      HEC 105  91.280  -4.249  -6.949
  870   HMC3  HEC 201          HMC3      HEC 105  91.324  -2.508  -6.682
  871    HAC  HEC 201           HAC      HEC 105  92.678  -6.130  -3.962
  872   HBC1  HEC 201          HBC1      HEC 105  93.497  -3.905  -5.473
  873   HBC2  HEC 201          HBC2      HEC 105  93.338  -5.213  -6.644
  874   HBC3  HEC 201          HBC3      HEC 105  94.393  -5.405  -5.246
  875   HMD1  HEC 201          HMD1      HEC 105  93.448  -6.285  -0.276
  876   HMD2  HEC 201          HMD2      HEC 105  92.311  -7.482   0.344
  877   HMD3  HEC 201          HMD3      HEC 105  93.300  -6.539   1.459
  878   HAD1  HEC 201          HAD1      HEC 105  91.966  -6.267   3.131
  879   HAD2  HEC 201          HAD2      HEC 105  90.470  -5.514   3.642
  880   HBD1  HEC 201          HBD1      HEC 105  91.628  -3.347   3.848
  881   HBD2  HEC 201          HBD2      HEC 105  93.134  -4.111   3.352
  882    H1   HOH 301           H2       HOH 200  81.609   3.531  -0.671
  883    H2   HOH 301           H1       HOH 200  80.103   3.711  -0.670
  884    H1   HOH 302           H2       HOH 201  85.249   5.244   6.923
  885    H2   HOH 302           H1       HOH 201  85.943   4.809   5.649
  886    H1   HOH 303           H2       HOH 202  81.817  -6.286   4.785
  887    H2   HOH 303           H1       HOH 202  81.597  -6.096   6.271
  888    H1   HOH 304           H2       HOH 203  83.734  -9.806  -0.495
  889    H2   HOH 304           H1       HOH 203  82.683 -10.889  -0.367
  Start of MODEL    7
    1    H1   GLY   1           H1       GLY   1  76.210   9.484  -6.509
    2    H2   GLY   1           H2       GLY   1  75.145   8.178  -6.732
    3    H3   GLY   1           H3       GLY   1  75.033   9.140  -5.336
    4    HA2  GLY   1           HA2      GLY   1  73.495  10.334  -6.369
    5    HA3  GLY   1           HA3      GLY   1  74.799  10.927  -7.399
    6    H    ASP   2           H        ASP   2  75.255   8.092  -8.350
    7    HA   ASP   2           HA       ASP   2  72.835   7.599  -9.936
    8    HB2  ASP   2           HB2      ASP   2  75.546   8.254 -11.092
    9    HB3  ASP   2           HB1      ASP   2  74.268   7.455 -12.006
   10    H    VAL   3           H        VAL   3  72.713   5.698  -8.663
   11    HA   VAL   3           HA       VAL   3  74.617   3.783  -8.196
   12    HB   VAL   3           HB       VAL   3  72.390   3.553  -7.295
   13   HG11  VAL   3          HG11      VAL   3  71.499   3.146 -10.167
   14   HG12  VAL   3          HG12      VAL   3  71.187   4.585  -9.195
   15   HG13  VAL   3          HG13      VAL   3  70.464   3.042  -8.742
   16   HG21  VAL   3          HG21      VAL   3  72.696   1.293  -9.281
   17   HG22  VAL   3          HG22      VAL   3  72.052   1.220  -7.640
   18   HG23  VAL   3          HG23      VAL   3  73.776   1.478  -7.900
   19    H    GLU   4           H        GLU   4  73.338   4.777 -11.225
   20    HA   GLU   4           HA       GLU   4  73.844   2.355 -12.673
   21    HB2  GLU   4           HB2      GLU   4  73.656   5.176 -13.752
   22    HB3  GLU   4           HB3      GLU   4  73.454   3.679 -14.661
   23    HG2  GLU   4           HG2      GLU   4  71.233   4.207 -14.242
   24    HG3  GLU   4           HG3      GLU   4  71.586   3.198 -12.840
   25    H    LYS   5           H        LYS   5  75.527   5.511 -12.687
   26    HA   LYS   5           HA       LYS   5  77.808   4.443 -14.054
   27    HB2  LYS   5           HB2      LYS   5  77.244   7.048 -12.639
   28    HB3  LYS   5           HB3      LYS   5  78.844   6.676 -13.281
   29    HG2  LYS   5           HG2      LYS   5  78.009   6.479 -15.514
   30    HG3  LYS   5           HG3      LYS   5  76.335   6.487 -14.960
   31    HD2  LYS   5           HD2      LYS   5  78.083   8.838 -14.299
   32    HD3  LYS   5           HD3      LYS   5  77.435   8.695 -15.932
   33    HE2  LYS   5           HE2      LYS   5  75.144   8.478 -14.974
   34    HE3  LYS   5           HE3      LYS   5  75.820   8.722 -13.364
   35    HZ1  LYS   5           HZ1      LYS   5  75.605  10.883 -13.728
   36    HZ2  LYS   5           HZ2      LYS   5  75.197  10.644 -15.360
   37    HZ3  LYS   5           HZ3      LYS   5  76.827  10.766 -14.898
   38    H    GLY   6           H        GLY   6  76.759   4.528 -10.796
   39    HA2  GLY   6           HA2      GLY   6  79.331   4.346  -9.539
   40    HA3  GLY   6           HA3      GLY   6  77.780   3.928  -8.806
   41    H    LYS   7           H        LYS   7  76.982   2.129 -10.886
   42    HA   LYS   7           HA       LYS   7  78.156  -0.284  -9.932
   43    HB2  LYS   7           HB2      LYS   7  75.799  -0.016 -10.814
   44    HB3  LYS   7           HB3      LYS   7  76.495   0.078 -12.431
   45    HG2  LYS   7           HG2      LYS   7  77.733  -2.164 -11.554
   46    HG3  LYS   7           HG3      LYS   7  76.254  -2.263 -10.604
   47    HD2  LYS   7           HD2      LYS   7  75.857  -3.438 -12.672
   48    HD3  LYS   7           HD3      LYS   7  74.950  -1.929 -12.739
   49    HE2  LYS   7           HE2      LYS   7  76.263  -1.060 -14.409
   50    HE3  LYS   7           HE3      LYS   7  77.731  -1.820 -13.796
   51    HZ1  LYS   7           HZ1      LYS   7  76.424  -3.972 -14.526
   52    HZ2  LYS   7           HZ2      LYS   7  77.386  -3.093 -15.617
   53    HZ3  LYS   7           HZ3      LYS   7  75.701  -2.882 -15.604
   54    H    LYS   8           H        LYS   8  78.441   1.589 -12.947
   55    HA   LYS   8           HA       LYS   8  80.104  -0.195 -14.344
   56    HB2  LYS   8           HB2      LYS   8  79.046   1.695 -15.447
   57    HB3  LYS   8           HB3      LYS   8  79.972   2.827 -14.463
   58    HG2  LYS   8           HG2      LYS   8  81.611   0.822 -15.903
   59    HG3  LYS   8           HG3      LYS   8  80.749   1.948 -16.948
   60    HD2  LYS   8           HD2      LYS   8  82.280   2.987 -14.571
   61    HD3  LYS   8           HD3      LYS   8  83.130   2.596 -16.065
   62    HE2  LYS   8           HE2      LYS   8  81.553   4.087 -17.304
   63    HE3  LYS   8           HE3      LYS   8  80.826   4.544 -15.764
   64    HZ1  LYS   8           HZ1      LYS   8  83.034   5.295 -15.034
   65    HZ2  LYS   8           HZ2      LYS   8  82.468   6.158 -16.383
   66    HZ3  LYS   8           HZ3      LYS   8  83.652   4.954 -16.576
   67    H    ILE   9           H        ILE   9  80.922   2.513 -12.195
   68    HA   ILE   9           HA       ILE   9  83.736   2.235 -12.431
   69    HB   ILE   9           HB       ILE   9  82.076   3.473 -10.228
   70   HG12  ILE   9          HG12      ILE   9  83.510   4.853 -12.507
   71   HG13  ILE   9          HG13      ILE   9  81.830   4.334 -12.639
   72   HG21  ILE   9          HG21      ILE   9  84.203   4.779  -9.845
   73   HG22  ILE   9          HG22      ILE   9  85.015   3.656 -10.937
   74   HG23  ILE   9          HG23      ILE   9  84.317   3.069  -9.428
   75   HD11  ILE   9          HD11      ILE   9  82.890   6.144 -10.449
   76   HD12  ILE   9          HD12      ILE   9  81.203   5.706 -10.728
   77   HD13  ILE   9          HD13      ILE   9  82.059   6.714 -11.897
   78    H    PHE  10           H        PHE  10  81.347   0.556 -10.588
   79    HA   PHE  10           HA       PHE  10  83.199  -0.432  -8.595
   80    HB2  PHE  10           HB2      PHE  10  81.053  -0.312  -7.722
   81    HB3  PHE  10           HB1      PHE  10  80.301  -0.860  -9.220
   82    HD1  PHE  10           HD1      PHE  10  80.284  -3.239  -9.831
   83    HD2  PHE  10           HD2      PHE  10  81.972  -1.898  -6.119
   84    HE1  PHE  10           HE1      PHE  10  80.294  -5.572  -8.997
   85    HE2  PHE  10           HE2      PHE  10  81.983  -4.234  -5.281
   86    HZ   PHE  10           HZ       PHE  10  81.145  -6.072  -6.725
   87    H    VAL  11           H        VAL  11  81.391  -1.931 -11.294
   88    HA   VAL  11           HA       VAL  11  82.416  -4.506 -11.065
   89    HB   VAL  11           HB       VAL  11  81.876  -4.758 -13.472
   90   HG11  VAL  11          HG11      VAL  11  80.154  -4.765 -11.581
   91   HG12  VAL  11          HG12      VAL  11  79.530  -4.452 -13.201
   92   HG13  VAL  11          HG13      VAL  11  79.762  -3.119 -12.074
   93   HG21  VAL  11          HG21      VAL  11  82.634  -2.519 -14.196
   94   HG22  VAL  11          HG22      VAL  11  81.318  -1.786 -13.282
   95   HG23  VAL  11          HG23      VAL  11  80.960  -2.806 -14.672
   96    H    GLN  12           H        GLN  12  83.843  -1.646 -12.489
   97    HA   GLN  12           HA       GLN  12  86.056  -3.230 -13.583
   98    HB2  GLN  12           HB2      GLN  12  86.729  -1.228 -14.712
   99    HB3  GLN  12           HB1      GLN  12  84.986  -1.410 -14.909
  100    HG2  GLN  12           HG2      GLN  12  84.697   0.119 -12.909
  101    HG3  GLN  12           HG1      GLN  12  86.432   0.430 -12.989
  102   HE21  GLN  12          HE21      GLN  12  85.710  -0.080 -16.129
  103   HE22  GLN  12          HE22      GLN  12  85.315   1.495 -16.613
  104    H    LYS  13           H        LYS  13  85.391  -1.118 -10.870
  105    HA   LYS  13           HA       LYS  13  88.274  -0.904 -10.323
  106    HB2  LYS  13           HB2      LYS  13  86.652   1.095 -10.315
  107    HB3  LYS  13           HB3      LYS  13  86.138   0.489  -8.741
  108    HG2  LYS  13           HG2      LYS  13  88.362   0.695  -7.850
  109    HG3  LYS  13           HG3      LYS  13  89.039   1.014  -9.445
  110    HD2  LYS  13           HD2      LYS  13  86.884   2.838  -8.436
  111    HD3  LYS  13           HD3      LYS  13  88.506   3.013  -7.768
  112    HE2  LYS  13           HE2      LYS  13  89.418   3.239 -10.057
  113    HE3  LYS  13           HE3      LYS  13  87.788   3.089 -10.714
  114    HZ1  LYS  13           HZ1      LYS  13  88.770   5.420 -10.306
  115    HZ2  LYS  13           HZ2      LYS  13  88.377   5.131  -8.678
  116    HZ3  LYS  13           HZ3      LYS  13  87.160   5.118  -9.864
  117    H    CYS  14           H        CYS  14  85.391  -1.420  -8.220
  118    HA   CYS  14           HA       CYS  14  87.094  -2.662  -6.238
  119    HB2  CYS  14           HB2      CYS  14  84.115  -2.609  -6.042
  120    HB3  CYS  14           HB1      CYS  14  85.313  -2.478  -4.758
  121    H    ALA  15           H        ALA  15  84.623  -3.865  -8.478
  122    HA   ALA  15           HA       ALA  15  84.109  -6.338  -7.404
  123    HB1  ALA  15           HB1      ALA  15  82.930  -5.905  -9.356
  124    HB2  ALA  15           HB2      ALA  15  84.101  -7.102  -9.913
  125    HB3  ALA  15           HB3      ALA  15  84.369  -5.388 -10.232
  126    H    GLN  16           H        GLN  16  87.086  -5.224  -8.826
  127    HA   GLN  16           HA       GLN  16  88.372  -7.533  -9.563
  128    HB2  GLN  16           HB2      GLN  16  89.497  -5.164  -8.066
  129    HB3  GLN  16           HB1      GLN  16  90.481  -6.416  -8.820
  130    HG2  GLN  16           HG2      GLN  16  89.140  -5.893 -10.974
  131    HG3  GLN  16           HG1      GLN  16  88.653  -4.415 -10.146
  132   HE21  GLN  16          HE21      GLN  16  91.647  -6.259 -10.961
  133   HE22  GLN  16          HE22      GLN  16  92.608  -4.877 -11.178
  134    H    CYS  17           H        CYS  17  88.643  -6.131  -6.264
  135    HA   CYS  17           HA       CYS  17  89.032  -8.895  -5.261
  136    HB2  CYS  17           HB2      CYS  17  90.180  -6.699  -3.651
  137    HB3  CYS  17           HB1      CYS  17  90.854  -8.273  -4.054
  138    H    HIS  18           H        HSD  18  86.453  -8.022  -5.365
  139    HA   HIS  18           HA       HSD  18  85.783  -7.923  -2.535
  140    HB2  HIS  18           HB2      HSD  18  85.234  -5.629  -4.391
  141    HB3  HIS  18           HB1      HSD  18  84.107  -5.989  -3.087
  142    HD1  HIS  18           HD1      HSD  18  84.983  -5.731  -0.634
  143    HD2  HIS  18           HD2      HSD  18  87.721  -4.584  -3.554
  144    HE1  HIS  18           HE1      HSD  18  86.804  -4.437   0.562
  145    H    THR  19           H        THR  19  83.193  -7.603  -2.474
  146    HA   THR  19           HA       THR  19  81.949  -9.196  -4.608
  147    HB   THR  19           HB       THR  19  80.878 -10.131  -2.142
  148    HG1  THR  19           HG1      THR  19  83.185 -11.097  -1.688
  149   HG21  THR  19          HG21      THR  19  81.168 -11.306  -4.385
  150   HG22  THR  19          HG22      THR  19  81.556 -12.269  -2.960
  151   HG23  THR  19          HG23      THR  19  82.852 -11.565  -3.927
  152    H    VAL  20           H        VAL  20  81.559  -7.298  -1.656
  153    HA   VAL  20           HA       VAL  20  79.821  -6.031  -0.857
  154    HB   VAL  20           HB       VAL  20  79.146  -4.279  -2.343
  155   HG11  VAL  20          HG11      VAL  20  81.932  -5.184  -3.121
  156   HG12  VAL  20          HG12      VAL  20  81.538  -4.374  -1.607
  157   HG13  VAL  20          HG13      VAL  20  81.318  -3.532  -3.140
  158   HG21  VAL  20          HG21      VAL  20  79.302  -4.387  -4.704
  159   HG22  VAL  20          HG22      VAL  20  78.615  -5.942  -4.244
  160   HG23  VAL  20          HG23      VAL  20  80.324  -5.819  -4.653
  161    H    GLU  21           H        GLU  21  79.095  -8.776  -2.051
  162    HA   GLU  21           HA       GLU  21  76.239  -8.220  -2.582
  163    HB2  GLU  21           HB2      GLU  21  76.277 -10.698  -3.308
  164    HB3  GLU  21           HB3      GLU  21  77.040  -9.515  -4.369
  165    HG2  GLU  21           HG2      GLU  21  79.204 -10.163  -3.752
  166    HG3  GLU  21           HG3      GLU  21  78.662 -10.902  -2.249
  167    H    LYS  22           H        LYS  22  74.961  -8.417  -0.889
  168    HA   LYS  22           HA       LYS  22  75.607  -9.366   1.615
  169    HB2  LYS  22           HB2      LYS  22  73.595  -8.025   1.083
  170    HB3  LYS  22           HB3      LYS  22  72.865  -9.449   0.340
  171    HG2  LYS  22           HG2      LYS  22  72.636 -10.566   2.382
  172    HG3  LYS  22           HG3      LYS  22  73.905  -9.618   3.158
  173    HD2  LYS  22           HD2      LYS  22  72.510  -7.716   3.375
  174    HD3  LYS  22           HD3      LYS  22  71.333  -8.347   2.223
  175    HE2  LYS  22           HE2      LYS  22  71.949  -9.723   4.846
  176    HE3  LYS  22           HE3      LYS  22  70.666  -8.524   4.678
  177    HZ1  LYS  22           HZ1      LYS  22  70.843 -11.229   3.585
  178    HZ2  LYS  22           HZ2      LYS  22  70.056 -10.053   2.644
  179    HZ3  LYS  22           HZ3      LYS  22  69.503 -10.400   4.212
  180    H    GLY  23           H        GLY  23  75.978 -11.301   2.454
  181    HA2  GLY  23           HA2      GLY  23  75.977 -13.571   2.798
  182    HA3  GLY  23           HA3      GLY  23  74.489 -13.634   1.863
  183    H    GLY  24           H        GLY  24  77.407 -12.301   0.466
  184    HA2  GLY  24           HA2      GLY  24  77.371 -14.387  -1.570
  185    HA3  GLY  24           HA3      GLY  24  78.350 -12.929  -1.580
  186    H    LYS  25           H        LYS  25  80.408 -13.554  -1.723
  187    HA   LYS  25           HA       LYS  25  81.525 -15.202   0.406
  188    HB2  LYS  25           HB2      LYS  25  82.543 -16.820  -1.046
  189    HB3  LYS  25           HB3      LYS  25  80.823 -16.779  -1.432
  190    HG2  LYS  25           HG2      LYS  25  81.597 -14.940  -3.188
  191    HG3  LYS  25           HG3      LYS  25  83.151 -15.754  -3.023
  192    HD2  LYS  25           HD2      LYS  25  82.336 -17.141  -4.642
  193    HD3  LYS  25           HD3      LYS  25  81.479 -17.906  -3.306
  194    HE2  LYS  25           HE2      LYS  25  80.421 -15.787  -5.194
  195    HE3  LYS  25           HE3      LYS  25  79.854 -17.447  -5.023
  196    HZ1  LYS  25           HZ1      LYS  25  78.845 -16.994  -3.028
  197    HZ2  LYS  25           HZ2      LYS  25  78.601 -15.527  -3.850
  198    HZ3  LYS  25           HZ3      LYS  25  79.834 -15.659  -2.689
  199    H    HIS  26           H        HIS  26  83.128 -13.959   1.131
  200    HA   HIS  26           HA       HIS  26  84.334 -11.858  -0.282
  201    HB2  HIS  26           HB2      HIS  26  86.205 -12.269   1.538
  202    HB3  HIS  26           HB1      HIS  26  84.618 -11.659   2.007
  203    HD1  HIS  26           HD1      HIS  26  85.239 -15.258   1.056
  204    HD2  HIS  26           HD2      HIS  26  84.506 -13.003   4.484
  205    HE1  HIS  26           HE1      HIS  26  84.811 -16.914   2.925
  206    HE2  HIS  26           HE2      HIS  26  84.362 -15.553   5.021
  207    H    LYS  27           H        LYS  27  86.089 -11.698  -1.571
  208    HA   LYS  27           HA       LYS  27  87.821 -14.046  -1.953
  209    HB2  LYS  27           HB2      LYS  27  86.296 -12.608  -4.132
  210    HB3  LYS  27           HB3      LYS  27  87.675 -13.661  -4.446
  211    HG2  LYS  27           HG2      LYS  27  86.460 -15.482  -3.182
  212    HG3  LYS  27           HG3      LYS  27  85.049 -14.426  -3.148
  213    HD2  LYS  27           HD2      LYS  27  86.469 -15.261  -5.692
  214    HD3  LYS  27           HD3      LYS  27  85.040 -16.074  -5.053
  215    HE2  LYS  27           HE2      LYS  27  83.944 -13.729  -5.055
  216    HE3  LYS  27           HE3      LYS  27  85.278 -13.257  -6.108
  217    HZ1  LYS  27           HZ1      LYS  27  82.988 -14.908  -6.671
  218    HZ2  LYS  27           HZ2      LYS  27  84.457 -15.576  -7.204
  219    HZ3  LYS  27           HZ3      LYS  27  83.981 -14.032  -7.730
  220    H    THR  28           H        THR  28  89.906 -13.481  -2.041
  221    HA   THR  28           HA       THR  28  91.758 -12.110  -1.892
  222    HB   THR  28           HB       THR  28  90.552 -10.577  -4.184
  223    HG1  THR  28           HG1      THR  28  91.007 -12.267  -5.509
  224   HG21  THR  28          HG21      THR  28  92.774 -10.257  -4.847
  225   HG22  THR  28          HG22      THR  28  93.342 -11.670  -3.960
  226   HG23  THR  28          HG23      THR  28  92.905 -10.202  -3.089
  227    H    GLY  29           H        GLY  29  89.328 -11.290  -0.400
  228    HA2  GLY  29           HA2      GLY  29  90.152  -9.031   0.869
  229    HA3  GLY  29           HA3      GLY  29  89.227  -8.407  -0.493
  230    HA   PRO  30           HA       PRO  30  86.441  -9.932   3.074
  231    HB2  PRO  30           HB2      PRO  30  86.038  -7.628   4.473
  232    HB3  PRO  30           HB1      PRO  30  87.370  -8.745   4.828
  233    HG2  PRO  30           HG2      PRO  30  87.406  -6.187   3.297
  234    HG3  PRO  30           HG1      PRO  30  88.583  -6.823   4.460
  235    HD2  PRO  30           HD2      PRO  30  88.936  -6.971   1.739
  236    HD3  PRO  30           HD1      PRO  30  89.635  -8.141   2.882
  237    H    ASN  31           H        ASN  31  84.167  -9.226   3.449
  238    HA   ASN  31           HA       ASN  31  83.046  -8.087   1.008
  239    HB2  ASN  31           HB2      ASN  31  80.967  -8.956   1.748
  240    HB3  ASN  31           HB1      ASN  31  82.160 -10.168   2.211
  241   HD21  ASN  31          HD21      ASN  31  82.313 -10.689   4.425
  242   HD22  ASN  31          HD22      ASN  31  81.484  -9.859   5.651
  243    H    LEU  32           H        LEU  32  81.303  -6.446   1.175
  244    HA   LEU  32           HA       LEU  32  81.855  -4.505   3.345
  245    HB2  LEU  32           HB2      LEU  32  80.848  -3.825   0.577
  246    HB3  LEU  32           HB3      LEU  32  81.412  -2.712   1.817
  247    HG   LEU  32           HG       LEU  32  83.056  -4.682   0.209
  248   HD11  LEU  32          HD11      LEU  32  84.361  -2.486  -0.165
  249   HD12  LEU  32          HD12      LEU  32  82.948  -1.674   0.505
  250   HD13  LEU  32          HD13      LEU  32  82.799  -2.633  -0.965
  251   HD21  LEU  32          HD21      LEU  32  84.142  -4.927   2.247
  252   HD22  LEU  32          HD22      LEU  32  83.632  -3.350   2.834
  253   HD23  LEU  32          HD23      LEU  32  84.938  -3.473   1.663
  254    H    HIS  33           H        HIS  33  79.936  -6.591   3.592
  255    HA   HIS  33           HA       HIS  33  77.308  -5.724   2.937
  256    HB2  HIS  33           HB2      HIS  33  78.209  -7.575   5.160
  257    HB3  HIS  33           HB1      HIS  33  76.566  -7.431   4.534
  258    HD1  HIS  33           HD1      HIS  33  77.668 -10.167   4.253
  259    HD2  HIS  33           HD2      HIS  33  78.438  -7.233   1.392
  260    HE1  HIS  33           HE1      HIS  33  78.293 -11.389   2.125
  261    HE2  HIS  33           HE2      HIS  33  78.764  -9.615   0.371
  262    H    GLY  34           H        GLY  34  75.788  -4.597   4.140
  263    HA2  GLY  34           HA2      GLY  34  75.233  -2.752   5.465
  264    HA3  GLY  34           HA3      GLY  34  75.625  -3.906   6.739
  265    H    LEU  35           H        LEU  35  77.996  -2.762   4.475
  266    HA   LEU  35           HA       LEU  35  79.998  -2.142   6.214
  267    HB2  LEU  35           HB2      LEU  35  80.327  -2.204   3.812
  268    HB3  LEU  35           HB3      LEU  35  79.295  -0.793   3.600
  269    HG   LEU  35           HG       LEU  35  81.045   0.309   5.284
  270   HD11  LEU  35          HD11      LEU  35  82.857  -1.579   3.806
  271   HD12  LEU  35          HD12      LEU  35  82.210  -2.019   5.385
  272   HD13  LEU  35          HD13      LEU  35  83.217  -0.582   5.210
  273   HD21  LEU  35          HD21      LEU  35  81.763  -0.174   2.382
  274   HD22  LEU  35          HD22      LEU  35  82.220   1.212   3.372
  275   HD23  LEU  35          HD23      LEU  35  80.535   0.975   2.911
  276    H    PHE  36           H        PHE  36  77.774   0.261   4.824
  277    HA   PHE  36           HA       PHE  36  78.647   2.455   6.295
  278    HB2  PHE  36           HB2      PHE  36  75.794   2.000   5.404
  279    HB3  PHE  36           HB1      PHE  36  76.618   3.543   5.632
  280    HD1  PHE  36           HD2      PHE  36  76.558   0.445   3.560
  281    HD2  PHE  36           HD1      PHE  36  77.998   4.481   3.911
  282    HE1  PHE  36           HE2      PHE  36  77.375   0.361   1.223
  283    HE2  PHE  36           HE1      PHE  36  78.805   4.395   1.577
  284    HZ   PHE  36           HZ       PHE  36  78.496   2.336   0.228
  285    H    GLY  37           H        GLY  37  79.005   1.943   8.472
  286    HA2  GLY  37           HA2      GLY  37  77.490   2.681  10.452
  287    HA3  GLY  37           HA3      GLY  37  76.651   1.187  10.077
  288    H    ARG  38           H        ARG  38  79.219  -0.197   9.388
  289    HA   ARG  38           HA       ARG  38  79.881  -0.960  12.127
  290    HB2  ARG  38           HB2      ARG  38  80.144  -2.166   9.448
  291    HB3  ARG  38           HB3      ARG  38  81.481  -2.510  10.543
  292    HG2  ARG  38           HG2      ARG  38  79.737  -3.179  12.276
  293    HG3  ARG  38           HG3      ARG  38  78.544  -3.096  10.980
  294    HD2  ARG  38           HD2      ARG  38  81.059  -4.711  10.620
  295    HD3  ARG  38           HD3      ARG  38  79.693  -5.387  11.500
  296    HE   ARG  38           HE       ARG  38  78.470  -4.582   9.272
  297   HH11  ARG  38          HH21      ARG  38  81.510  -6.203   9.723
  298   HH12  ARG  38          HH22      ARG  38  81.443  -7.024   8.199
  299   HH21  ARG  38          HH11      ARG  38  78.386  -5.676   7.292
  300   HH22  ARG  38          HH12      ARG  38  79.679  -6.735   6.833
  301    H    LYS  39           H        LYS  39  81.913  -0.899  13.062
  302    HA   LYS  39           HA       LYS  39  83.569   1.304  12.356
  303    HB2  LYS  39           HB2      LYS  39  83.550  -0.789  14.455
  304    HB3  LYS  39           HB3      LYS  39  85.114  -0.061  14.102
  305    HG2  LYS  39           HG2      LYS  39  82.703   1.698  14.499
  306    HG3  LYS  39           HG3      LYS  39  83.553   1.049  15.899
  307    HD2  LYS  39           HD2      LYS  39  85.690   1.992  14.958
  308    HD3  LYS  39           HD3      LYS  39  84.734   2.771  13.699
  309    HE2  LYS  39           HE2      LYS  39  84.844   4.476  15.277
  310    HE3  LYS  39           HE3      LYS  39  83.342   3.685  15.756
  311    HZ1  LYS  39           HZ1      LYS  39  84.759   2.302  17.284
  312    HZ2  LYS  39           HZ2      LYS  39  84.602   3.940  17.705
  313    HZ3  LYS  39           HZ3      LYS  39  86.027   3.382  16.967
  314    H    THR  40           H        THR  40  86.011   1.025  12.132
  315    HA   THR  40           HA       THR  40  86.552  -0.399   9.749
  316    HB   THR  40           HB       THR  40  88.978   0.191  10.345
  317    HG1  THR  40           HG1      THR  40  87.757   1.852  12.252
  318   HG21  THR  40          HG21      THR  40  87.947   1.634   8.817
  319   HG22  THR  40          HG22      THR  40  88.371   2.727  10.133
  320   HG23  THR  40          HG23      THR  40  86.716   2.138   9.975
  321    H    GLY  41           H        GLY  41  87.746  -2.229   9.337
  322    HA2  GLY  41           HA2      GLY  41  88.346  -4.419   9.688
  323    HA3  GLY  41           HA3      GLY  41  89.236  -3.776  11.068
  324    H    GLN  42           H        GLN  42  85.770  -4.143  10.338
  325    HA   GLN  42           HA       GLN  42  85.409  -5.375  12.999
  326    HB2  GLN  42           HB2      GLN  42  83.712  -3.700  11.223
  327    HB3  GLN  42           HB1      GLN  42  82.882  -4.946  12.151
  328    HG2  GLN  42           HG2      GLN  42  84.805  -2.958  13.381
  329    HG3  GLN  42           HG1      GLN  42  83.061  -2.710  13.314
  330   HE21  GLN  42          HE21      GLN  42  81.925  -5.057  14.028
  331   HE22  GLN  42          HE22      GLN  42  82.492  -5.603  15.533
  332    H    ALA  43           H        ALA  43  85.373  -6.042   9.632
  333    HA   ALA  43           HA       ALA  43  83.660  -8.360   9.812
  334    HB1  ALA  43           HB1      ALA  43  85.161  -6.931   7.691
  335    HB2  ALA  43           HB2      ALA  43  83.515  -7.561   7.678
  336    HB3  ALA  43           HB3      ALA  43  84.878  -8.653   7.427
  337    HA   PRO  44           HA       PRO  44  87.173 -10.831  11.173
  338    HB2  PRO  44           HB2      PRO  44  85.837 -13.134  11.664
  339    HB3  PRO  44           HB1      PRO  44  85.691 -11.717  12.723
  340    HG2  PRO  44           HG2      PRO  44  83.831 -12.694  10.607
  341    HG3  PRO  44           HG1      PRO  44  83.467 -12.040  12.214
  342    HD2  PRO  44           HD2      PRO  44  83.299 -10.567   9.885
  343    HD3  PRO  44           HD1      PRO  44  83.577  -9.854  11.490
  344    H    GLY  45           H        GLY  45  85.183 -11.330   8.429
  345    HA2  GLY  45           HA2      GLY  45  85.870 -13.714   7.312
  346    HA3  GLY  45           HA3      GLY  45  85.700 -12.241   6.365
  347    H    PHE  46           H        PHE  46  87.621 -10.869   6.131
  348    HA   PHE  46           HA       PHE  46  89.989 -12.503   5.683
  349    HB2  PHE  46           HB2      PHE  46  89.055 -10.786   4.040
  350    HB3  PHE  46           HB1      PHE  46  89.690  -9.553   5.129
  351    HD1  PHE  46           HD1      PHE  46  90.556 -12.280   2.811
  352    HD2  PHE  46           HD2      PHE  46  92.093  -9.257   5.446
  353    HE1  PHE  46           HE1      PHE  46  92.816 -12.574   1.831
  354    HE2  PHE  46           HE2      PHE  46  94.352  -9.551   4.467
  355    HZ   PHE  46           HZ       PHE  46  94.713 -11.210   2.660
  356    H    THR  47           H        THR  47  92.097 -11.906   6.423
  357    HA   THR  47           HA       THR  47  92.163 -11.160   9.184
  358    HB   THR  47           HB       THR  47  94.550 -11.321   7.347
  359    HG1  THR  47           HG1      THR  47  93.937 -13.588   8.690
  360   HG21  THR  47          HG21      THR  47  94.738 -10.533   9.759
  361   HG22  THR  47          HG22      THR  47  95.728 -11.930   9.339
  362   HG23  THR  47          HG23      THR  47  94.226 -12.151  10.237
  363    H    TYR  48           H        TYR  48  91.228  -9.055   9.148
  364    HA   TYR  48           HA       TYR  48  92.144  -6.867   7.663
  365    HB2  TYR  48           HB2      TYR  48  90.674  -7.202  10.244
  366    HB3  TYR  48           HB3      TYR  48  91.272  -5.598   9.824
  367    HD1  TYR  48           HD2      TYR  48  89.025  -8.346   8.808
  368    HD2  TYR  48           HD1      TYR  48  90.381  -4.366   7.963
  369    HE1  TYR  48           HE2      TYR  48  87.117  -8.028   7.257
  370    HE2  TYR  48           HE1      TYR  48  88.479  -4.041   6.419
  371    HH   TYR  48           HH       TYR  48  86.268  -4.941   6.025
  372    H    THR  49           H        THR  49  93.467  -5.086   8.259
  373    HA   THR  49           HA       THR  49  95.907  -5.883   9.583
  374    HB   THR  49           HB       THR  49  96.670  -3.605   8.981
  375    HG1  THR  49           HG1      THR  49  94.197  -3.243   7.700
  376   HG21  THR  49          HG21      THR  49  96.115  -3.865   6.440
  377   HG22  THR  49          HG22      THR  49  95.331  -5.363   6.940
  378   HG23  THR  49          HG23      THR  49  97.053  -5.124   7.242
  379    H    ASP  50           H        ASP  50  96.907  -4.259  11.176
  380    HA   ASP  50           HA       ASP  50  95.235  -4.145  13.484
  381    HB2  ASP  50           HB2      ASP  50  97.814  -2.624  13.199
  382    HB3  ASP  50           HB1      ASP  50  97.130  -3.382  14.636
  383    H    ALA  51           H        ALA  51  96.294  -1.784  11.092
  384    HA   ALA  51           HA       ALA  51  95.445   0.553  12.419
  385    HB1  ALA  51           HB1      ALA  51  95.699   1.651  10.350
  386    HB2  ALA  51           HB2      ALA  51  95.343   0.188   9.431
  387    HB3  ALA  51           HB3      ALA  51  96.874   0.336  10.297
  388    H    ASN  52           H        ASN  52  93.721  -1.745  10.365
  389    HA   ASN  52           HA       ASN  52  91.294  -0.162  10.345
  390    HB2  ASN  52           HB2      ASN  52  92.232  -2.704   9.146
  391    HB3  ASN  52           HB1      ASN  52  90.510  -2.630   9.506
  392   HD21  ASN  52          HD21      ASN  52  90.122  -2.592   7.128
  393   HD22  ASN  52          HD22      ASN  52  90.333  -1.141   6.268
  394    H    LYS  53           H        LYS  53  92.697  -2.722  12.230
  395    HA   LYS  53           HA       LYS  53  90.219  -3.399  13.575
  396    HB2  LYS  53           HB2      LYS  53  91.511  -5.292  13.549
  397    HB3  LYS  53           HB3      LYS  53  93.019  -4.387  13.531
  398    HG2  LYS  53           HG2      LYS  53  92.881  -3.958  15.898
  399    HG3  LYS  53           HG3      LYS  53  91.241  -4.605  15.972
  400    HD2  LYS  53           HD2      LYS  53  93.422  -6.373  14.921
  401    HD3  LYS  53           HD3      LYS  53  93.327  -6.104  16.661
  402    HE2  LYS  53           HE2      LYS  53  91.056  -7.102  14.916
  403    HE3  LYS  53           HE3      LYS  53  92.025  -8.096  16.002
  404    HZ1  LYS  53           HZ1      LYS  53  89.852  -6.322  16.601
  405    HZ2  LYS  53           HZ2      LYS  53  91.214  -6.045  17.579
  406    HZ3  LYS  53           HZ3      LYS  53  90.501  -7.586  17.525
  407    H    ASN  54           H        ASN  54  92.618  -1.031  13.793
  408    HA   ASN  54           HA       ASN  54  92.742  -0.610  16.593
  409    HB2  ASN  54           HB2      ASN  54  93.959   1.264  16.074
  410    HB3  ASN  54           HB1      ASN  54  94.134   0.381  14.564
  411   HD21  ASN  54          HD21      ASN  54  91.476   0.883  13.520
  412   HD22  ASN  54          HD22      ASN  54  91.364   2.539  13.174
  413    H    LYS  55           H        LYS  55  90.345  -0.014  14.255
  414    HA   LYS  55           HA       LYS  55  88.245   0.928  14.360
  415    HB2  LYS  55           HB2      LYS  55  88.486   1.145  17.345
  416    HB3  LYS  55           HB3      LYS  55  87.075   0.746  16.366
  417    HG2  LYS  55           HG2      LYS  55  88.468  -1.362  15.674
  418    HG3  LYS  55           HG3      LYS  55  89.406  -0.999  17.121
  419    HD2  LYS  55           HD2      LYS  55  87.791  -2.392  18.030
  420    HD3  LYS  55           HD3      LYS  55  87.005  -0.828  18.241
  421    HE2  LYS  55           HE2      LYS  55  85.822  -1.174  16.068
  422    HE3  LYS  55           HE3      LYS  55  86.545  -2.779  15.965
  423    HZ1  LYS  55           HZ1      LYS  55  85.493  -2.734  18.457
  424    HZ2  LYS  55           HZ2      LYS  55  84.763  -3.441  17.096
  425    HZ3  LYS  55           HZ3      LYS  55  84.343  -1.863  17.565
  426    H    GLY  56           H        GLY  56  89.748   2.768  13.486
  427    HA2  GLY  56           HA2      GLY  56  90.021   5.038  15.279
  428    HA3  GLY  56           HA3      GLY  56  90.495   4.980  13.585
  429    H    ILE  57           H        ILE  57  88.126   4.214  12.381
  430    HA   ILE  57           HA       ILE  57  86.094   6.162  13.219
  431    HB   ILE  57           HB       ILE  57  85.961   7.183  11.033
  432   HG12  ILE  57          HG12      ILE  57  87.911   6.546   9.400
  433   HG13  ILE  57          HG13      ILE  57  87.984   5.053  10.332
  434   HG21  ILE  57          HG21      ILE  57  88.027   8.406  11.043
  435   HG22  ILE  57          HG22      ILE  57  88.885   7.066  11.804
  436   HG23  ILE  57          HG23      ILE  57  87.683   7.976  12.719
  437   HD11  ILE  57          HD11      ILE  57  86.091   4.247   9.384
  438   HD12  ILE  57          HD12      ILE  57  86.312   5.510   8.179
  439   HD13  ILE  57          HD13      ILE  57  85.243   5.782   9.549
  440    H    THR  58           H        THR  58  84.109   5.937  11.744
  441    HA   THR  58           HA       THR  58  83.663   3.056  11.269
  442    HB   THR  58           HB       THR  58  81.766   5.272  12.048
  443    HG1  THR  58           HG1      THR  58  81.909   4.377  13.939
  444   HG21  THR  58          HG21      THR  58  80.090   3.325  12.096
  445   HG22  THR  58          HG22      THR  58  81.241   2.463  11.078
  446   HG23  THR  58          HG23      THR  58  80.517   3.966  10.510
  447    H    TRP  59           H        TRP  59  82.821   2.327   9.374
  448    HA   TRP  59           HA       TRP  59  83.185   3.878   7.037
  449    HB2  TRP  59           HB2      TRP  59  81.357   1.487   7.187
  450    HB3  TRP  59           HB1      TRP  59  82.338   2.041   5.830
  451    HD1  TRP  59           HD1      TRP  59  85.111   2.386   7.212
  452    HE1  TRP  59           HE1      TRP  59  86.427   0.315   8.021
  453    HE3  TRP  59           HE3      TRP  59  81.310  -0.993   7.630
  454    HZ2  TRP  59           HZ2      TRP  59  85.920  -2.394   8.782
  455    HZ3  TRP  59           HZ3      TRP  59  81.754  -3.306   8.388
  456    HH2  TRP  59           HH2      TRP  59  84.055  -4.010   8.964
  457    H    LYS  60           H        LYS  60  81.835   5.155   5.910
  458    HA   LYS  60           HA       LYS  60  78.964   5.111   6.364
  459    HB2  LYS  60           HB2      LYS  60  80.654   7.527   7.064
  460    HB3  LYS  60           HB3      LYS  60  78.899   7.552   6.906
  461    HG2  LYS  60           HG2      LYS  60  78.864   5.657   8.630
  462    HG3  LYS  60           HG3      LYS  60  80.556   6.045   8.933
  463    HD2  LYS  60           HD2      LYS  60  78.382   8.144   9.045
  464    HD3  LYS  60           HD3      LYS  60  78.844   7.191  10.455
  465    HE2  LYS  60           HE2      LYS  60  81.217   7.943  10.104
  466    HE3  LYS  60           HE3      LYS  60  80.636   9.019   8.834
  467    HZ1  LYS  60           HZ1      LYS  60  79.042   9.875  10.605
  468    HZ2  LYS  60           HZ2      LYS  60  80.672  10.333  10.734
  469    HZ3  LYS  60           HZ3      LYS  60  80.052   9.102  11.727
  470    H    GLU  61           H        GLU  61  78.430   7.619   5.154
  471    HA   GLU  61           HA       GLU  61  78.914   6.922   2.404
  472    HB2  GLU  61           HB2      GLU  61  76.786   7.931   3.079
  473    HB3  GLU  61           HB3      GLU  61  77.631   9.378   3.625
  474    HG2  GLU  61           HG2      GLU  61  78.310   9.939   1.406
  475    HG3  GLU  61           HG3      GLU  61  77.845   8.354   0.789
  476    H    GLU  62           H        GLU  62  79.675   9.842   4.324
  477    HA   GLU  62           HA       GLU  62  81.450  10.910   2.377
  478    HB2  GLU  62           HB2      GLU  62  81.459  11.542   5.331
  479    HB3  GLU  62           HB3      GLU  62  81.965  12.583   3.999
  480    HG2  GLU  62           HG2      GLU  62  79.561  12.389   3.133
  481    HG3  GLU  62           HG3      GLU  62  79.163  11.701   4.706
  482    H    THR  63           H        THR  63  81.997   9.131   5.409
  483    HA   THR  63           HA       THR  63  84.760   9.205   5.519
  484    HB   THR  63           HB       THR  63  84.612   7.029   6.694
  485    HG1  THR  63           HG1      THR  63  82.007   7.148   5.618
  486   HG21  THR  63          HG21      THR  63  84.098   9.053   7.931
  487   HG22  THR  63          HG22      THR  63  82.992   7.773   8.433
  488   HG23  THR  63          HG23      THR  63  82.440   9.035   7.330
  489    H    LEU  64           H        LEU  64  82.649   7.169   3.567
  490    HA   LEU  64           HA       LEU  64  84.720   5.525   2.506
  491    HB2  LEU  64           HB2      LEU  64  81.847   5.890   2.094
  492    HB3  LEU  64           HB3      LEU  64  82.706   5.526   0.604
  493    HG   LEU  64           HG       LEU  64  83.012   3.906   3.145
  494   HD11  LEU  64          HD11      LEU  64  80.900   3.215   2.651
  495   HD12  LEU  64          HD12      LEU  64  81.689   2.290   1.374
  496   HD13  LEU  64          HD13      LEU  64  80.963   3.854   1.010
  497   HD21  LEU  64          HD21      LEU  64  83.729   2.249   1.161
  498   HD22  LEU  64          HD22      LEU  64  84.884   3.362   1.890
  499   HD23  LEU  64          HD23      LEU  64  84.112   3.772   0.359
  500    H    MET  65           H        MET  65  83.304   8.615   1.579
  501    HA   MET  65           HA       MET  65  84.337   8.764  -1.040
  502    HB2  MET  65           HB2      MET  65  83.736  10.986   0.919
  503    HB3  MET  65           HB1      MET  65  84.056  11.217  -0.798
  504    HG2  MET  65           HG2      MET  65  82.118   9.937  -1.415
  505    HG3  MET  65           HG1      MET  65  81.870   9.413   0.247
  506    HE1  MET  65           HE1      MET  65  81.820  12.308  -2.288
  507    HE2  MET  65           HE2      MET  65  80.271  13.012  -1.832
  508    HE3  MET  65           HE3      MET  65  80.361  11.308  -2.272
  509    H    GLU  66           H        GLU  66  85.653  10.254   1.940
  510    HA   GLU  66           HA       GLU  66  88.056  11.129   0.746
  511    HB2  GLU  66           HB2      GLU  66  87.474  10.412   3.632
  512    HB3  GLU  66           HB3      GLU  66  88.915  11.262   3.077
  513    HG2  GLU  66           HG2      GLU  66  87.135  12.872   1.943
  514    HG3  GLU  66           HG3      GLU  66  86.076  12.219   3.192
  515    H    TYR  67           H        TYR  67  87.025   8.076   2.042
  516    HA   TYR  67           HA       TYR  67  89.659   6.895   2.122
  517    HB2  TYR  67           HB2      TYR  67  88.068   6.002   3.650
  518    HB3  TYR  67           HB3      TYR  67  86.856   5.819   2.388
  519    HD1  TYR  67           HD2      TYR  67  87.043   4.033   0.696
  520    HD2  TYR  67           HD1      TYR  67  89.853   4.383   3.926
  521    HE1  TYR  67           HE2      TYR  67  87.833   1.723   0.259
  522    HE2  TYR  67           HE1      TYR  67  90.641   2.072   3.490
  523    HH   TYR  67           HH       TYR  67  90.435   0.508   0.955
  524    H    LEU  68           H        LEU  68  87.094   7.281  -0.182
  525    HA   LEU  68           HA       LEU  68  88.008   5.214  -1.974
  526    HB2  LEU  68           HB2      LEU  68  85.825   7.240  -1.937
  527    HB3  LEU  68           HB3      LEU  68  86.341   6.655  -3.511
  528    HG   LEU  68           HG       LEU  68  85.516   4.874  -1.200
  529   HD11  LEU  68          HD11      LEU  68  83.553   4.417  -2.800
  530   HD12  LEU  68          HD12      LEU  68  84.036   5.902  -3.622
  531   HD13  LEU  68          HD13      LEU  68  83.546   5.947  -1.931
  532   HD21  LEU  68          HD21      LEU  68  85.278   3.385  -3.451
  533   HD22  LEU  68          HD22      LEU  68  86.729   3.406  -2.454
  534   HD23  LEU  68          HD23      LEU  68  86.642   4.401  -3.904
  535    H    GLU  69           H        GLU  69  88.927   8.440  -1.345
  536    HA   GLU  69           HA       GLU  69  90.105   8.755  -4.031
  537    HB2  GLU  69           HB2      GLU  69  90.071  11.034  -3.708
  538    HB3  GLU  69           HB3      GLU  69  88.707  10.575  -2.694
  539    HG2  GLU  69           HG2      GLU  69  90.444  10.387  -0.785
  540    HG3  GLU  69           HG3      GLU  69  91.509  11.303  -1.849
  541    H    ASN  70           H        ASN  70  90.867   7.684  -0.967
  542    HA   ASN  70           HA       ASN  70  93.622   7.324  -1.568
  543    HB2  ASN  70           HB2      ASN  70  93.290   9.856  -0.851
  544    HB3  ASN  70           HB1      ASN  70  93.302   9.168   0.769
  545   HD21  ASN  70          HD21      ASN  70  95.195   7.067   0.398
  546   HD22  ASN  70          HD22      ASN  70  96.705   7.755   0.041
  547    HA   PRO  71           HA       PRO  71  91.277   4.557   1.485
  548    HB2  PRO  71           HB2      PRO  71  93.004   2.680  -0.081
  549    HB3  PRO  71           HB1      PRO  71  91.329   2.481   0.466
  550    HG2  PRO  71           HG2      PRO  71  91.925   3.064  -2.073
  551    HG3  PRO  71           HG1      PRO  71  90.471   3.694  -1.280
  552    HD2  PRO  71           HD2      PRO  71  92.970   5.122  -2.029
  553    HD3  PRO  71           HD1      PRO  71  91.323   5.757  -1.822
  554    H    LYS  72           H        LYS  72  94.677   4.673   0.478
  555    HA   LYS  72           HA       LYS  72  95.665   3.337   2.815
  556    HB2  LYS  72           HB2      LYS  72  96.844   3.356   0.627
  557    HB3  LYS  72           HB3      LYS  72  97.158   5.075   0.844
  558    HG2  LYS  72           HG2      LYS  72  98.988   4.577   2.067
  559    HG3  LYS  72           HG3      LYS  72  97.960   3.787   3.259
  560    HD2  LYS  72           HD2      LYS  72  98.897   2.395   0.738
  561    HD3  LYS  72           HD3      LYS  72  99.800   2.338   2.251
  562    HE2  LYS  72           HE2      LYS  72  96.918   1.455   1.908
  563    HE3  LYS  72           HE3      LYS  72  98.308   0.376   2.015
  564    HZ1  LYS  72           HZ1      LYS  72  97.211   2.165   4.098
  565    HZ2  LYS  72           HZ2      LYS  72  98.789   1.542   4.197
  566    HZ3  LYS  72           HZ3      LYS  72  97.457   0.488   4.171
  567    H    LYS  73           H        LYS  73  95.653   6.747   1.766
  568    HA   LYS  73           HA       LYS  73  97.009   7.743   4.020
  569    HB2  LYS  73           HB2      LYS  73  96.706   8.985   1.886
  570    HB3  LYS  73           HB3      LYS  73  95.009   9.221   2.306
  571    HG2  LYS  73           HG2      LYS  73  95.661  10.401   4.360
  572    HG3  LYS  73           HG3      LYS  73  97.364  10.130   3.987
  573    HD2  LYS  73           HD2      LYS  73  97.052  12.290   3.156
  574    HD3  LYS  73           HD3      LYS  73  96.767  11.317   1.714
  575    HE2  LYS  73           HE2      LYS  73  94.351  11.431   2.069
  576    HE3  LYS  73           HE3      LYS  73  94.590  12.306   3.582
  577    HZ1  LYS  73           HZ1      LYS  73  95.881  13.949   2.113
  578    HZ2  LYS  73           HZ2      LYS  73  94.183  13.979   2.067
  579    HZ3  LYS  73           HZ3      LYS  73  95.056  13.224   0.821
  580    H    TYR  74           H        TYR  74  93.601   7.035   3.488
  581    HA   TYR  74           HA       TYR  74  92.585   8.519   5.673
  582    HB2  TYR  74           HB2      TYR  74  91.420   7.169   3.657
  583    HB3  TYR  74           HB3      TYR  74  91.233   5.971   4.937
  584    HD1  TYR  74           HD1      TYR  74  90.931   9.699   4.531
  585    HD2  TYR  74           HD2      TYR  74  89.266   6.102   6.188
  586    HE1  TYR  74           HE1      TYR  74  89.043  11.003   5.470
  587    HE2  TYR  74           HE2      TYR  74  87.380   7.407   7.126
  588    HH   TYR  74           HH       TYR  74  87.402  10.698   7.448
  589    H    ILE  75           H        ILE  75  93.220   5.013   5.426
  590    HA   ILE  75           HA       ILE  75  93.793   4.995   8.329
  591    HB   ILE  75           HB       ILE  75  92.344   2.795   6.840
  592   HG12  ILE  75          HG12      ILE  75  91.136   4.717   8.841
  593   HG13  ILE  75          HG13      ILE  75  91.085   5.028   7.107
  594   HG21  ILE  75          HG21      ILE  75  93.614   2.062   8.814
  595   HG22  ILE  75          HG22      ILE  75  91.884   1.997   9.149
  596   HG23  ILE  75          HG23      ILE  75  92.856   3.323   9.787
  597   HD11  ILE  75          HD11      ILE  75  89.049   3.836   8.032
  598   HD12  ILE  75          HD12      ILE  75  90.096   2.453   8.350
  599   HD13  ILE  75          HD13      ILE  75  89.850   3.009   6.695
  600    HA   PRO  76           HA       PRO  76  97.421   3.582   5.657
  601    HB2  PRO  76           HB2      PRO  76  98.526   4.281   8.364
  602    HB3  PRO  76           HB1      PRO  76  99.237   4.545   6.758
  603    HG2  PRO  76           HG2      PRO  76  98.050   6.525   8.097
  604    HG3  PRO  76           HG1      PRO  76  97.934   6.391   6.334
  605    HD2  PRO  76           HD2      PRO  76  95.840   5.923   8.381
  606    HD3  PRO  76           HD1      PRO  76  95.661   6.316   6.658
  607    H    GLY  77           H        GLY  77  98.801   1.712   6.001
  608    HA2  GLY  77           HA2      GLY  77  99.424  -0.312   6.993
  609    HA3  GLY  77           HA3      GLY  77  98.299   0.012   8.310
  610    H    THR  78           H        THR  78  96.103   0.617   6.409
  611    HA   THR  78           HA       THR  78  94.847  -1.871   6.307
  612    HB   THR  78           HB       THR  78  93.691   0.327   6.106
  613    HG1  THR  78           HG1      THR  78  93.239  -1.929   4.736
  614   HG21  THR  78          HG21      THR  78  93.725   1.536   4.045
  615   HG22  THR  78          HG22      THR  78  94.605   0.244   3.229
  616   HG23  THR  78          HG23      THR  78  95.408   1.216   4.462
  617    H    LYS  79           H        LYS  79  94.589  -3.428   4.704
  618    HA   LYS  79           HA       LYS  79  96.716  -3.434   2.689
  619    HB2  LYS  79           HB2      LYS  79  95.824  -5.409   4.318
  620    HB3  LYS  79           HB3      LYS  79  94.872  -5.748   2.876
  621    HG2  LYS  79           HG2      LYS  79  96.838  -6.969   2.486
  622    HG3  LYS  79           HG3      LYS  79  97.129  -5.474   1.599
  623    HD2  LYS  79           HD2      LYS  79  99.100  -5.509   2.781
  624    HD3  LYS  79           HD3      LYS  79  98.103  -4.740   4.016
  625    HE2  LYS  79           HE2      LYS  79  99.086  -6.488   5.217
  626    HE3  LYS  79           HE3      LYS  79  97.555  -7.211   4.723
  627    HZ1  LYS  79           HZ1      LYS  79 100.254  -7.659   3.630
  628    HZ2  LYS  79           HZ2      LYS  79  98.886  -7.945   2.664
  629    HZ3  LYS  79           HZ3      LYS  79  99.096  -8.798   4.119
  630    H    MET  80           H        MET  80  95.981  -1.987   1.152
  631    HA   MET  80           HA       MET  80  94.358  -3.025  -0.904
  632    HB2  MET  80           HB2      MET  80  92.440  -2.582   0.482
  633    HB3  MET  80           HB1      MET  80  93.029  -0.965   0.874
  634    HG2  MET  80           HG2      MET  80  92.672  -0.182  -1.349
  635    HG3  MET  80           HG1      MET  80  92.466  -1.818  -1.973
  636    HE1  MET  80           HE1      MET  80  90.805   1.057  -1.924
  637    HE2  MET  80           HE2      MET  80  89.119   0.554  -1.954
  638    HE3  MET  80           HE3      MET  80  90.273  -0.190  -3.058
  639    H    ILE  81           H        ILE  81  96.012  -2.349  -2.215
  640    HA   ILE  81           HA       ILE  81  96.478   0.570  -2.394
  641    HB   ILE  81           HB       ILE  81  98.259  -1.779  -3.077
  642   HG12  ILE  81          HG12      ILE  81  99.800  -0.518  -1.517
  643   HG13  ILE  81          HG13      ILE  81  98.459   0.568  -1.161
  644   HG21  ILE  81          HG21      ILE  81  98.465   1.145  -3.818
  645   HG22  ILE  81          HG22      ILE  81  98.604  -0.260  -4.875
  646   HG23  ILE  81          HG23      ILE  81  99.886   0.105  -3.722
  647   HD11  ILE  81          HD11      ILE  81  97.821  -2.314  -0.910
  648   HD12  ILE  81          HD12      ILE  81  97.396  -0.967   0.145
  649   HD13  ILE  81          HD13      ILE  81  98.993  -1.701   0.256
  650    H    PHE  82           H        PHE  82  95.074   1.283  -3.904
  651    HA   PHE  82           HA       PHE  82  95.372   0.233  -6.618
  652    HB2  PHE  82           HB2      PHE  82  93.391  -0.891  -5.334
  653    HB3  PHE  82           HB1      PHE  82  92.582   0.657  -5.580
  654    HD1  PHE  82           HD2      PHE  82  94.182  -2.217  -7.300
  655    HD2  PHE  82           HD1      PHE  82  91.800   1.330  -7.747
  656    HE1  PHE  82           HE2      PHE  82  93.651  -2.869  -9.634
  657    HE2  PHE  82           HE1      PHE  82  91.269   0.678 -10.080
  658    HZ   PHE  82           HZ       PHE  82  92.194  -1.421 -11.023
  659    H    ALA  83           H        ALA  83  94.102   1.652  -8.186
  660    HA   ALA  83           HA       ALA  83  94.896   4.351  -7.812
  661    HB1  ALA  83           HB1      ALA  83  93.068   3.062  -9.849
  662    HB2  ALA  83           HB2      ALA  83  94.781   3.441 -10.042
  663    HB3  ALA  83           HB3      ALA  83  93.597   4.744  -9.923
  664    H    GLY  84           H        GLY  84  93.961   5.670  -6.383
  665    HA2  GLY  84           HA2      GLY  84  91.377   5.385  -5.301
  666    HA3  GLY  84           HA3      GLY  84  92.352   6.851  -5.238
  667    H    ILE  85           H        ILE  85  89.822   7.419  -5.449
  668    HA   ILE  85           HA       ILE  85  88.949   7.518  -8.229
  669    HB   ILE  85           HB       ILE  85  87.730   8.551  -5.664
  670   HG12  ILE  85          HG12      ILE  85  87.896   5.991  -6.353
  671   HG13  ILE  85          HG13      ILE  85  86.405   6.638  -5.679
  672   HG21  ILE  85          HG21      ILE  85  86.840   8.743  -8.537
  673   HG22  ILE  85          HG22      ILE  85  86.887  10.011  -7.311
  674   HG23  ILE  85          HG23      ILE  85  85.668   8.739  -7.222
  675   HD11  ILE  85          HD11      ILE  85  86.265   5.204  -7.848
  676   HD12  ILE  85          HD12      ILE  85  86.846   6.659  -8.655
  677   HD13  ILE  85          HD13      ILE  85  85.328   6.695  -7.760
  678    H    LYS  86           H        LYS  86  88.368   9.556  -9.265
  679    HA   LYS  86           HA       LYS  86  90.326  11.657  -8.629
  680    HB2  LYS  86           HB2      LYS  86  88.800  10.896 -11.106
  681    HB3  LYS  86           HB3      LYS  86  89.539  12.491 -10.956
  682    HG2  LYS  86           HG2      LYS  86  91.729  11.474 -10.556
  683    HG3  LYS  86           HG3      LYS  86  91.013   9.862 -10.612
  684    HD2  LYS  86           HD2      LYS  86  90.520  10.034 -12.923
  685    HD3  LYS  86           HD3      LYS  86  90.743  11.783 -12.925
  686    HE2  LYS  86           HE2      LYS  86  93.006   9.900 -12.251
  687    HE3  LYS  86           HE3      LYS  86  92.654  10.369 -13.915
  688    HZ1  LYS  86           HZ1      LYS  86  94.051  12.041 -13.385
  689    HZ2  LYS  86           HZ2      LYS  86  93.723  11.959 -11.721
  690    HZ3  LYS  86           HZ3      LYS  86  92.637  12.744 -12.765
  691    H    LYS  87           H        LYS  87  87.065  11.765 -10.084
  692    HA   LYS  87           HA       LYS  87  86.572  14.326  -8.817
  693    HB2  LYS  87           HB2      LYS  87  84.912  12.602 -10.661
  694    HB3  LYS  87           HB3      LYS  87  84.394  14.174 -10.053
  695    HG2  LYS  87           HG2      LYS  87  86.303  15.266 -11.084
  696    HG3  LYS  87           HG3      LYS  87  86.976  13.711 -11.574
  697    HD2  LYS  87           HD2      LYS  87  84.194  14.376 -12.465
  698    HD3  LYS  87           HD3      LYS  87  85.536  15.189 -13.268
  699    HE2  LYS  87           HE2      LYS  87  85.508  12.194 -12.892
  700    HE3  LYS  87           HE3      LYS  87  84.744  12.958 -14.285
  701    HZ1  LYS  87           HZ1      LYS  87  86.725  13.614 -15.135
  702    HZ2  LYS  87           HZ2      LYS  87  87.263  12.233 -14.304
  703    HZ3  LYS  87           HZ3      LYS  87  87.468  13.773 -13.619
  704    H    LYS  88           H        LYS  88  84.543  14.764  -7.668
  705    HA   LYS  88           HA       LYS  88  84.221  12.996  -5.453
  706    HB2  LYS  88           HB2      LYS  88  83.933  15.518  -5.425
  707    HB3  LYS  88           HB3      LYS  88  82.376  15.263  -6.217
  708    HG2  LYS  88           HG2      LYS  88  81.834  13.643  -4.308
  709    HG3  LYS  88           HG3      LYS  88  83.252  14.294  -3.489
  710    HD2  LYS  88           HD2      LYS  88  81.639  15.725  -2.647
  711    HD3  LYS  88           HD3      LYS  88  82.100  16.624  -4.093
  712    HE2  LYS  88           HE2      LYS  88  80.238  15.436  -5.321
  713    HE3  LYS  88           HE3      LYS  88  79.722  14.775  -3.771
  714    HZ1  LYS  88           HZ1      LYS  88  79.159  16.855  -2.974
  715    HZ2  LYS  88           HZ2      LYS  88  78.666  16.944  -4.597
  716    HZ3  LYS  88           HZ3      LYS  88  80.118  17.677  -4.106
  717    H    THR  89           H        THR  89  82.065  13.911  -8.154
  718    HA   THR  89           HA       THR  89  79.871  12.352  -7.474
  719    HB   THR  89           HB       THR  89  79.379  12.281  -9.921
  720    HG1  THR  89           HG1      THR  89  81.770  13.773 -10.159
  721   HG21  THR  89          HG21      THR  89  80.253  14.898  -8.674
  722   HG22  THR  89          HG22      THR  89  78.634  14.198  -8.672
  723   HG23  THR  89          HG23      THR  89  79.334  14.799 -10.175
  724    H    GLU  90           H        GLU  90  82.961  11.388  -8.768
  725    HA   GLU  90           HA       GLU  90  82.176   8.812  -9.699
  726    HB2  GLU  90           HB2      GLU  90  84.810  10.044  -8.913
  727    HB3  GLU  90           HB3      GLU  90  84.696   8.326  -9.292
  728    HG2  GLU  90           HG2      GLU  90  83.738   8.864 -11.491
  729    HG3  GLU  90           HG3      GLU  90  83.826  10.584 -11.114
  730    H    ARG  91           H        ARG  91  83.301  10.109  -6.625
  731    HA   ARG  91           HA       ARG  91  83.388   7.561  -5.288
  732    HB2  ARG  91           HB2      ARG  91  83.200  10.328  -4.067
  733    HB3  ARG  91           HB3      ARG  91  83.753   8.855  -3.275
  734    HG2  ARG  91           HG2      ARG  91  85.609   8.708  -4.930
  735    HG3  ARG  91           HG3      ARG  91  85.094  10.258  -5.597
  736    HD2  ARG  91           HD2      ARG  91  85.253  10.767  -2.872
  737    HD3  ARG  91           HD3      ARG  91  86.623   9.699  -3.159
  738    HE   ARG  91           HE       ARG  91  86.811  11.519  -5.182
  739   HH11  ARG  91          HH21      ARG  91  86.474  11.712  -1.739
  740   HH12  ARG  91          HH22      ARG  91  87.319  13.217  -1.606
  741   HH21  ARG  91          HH11      ARG  91  87.918  13.492  -5.009
  742   HH22  ARG  91          HH12      ARG  91  88.138  14.224  -3.454
  743    H    GLU  92           H        GLU  92  81.164  10.355  -5.239
  744    HA   GLU  92           HA       GLU  92  79.279   9.314  -3.456
  745    HB2  GLU  92           HB2      GLU  92  79.403  11.676  -4.421
  746    HB3  GLU  92           HB3      GLU  92  78.577  11.029  -5.839
  747    HG2  GLU  92           HG2      GLU  92  76.732  10.235  -4.402
  748    HG3  GLU  92           HG3      GLU  92  77.551  10.896  -2.988
  749    H    ASP  93           H        ASP  93  79.244   9.217  -7.031
  750    HA   ASP  93           HA       ASP  93  76.953   7.618  -7.303
  751    HB2  ASP  93           HB2      ASP  93  79.401   7.785  -9.079
  752    HB3  ASP  93           HB1      ASP  93  77.869   7.045  -9.539
  753    H    LEU  94           H        LEU  94  80.389   6.704  -7.168
  754    HA   LEU  94           HA       LEU  94  80.076   3.929  -7.383
  755    HB2  LEU  94           HB2      LEU  94  82.272   4.988  -7.535
  756    HB3  LEU  94           HB3      LEU  94  82.147   5.519  -5.860
  757    HG   LEU  94           HG       LEU  94  82.124   3.219  -5.073
  758   HD11  LEU  94          HD11      LEU  94  81.946   2.656  -8.020
  759   HD12  LEU  94          HD12      LEU  94  81.015   1.958  -6.694
  760   HD13  LEU  94          HD13      LEU  94  82.690   1.469  -6.947
  761   HD21  LEU  94          HD21      LEU  94  84.304   4.443  -5.680
  762   HD22  LEU  94          HD22      LEU  94  84.343   3.419  -7.115
  763   HD23  LEU  94          HD23      LEU  94  84.395   2.691  -5.512
  764    H    ILE  95           H        ILE  95  79.822   6.096  -4.636
  765    HA   ILE  95           HA       ILE  95  79.646   3.989  -2.710
  766    HB   ILE  95           HB       ILE  95  79.269   6.964  -2.612
  767   HG12  ILE  95          HG12      ILE  95  81.057   5.351  -0.836
  768   HG13  ILE  95          HG13      ILE  95  81.488   5.457  -2.536
  769   HG21  ILE  95          HG21      ILE  95  77.653   6.434  -1.018
  770   HG22  ILE  95          HG22      ILE  95  79.105   6.400  -0.020
  771   HG23  ILE  95          HG23      ILE  95  78.409   4.893  -0.614
  772   HD11  ILE  95          HD11      ILE  95  82.063   7.651  -2.390
  773   HD12  ILE  95          HD12      ILE  95  82.232   7.298  -0.674
  774   HD13  ILE  95          HD13      ILE  95  80.751   8.033  -1.280
  775    H    ALA  96           H        ALA  96  77.423   5.792  -4.678
  776    HA   ALA  96           HA       ALA  96  75.040   5.219  -3.252
  777    HB1  ALA  96           HB1      ALA  96  75.318   5.567  -6.244
  778    HB2  ALA  96           HB2      ALA  96  75.299   6.916  -5.107
  779    HB3  ALA  96           HB3      ALA  96  73.888   5.869  -5.258
  780    H    TYR  97           H        TYR  97  76.959   3.484  -5.622
  781    HA   TYR  97           HA       TYR  97  75.043   1.360  -5.978
  782    HB2  TYR  97           HB2      TYR  97  76.541   1.756  -7.805
  783    HB3  TYR  97           HB3      TYR  97  77.951   1.659  -6.752
  784    HD1  TYR  97           HD1      TYR  97  75.139  -0.315  -8.189
  785    HD2  TYR  97           HD2      TYR  97  78.934  -0.441  -6.185
  786    HE1  TYR  97           HE1      TYR  97  75.248  -2.763  -8.552
  787    HE2  TYR  97           HE2      TYR  97  79.042  -2.891  -6.549
  788    HH   TYR  97           HH       TYR  97  77.708  -4.736  -7.052
  789    H    LEU  98           H        LEU  98  78.136   1.750  -4.239
  790    HA   LEU  98           HA       LEU  98  78.347  -0.802  -3.162
  791    HB2  LEU  98           HB2      LEU  98  79.235   1.909  -2.228
  792    HB3  LEU  98           HB3      LEU  98  79.466   0.513  -1.183
  793    HG   LEU  98           HG       LEU  98  80.344   0.356  -4.059
  794   HD11  LEU  98          HD11      LEU  98  82.409   1.380  -3.659
  795   HD12  LEU  98          HD12      LEU  98  82.221   1.297  -1.910
  796   HD13  LEU  98          HD13      LEU  98  81.286   2.463  -2.844
  797   HD21  LEU  98          HD21      LEU  98  81.559  -0.779  -1.535
  798   HD22  LEU  98          HD22      LEU  98  81.849  -1.296  -3.195
  799   HD23  LEU  98          HD23      LEU  98  80.290  -1.608  -2.431
  800    H    LYS  99           H        LYS  99  76.135   1.753  -2.415
  801    HA   LYS  99           HA       LYS  99  75.382   0.724   0.181
  802    HB2  LYS  99           HB2      LYS  99  74.424   2.941  -1.600
  803    HB3  LYS  99           HB3      LYS  99  73.405   2.399  -0.266
  804    HG2  LYS  99           HG2      LYS  99  75.427   2.696   1.250
  805    HG3  LYS  99           HG3      LYS  99  76.222   3.500  -0.103
  806    HD2  LYS  99           HD2      LYS  99  73.529   4.351   0.997
  807    HD3  LYS  99           HD3      LYS  99  75.058   5.060   1.517
  808    HE2  LYS  99           HE2      LYS  99  75.504   5.503  -0.981
  809    HE3  LYS  99           HE3      LYS  99  73.790   5.161  -1.221
  810    HZ1  LYS  99           HZ1      LYS  99  75.002   7.514  -0.248
  811    HZ2  LYS  99           HZ2      LYS  99  73.971   6.880   0.944
  812    HZ3  LYS  99           HZ3      LYS  99  73.369   7.229  -0.606
  813    H    LYS 100           H        LYS 100  73.818   0.887  -3.025
  814    HA   LYS 100           HA       LYS 100  71.593  -0.731  -2.202
  815    HB2  LYS 100           HB2      LYS 100  71.669   0.985  -4.115
  816    HB3  LYS 100           HB3      LYS 100  72.459  -0.282  -5.054
  817    HG2  LYS 100           HG2      LYS 100  70.515  -1.798  -4.444
  818    HG3  LYS 100           HG3      LYS 100  69.709  -0.374  -3.789
  819    HD2  LYS 100           HD2      LYS 100  70.776  -0.459  -6.618
  820    HD3  LYS 100           HD3      LYS 100  69.142  -0.986  -6.215
  821    HE2  LYS 100           HE2      LYS 100  68.808   1.280  -5.105
  822    HE3  LYS 100           HE3      LYS 100  70.333   1.771  -5.844
  823    HZ1  LYS 100           HZ1      LYS 100  67.829   0.953  -7.191
  824    HZ2  LYS 100           HZ2      LYS 100  69.318   1.000  -8.006
  825    HZ3  LYS 100           HZ3      LYS 100  68.668   2.419  -7.337
  826    H    ALA 101           H        ALA 101  74.784  -1.377  -3.255
  827    HA   ALA 101           HA       ALA 101  74.214  -4.061  -4.223
  828    HB1  ALA 101           HB1      ALA 101  76.870  -2.703  -3.718
  829    HB2  ALA 101           HB2      ALA 101  76.001  -2.681  -5.254
  830    HB3  ALA 101           HB3      ALA 101  76.615  -4.203  -4.608
  831    H    THR 102           H        THR 102  75.409  -2.472  -1.337
  832    HA   THR 102           HA       THR 102  76.120  -5.020  -0.087
  833    HB   THR 102           HB       THR 102  76.814  -3.589   1.820
  834    HG1  THR 102           HG1      THR 102  75.545  -1.698   0.213
  835   HG21  THR 102          HG21      THR 102  78.549  -2.243   0.442
  836   HG22  THR 102          HG22      THR 102  77.804  -3.004  -0.964
  837   HG23  THR 102          HG23      THR 102  78.550  -3.999   0.285
  838    H    ASN 103           H        ASN 103  73.380  -3.248  -0.596
  839    HA   ASN 103           HA       ASN 103  72.124  -3.863   1.986
  840    HB2  ASN 103           HB2      ASN 103  71.392  -2.169  -0.384
  841    HB3  ASN 103           HB1      ASN 103  70.162  -2.653   0.776
  842   HD21  ASN 103          HD21      ASN 103  73.462  -2.157   1.864
  843   HD22  ASN 103          HD22      ASN 103  73.160  -0.713   2.702
  844    H    GLU 104           H        GLU 104  72.271  -4.943  -1.303
  845    HA   GLU 104           HA       GLU 104  70.602  -7.237  -0.651
  846    HB2  GLU 104           HB2      GLU 104  69.229  -6.875  -2.756
  847    HB3  GLU 104           HB3      GLU 104  68.867  -5.786  -1.416
  848    HG2  GLU 104           HG2      GLU 104  70.083  -3.994  -2.407
  849    HG3  GLU 104           HG3      GLU 104  70.849  -5.065  -3.580
  850    HHA  HEC 201           HA       HEC 105  89.293  -3.561   3.261
  851    HHB  HEC 201           HB       HEC 105  85.512  -0.037  -0.380
  852    HHC  HEC 201           HC       HEC 105  88.865  -1.728  -5.470
  853    HHD  HEC 201           HD       HEC 105  92.220  -5.739  -1.908
  854   HMA1  HEC 201          HMA1      HEC 105  85.677   0.778   2.418
  855   HMA2  HEC 201          HMA2      HEC 105  85.011  -0.595   3.302
  856   HMA3  HEC 201          HMA3      HEC 105  84.548  -0.321   1.625
  857   HAA1  HEC 201          HAA1      HEC 105  86.806  -1.042   4.549
  858   HAA2  HEC 201          HAA2      HEC 105  88.317  -1.927   4.519
  859   HBA1  HEC 201          HBA1      HEC 105  87.247  -4.009   4.595
  860   HBA2  HEC 201          HBA2      HEC 105  85.706  -3.347   4.060
  861   HMB1  HEC 201          HMB1      HEC 105  84.118   0.120  -2.686
  862   HMB2  HEC 201          HMB2      HEC 105  84.831   1.179  -3.895
  863   HMB3  HEC 201          HMB3      HEC 105  85.106   1.490  -2.184
  864    HAB  HEC 201           HAB      HEC 105  87.380  -0.515  -6.129
  865   HBB1  HEC 201          HBB1      HEC 105  86.683   2.020  -4.691
  866   HBB2  HEC 201          HBB2      HEC 105  87.993   1.703  -5.823
  867   HBB3  HEC 201          HBB3      HEC 105  86.345   1.898  -6.416
  868   HMC1  HEC 201          HMC1      HEC 105  89.836  -3.303  -6.822
  869   HMC2  HEC 201          HMC2      HEC 105  91.331  -4.236  -6.828
  870   HMC3  HEC 201          HMC3      HEC 105  91.379  -2.495  -6.555
  871    HAC  HEC 201           HAC      HEC 105  92.726  -6.103  -3.834
  872   HBC1  HEC 201          HBC1      HEC 105  94.435  -5.140  -4.954
  873   HBC2  HEC 201          HBC2      HEC 105  93.372  -3.868  -5.560
  874   HBC3  HEC 201          HBC3      HEC 105  93.535  -5.382  -6.450
  875   HMD1  HEC 201          HMD1      HEC 105  93.471  -6.249  -0.061
  876   HMD2  HEC 201          HMD2      HEC 105  92.288  -7.488   0.356
  877   HMD3  HEC 201          HMD3      HEC 105  93.170  -6.647   1.627
  878   HAD1  HEC 201          HAD1      HEC 105  91.748  -6.398   3.258
  879   HAD2  HEC 201          HAD2      HEC 105  90.375  -5.450   3.782
  880   HBD1  HEC 201          HBD1      HEC 105  92.461  -3.588   3.304
  881   HBD2  HEC 201          HBD2      HEC 105  93.189  -4.934   4.173
  882    H1   HOH 301           H2       HOH 200  82.653   3.992  -1.071
  883    H2   HOH 301           H1       HOH 200  82.828   2.579  -0.553
  884    H1   HOH 302           H2       HOH 201  86.116   6.365   5.195
  885    H2   HOH 302           H1       HOH 201  86.487   4.911   5.391
  886    H1   HOH 303           H2       HOH 202  82.174  -5.784   5.202
  887    H2   HOH 303           H1       HOH 202  81.871  -6.472   6.516
  888    H1   HOH 304           H2       HOH 203  81.425 -11.302   0.333
  889    H2   HOH 304           H1       HOH 203  80.590 -10.080   0.022
  Start of MODEL    8
    1    H1   GLY   1           H1       GLY   1  71.979  10.262  -6.670
    2    H2   GLY   1           H2       GLY   1  73.093  11.410  -6.099
    3    H3   GLY   1           H3       GLY   1  72.663  10.082  -5.128
    4    HA2  GLY   1           HA2      GLY   1  74.751  10.280  -6.992
    5    HA3  GLY   1           HA3      GLY   1  74.330   8.913  -5.957
    6    H    ASP   2           H        ASP   2  75.327   8.586  -8.562
    7    HA   ASP   2           HA       ASP   2  72.955   7.692 -10.092
    8    HB2  ASP   2           HB2      ASP   2  75.756   8.402 -10.972
    9    HB3  ASP   2           HB1      ASP   2  74.578   7.610 -12.018
   10    H    VAL   3           H        VAL   3  72.785   5.777  -8.795
   11    HA   VAL   3           HA       VAL   3  74.728   3.884  -8.295
   12    HB   VAL   3           HB       VAL   3  72.512   3.632  -7.379
   13   HG11  VAL   3          HG11      VAL   3  71.655   3.370 -10.276
   14   HG12  VAL   3          HG12      VAL   3  71.198   4.644  -9.146
   15   HG13  VAL   3          HG13      VAL   3  70.611   2.999  -8.905
   16   HG21  VAL   3          HG21      VAL   3  72.759   1.372  -9.368
   17   HG22  VAL   3          HG22      VAL   3  72.229   1.302  -7.687
   18   HG23  VAL   3          HG23      VAL   3  73.928   1.573  -8.066
   19    H    GLU   4           H        GLU   4  73.455   4.882 -11.313
   20    HA   GLU   4           HA       GLU   4  73.950   2.461 -12.769
   21    HB2  GLU   4           HB2      GLU   4  73.504   5.325 -13.618
   22    HB3  GLU   4           HB3      GLU   4  73.777   4.017 -14.770
   23    HG2  GLU   4           HG2      GLU   4  71.818   2.839 -14.017
   24    HG3  GLU   4           HG3      GLU   4  71.614   3.938 -12.655
   25    H    LYS   5           H        LYS   5  75.625   5.620 -12.771
   26    HA   LYS   5           HA       LYS   5  77.904   4.561 -14.153
   27    HB2  LYS   5           HB2      LYS   5  77.259   7.173 -12.802
   28    HB3  LYS   5           HB3      LYS   5  78.916   6.822 -13.281
   29    HG2  LYS   5           HG2      LYS   5  78.084   7.905 -15.181
   30    HG3  LYS   5           HG3      LYS   5  77.853   6.211 -15.600
   31    HD2  LYS   5           HD2      LYS   5  75.757   7.094 -16.114
   32    HD3  LYS   5           HD3      LYS   5  75.496   6.550 -14.461
   33    HE2  LYS   5           HE2      LYS   5  75.877   8.800 -13.609
   34    HE3  LYS   5           HE3      LYS   5  76.305   9.372 -15.221
   35    HZ1  LYS   5           HZ1      LYS   5  73.854   9.535 -14.197
   36    HZ2  LYS   5           HZ2      LYS   5  73.739   8.040 -14.999
   37    HZ3  LYS   5           HZ3      LYS   5  74.169   9.440 -15.862
   38    H    GLY   6           H        GLY   6  76.859   4.662 -10.894
   39    HA2  GLY   6           HA2      GLY   6  79.446   4.459  -9.656
   40    HA3  GLY   6           HA3      GLY   6  77.893   4.094  -8.898
   41    H    LYS   7           H        LYS   7  77.068   2.304 -11.011
   42    HA   LYS   7           HA       LYS   7  78.156  -0.137 -10.015
   43    HB2  LYS   7           HB2      LYS   7  75.815   0.193 -10.914
   44    HB3  LYS   7           HB3      LYS   7  76.519   0.255 -12.528
   45    HG2  LYS   7           HG2      LYS   7  77.650  -2.002 -11.862
   46    HG3  LYS   7           HG3      LYS   7  76.423  -2.058 -10.600
   47    HD2  LYS   7           HD2      LYS   7  75.359  -3.185 -12.352
   48    HD3  LYS   7           HD3      LYS   7  74.756  -1.543 -12.557
   49    HE2  LYS   7           HE2      LYS   7  77.035  -1.406 -14.044
   50    HE3  LYS   7           HE3      LYS   7  76.608  -3.101 -14.272
   51    HZ1  LYS   7           HZ1      LYS   7  75.585  -1.631 -15.926
   52    HZ2  LYS   7           HZ2      LYS   7  74.756  -0.818 -14.686
   53    HZ3  LYS   7           HZ3      LYS   7  74.427  -2.455 -14.999
   54    H    LYS   8           H        LYS   8  78.521   1.717 -13.033
   55    HA   LYS   8           HA       LYS   8  80.155  -0.124 -14.403
   56    HB2  LYS   8           HB2      LYS   8  79.166   1.747 -15.570
   57    HB3  LYS   8           HB3      LYS   8  80.033   2.896 -14.554
   58    HG2  LYS   8           HG2      LYS   8  81.791   0.928 -15.879
   59    HG3  LYS   8           HG3      LYS   8  80.923   1.972 -17.002
   60    HD2  LYS   8           HD2      LYS   8  82.455   3.034 -14.615
   61    HD3  LYS   8           HD3      LYS   8  83.167   2.868 -16.219
   62    HE2  LYS   8           HE2      LYS   8  82.235   4.824 -16.851
   63    HE3  LYS   8           HE3      LYS   8  80.629   4.202 -16.476
   64    HZ1  LYS   8           HZ1      LYS   8  81.296   6.220 -15.206
   65    HZ2  LYS   8           HZ2      LYS   8  82.479   5.281 -14.426
   66    HZ3  LYS   8           HZ3      LYS   8  80.833   4.905 -14.241
   67    H    ILE   9           H        ILE   9  80.996   2.588 -12.268
   68    HA   ILE   9           HA       ILE   9  83.807   2.263 -12.466
   69    HB   ILE   9           HB       ILE   9  82.155   3.511 -10.260
   70   HG12  ILE   9          HG12      ILE   9  83.607   4.924 -12.504
   71   HG13  ILE   9          HG13      ILE   9  81.938   4.382 -12.689
   72   HG21  ILE   9          HG21      ILE   9  84.298   4.785  -9.867
   73   HG22  ILE   9          HG22      ILE   9  85.094   3.672 -10.981
   74   HG23  ILE   9          HG23      ILE   9  84.397   3.068  -9.477
   75   HD11  ILE   9          HD11      ILE   9  82.008   6.721 -11.917
   76   HD12  ILE   9          HD12      ILE   9  82.964   6.235 -10.518
   77   HD13  ILE   9          HD13      ILE   9  81.299   5.680 -10.682
   78    H    PHE  10           H        PHE  10  81.364   0.632 -10.637
   79    HA   PHE  10           HA       PHE  10  83.184  -0.391  -8.634
   80    HB2  PHE  10           HB2      PHE  10  81.044  -0.227  -7.764
   81    HB3  PHE  10           HB1      PHE  10  80.280  -0.741  -9.267
   82    HD1  PHE  10           HD1      PHE  10  80.215  -3.119  -9.902
   83    HD2  PHE  10           HD2      PHE  10  81.884  -1.847  -6.159
   84    HE1  PHE  10           HE1      PHE  10  80.154  -5.457  -9.087
   85    HE2  PHE  10           HE2      PHE  10  81.824  -4.189  -5.339
   86    HZ   PHE  10           HZ       PHE  10  80.960  -5.994  -6.808
   87    H    VAL  11           H        VAL  11  81.353  -1.870 -11.330
   88    HA   VAL  11           HA       VAL  11  82.317  -4.464 -11.081
   89    HB   VAL  11           HB       VAL  11  81.794  -4.717 -13.494
   90   HG11  VAL  11          HG11      VAL  11  79.696  -3.024 -12.136
   91   HG12  VAL  11          HG12      VAL  11  80.055  -4.669 -11.613
   92   HG13  VAL  11          HG13      VAL  11  79.456  -4.372 -13.244
   93   HG21  VAL  11          HG21      VAL  11  82.603  -2.514 -14.239
   94   HG22  VAL  11          HG22      VAL  11  81.327  -1.729 -13.310
   95   HG23  VAL  11          HG23      VAL  11  80.914  -2.736 -14.695
   96    H    GLN  12           H        GLN  12  83.823  -1.651 -12.520
   97    HA   GLN  12           HA       GLN  12  86.008  -3.304 -13.571
   98    HB2  GLN  12           HB2      GLN  12  86.728  -1.338 -14.737
   99    HB3  GLN  12           HB1      GLN  12  84.984  -1.497 -14.947
  100    HG2  GLN  12           HG2      GLN  12  84.722   0.068 -12.956
  101    HG3  GLN  12           HG1      GLN  12  86.455   0.374 -13.081
  102   HE21  GLN  12          HE21      GLN  12  85.731  -0.200 -16.189
  103   HE22  GLN  12          HE22      GLN  12  85.300   1.354 -16.707
  104    H    LYS  13           H        LYS  13  85.370  -1.111 -10.912
  105    HA   LYS  13           HA       LYS  13  88.255  -0.956 -10.352
  106    HB2  LYS  13           HB2      LYS  13  86.678   1.084 -10.396
  107    HB3  LYS  13           HB3      LYS  13  86.153   0.527  -8.807
  108    HG2  LYS  13           HG2      LYS  13  88.381   0.701  -7.922
  109    HG3  LYS  13           HG3      LYS  13  89.067   0.959  -9.524
  110    HD2  LYS  13           HD2      LYS  13  86.962   2.868  -8.577
  111    HD3  LYS  13           HD3      LYS  13  88.581   3.013  -7.896
  112    HE2  LYS  13           HE2      LYS  13  89.560   3.422 -10.014
  113    HE3  LYS  13           HE3      LYS  13  88.141   2.830 -10.877
  114    HZ1  LYS  13           HZ1      LYS  13  86.988   4.761  -9.578
  115    HZ2  LYS  13           HZ2      LYS  13  87.826   5.070 -11.024
  116    HZ3  LYS  13           HZ3      LYS  13  88.559   5.398  -9.527
  117    H    CYS  14           H        CYS  14  85.344  -1.356  -8.260
  118    HA   CYS  14           HA       CYS  14  87.004  -2.590  -6.239
  119    HB2  CYS  14           HB2      CYS  14  84.025  -2.488  -6.070
  120    HB3  CYS  14           HB1      CYS  14  85.213  -2.351  -4.781
  121    H    ALA  15           H        ALA  15  84.509  -3.792  -8.453
  122    HA   ALA  15           HA       ALA  15  83.995  -6.256  -7.352
  123    HB1  ALA  15           HB1      ALA  15  84.245  -5.359 -10.205
  124    HB2  ALA  15           HB2      ALA  15  82.793  -5.780  -9.296
  125    HB3  ALA  15           HB3      ALA  15  83.898  -7.046  -9.827
  126    H    GLN  16           H        GLN  16  86.939  -5.148  -8.833
  127    HA   GLN  16           HA       GLN  16  88.227  -7.437  -9.603
  128    HB2  GLN  16           HB2      GLN  16  89.082  -4.828  -8.521
  129    HB3  GLN  16           HB1      GLN  16  90.274  -6.118  -8.377
  130    HG2  GLN  16           HG2      GLN  16  90.040  -6.596 -10.791
  131    HG3  GLN  16           HG1      GLN  16  88.862  -5.292 -10.932
  132   HE21  GLN  16          HE21      GLN  16  89.833  -3.111  -9.830
  133   HE22  GLN  16          HE22      GLN  16  91.412  -2.740 -10.329
  134    H    CYS  17           H        CYS  17  88.502  -6.087  -6.280
  135    HA   CYS  17           HA       CYS  17  88.950  -8.861  -5.333
  136    HB2  CYS  17           HB2      CYS  17  90.101  -6.673  -3.710
  137    HB3  CYS  17           HB1      CYS  17  90.779  -8.240  -4.132
  138    H    HIS  18           H        HSD  18  86.361  -8.062  -5.360
  139    HA   HIS  18           HA       HSD  18  85.749  -8.020  -2.530
  140    HB2  HIS  18           HB2      HSD  18  85.117  -5.668  -4.297
  141    HB3  HIS  18           HB1      HSD  18  84.128  -6.043  -2.886
  142    HD1  HIS  18           HD1      HSD  18  86.529  -7.054  -1.064
  143    HD2  HIS  18           HD2      HSD  18  86.443  -3.458  -3.174
  144    HE1  HIS  18           HE1      HSD  18  88.163  -5.500   0.096
  145    H    THR  19           H        THR  19  83.193  -7.743  -2.340
  146    HA   THR  19           HA       THR  19  81.899  -9.286  -4.499
  147    HB   THR  19           HB       THR  19  80.839 -10.097  -1.955
  148    HG1  THR  19           HG1      THR  19  83.112 -11.216  -1.650
  149   HG21  THR  19          HG21      THR  19  80.839 -11.342  -4.139
  150   HG22  THR  19          HG22      THR  19  81.396 -12.304  -2.769
  151   HG23  THR  19          HG23      THR  19  82.563 -11.638  -3.910
  152    H    VAL  20           H        VAL  20  81.561  -7.231  -1.650
  153    HA   VAL  20           HA       VAL  20  79.810  -5.938  -0.890
  154    HB   VAL  20           HB       VAL  20  79.125  -4.255  -2.474
  155   HG11  VAL  20          HG11      VAL  20  81.947  -5.100  -3.181
  156   HG12  VAL  20          HG12      VAL  20  81.519  -4.332  -1.654
  157   HG13  VAL  20          HG13      VAL  20  81.288  -3.466  -3.171
  158   HG21  VAL  20          HG21      VAL  20  80.389  -5.916  -4.654
  159   HG22  VAL  20          HG22      VAL  20  79.411  -4.463  -4.830
  160   HG23  VAL  20          HG23      VAL  20  78.661  -5.971  -4.316
  161    H    GLU  21           H        GLU  21  79.065  -8.705  -1.772
  162    HA   GLU  21           HA       GLU  21  76.189  -8.171  -2.245
  163    HB2  GLU  21           HB2      GLU  21  76.006 -10.060  -3.644
  164    HB3  GLU  21           HB3      GLU  21  77.481  -9.257  -4.181
  165    HG2  GLU  21           HG2      GLU  21  78.692 -10.815  -2.496
  166    HG3  GLU  21           HG3      GLU  21  77.200 -11.755  -2.518
  167    H    LYS  22           H        LYS  22  74.978  -8.734  -0.579
  168    HA   LYS  22           HA       LYS  22  75.940 -10.055   1.708
  169    HB2  LYS  22           HB2      LYS  22  73.979  -8.555   1.707
  170    HB3  LYS  22           HB3      LYS  22  73.073  -9.750   0.783
  171    HG2  LYS  22           HG2      LYS  22  74.353 -10.815   3.233
  172    HG3  LYS  22           HG3      LYS  22  73.096  -9.615   3.526
  173    HD2  LYS  22           HD2      LYS  22  71.539 -10.911   2.098
  174    HD3  LYS  22           HD3      LYS  22  72.792 -12.127   1.854
  175    HE2  LYS  22           HE2      LYS  22  71.903 -11.326   4.624
  176    HE3  LYS  22           HE3      LYS  22  71.056 -12.576   3.712
  177    HZ1  LYS  22           HZ1      LYS  22  72.726 -14.016   3.979
  178    HZ2  LYS  22           HZ2      LYS  22  73.207 -13.009   5.260
  179    HZ3  LYS  22           HZ3      LYS  22  73.929 -12.846   3.731
  180    H    GLY  23           H        GLY  23  75.983 -12.144   2.338
  181    HA2  GLY  23           HA2      GLY  23  75.674 -14.432   2.305
  182    HA3  GLY  23           HA3      GLY  23  74.415 -14.201   1.096
  183    H    GLY  24           H        GLY  24  77.544 -12.826   0.526
  184    HA2  GLY  24           HA2      GLY  24  77.941 -14.698  -1.707
  185    HA3  GLY  24           HA3      GLY  24  78.738 -13.141  -1.502
  186    H    LYS  25           H        LYS  25  80.836 -13.797  -1.635
  187    HA   LYS  25           HA       LYS  25  81.906 -15.188   0.689
  188    HB2  LYS  25           HB2      LYS  25  83.298 -16.674  -0.862
  189    HB3  LYS  25           HB3      LYS  25  81.601 -17.109  -0.665
  190    HG2  LYS  25           HG2      LYS  25  81.077 -15.853  -2.761
  191    HG3  LYS  25           HG3      LYS  25  82.801 -15.552  -2.975
  192    HD2  LYS  25           HD2      LYS  25  83.148 -18.062  -2.887
  193    HD3  LYS  25           HD3      LYS  25  81.394 -18.232  -2.961
  194    HE2  LYS  25           HE2      LYS  25  81.280 -17.237  -5.119
  195    HE3  LYS  25           HE3      LYS  25  82.930 -16.621  -5.006
  196    HZ1  LYS  25           HZ1      LYS  25  82.844 -18.577  -6.399
  197    HZ2  LYS  25           HZ2      LYS  25  82.141 -19.481  -5.143
  198    HZ3  LYS  25           HZ3      LYS  25  83.733 -18.906  -4.992
  199    H    HIS  26           H        HIS  26  83.480 -13.906   1.371
  200    HA   HIS  26           HA       HIS  26  84.619 -11.795  -0.040
  201    HB2  HIS  26           HB2      HIS  26  86.552 -12.176   1.716
  202    HB3  HIS  26           HB1      HIS  26  84.959 -11.644   2.248
  203    HD1  HIS  26           HD1      HIS  26  86.617 -15.024   1.557
  204    HD2  HIS  26           HD2      HIS  26  84.059 -13.222   4.313
  205    HE1  HIS  26           HE1      HIS  26  86.075 -16.788   3.292
  206    HE2  HIS  26           HE2      HIS  26  84.516 -15.705   4.979
  207    H    LYS  27           H        LYS  27  86.032 -11.695  -1.646
  208    HA   LYS  27           HA       LYS  27  87.871 -13.976  -2.087
  209    HB2  LYS  27           HB2      LYS  27  87.658 -13.265  -4.567
  210    HB3  LYS  27           HB3      LYS  27  86.331 -14.180  -3.853
  211    HG2  LYS  27           HG2      LYS  27  84.990 -12.232  -3.583
  212    HG3  LYS  27           HG3      LYS  27  86.358 -11.159  -3.875
  213    HD2  LYS  27           HD2      LYS  27  84.955 -11.249  -5.874
  214    HD3  LYS  27           HD3      LYS  27  86.502 -12.027  -6.207
  215    HE2  LYS  27           HE2      LYS  27  85.566 -14.201  -6.064
  216    HE3  LYS  27           HE3      LYS  27  84.106 -13.609  -5.268
  217    HZ1  LYS  27           HZ1      LYS  27  83.171 -13.326  -7.237
  218    HZ2  LYS  27           HZ2      LYS  27  84.555 -13.950  -7.998
  219    HZ3  LYS  27           HZ3      LYS  27  84.414 -12.279  -7.722
  220    H    THR  28           H        THR  28  89.967 -13.441  -2.175
  221    HA   THR  28           HA       THR  28  91.828 -12.086  -1.913
  222    HB   THR  28           HB       THR  28  90.697 -10.537  -4.234
  223    HG1  THR  28           HG1      THR  28  91.319 -12.245  -5.546
  224   HG21  THR  28          HG21      THR  28  92.941 -10.235  -4.840
  225   HG22  THR  28          HG22      THR  28  93.477 -11.644  -3.925
  226   HG23  THR  28          HG23      THR  28  93.020 -10.166  -3.080
  227    H    GLY  29           H        GLY  29  89.378 -11.251  -0.485
  228    HA2  GLY  29           HA2      GLY  29  90.199  -8.987   0.804
  229    HA3  GLY  29           HA3      GLY  29  89.254  -8.378  -0.553
  230    HA   PRO  30           HA       PRO  30  86.557  -9.993   3.069
  231    HB2  PRO  30           HB2      PRO  30  86.026  -7.633   4.364
  232    HB3  PRO  30           HB1      PRO  30  87.366  -8.710   4.804
  233    HG2  PRO  30           HG2      PRO  30  87.404  -6.207   3.189
  234    HG3  PRO  30           HG1      PRO  30  88.562  -6.790   4.397
  235    HD2  PRO  30           HD2      PRO  30  89.000  -7.002   1.704
  236    HD3  PRO  30           HD1      PRO  30  89.660  -8.157   2.885
  237    H    ASN  31           H        ASN  31  84.282  -8.968   3.649
  238    HA   ASN  31           HA       ASN  31  83.073  -8.136   1.092
  239    HB2  ASN  31           HB2      ASN  31  81.017  -9.006   1.942
  240    HB3  ASN  31           HB1      ASN  31  82.257 -10.191   2.345
  241   HD21  ASN  31          HD21      ASN  31  80.101 -10.434   3.937
  242   HD22  ASN  31          HD22      ASN  31  80.350  -9.736   5.464
  243    H    LEU  32           H        LEU  32  81.284  -6.533   1.228
  244    HA   LEU  32           HA       LEU  32  81.843  -4.492   3.305
  245    HB2  LEU  32           HB2      LEU  32  80.708  -3.966   0.556
  246    HB3  LEU  32           HB3      LEU  32  81.277  -2.782   1.723
  247    HG   LEU  32           HG       LEU  32  82.923  -4.751   0.121
  248   HD11  LEU  32          HD11      LEU  32  83.363  -1.786   0.445
  249   HD12  LEU  32          HD12      LEU  32  82.151  -2.385  -0.684
  250   HD13  LEU  32          HD13      LEU  32  83.842  -2.836  -0.889
  251   HD21  LEU  32          HD21      LEU  32  84.830  -3.465   1.440
  252   HD22  LEU  32          HD22      LEU  32  84.074  -4.889   2.142
  253   HD23  LEU  32          HD23      LEU  32  83.574  -3.285   2.660
  254    H    HIS  33           H        HIS  33  79.959  -6.692   3.559
  255    HA   HIS  33           HA       HIS  33  77.303  -5.938   3.011
  256    HB2  HIS  33           HB2      HIS  33  78.378  -7.616   5.294
  257    HB3  HIS  33           HB1      HIS  33  76.691  -7.543   4.787
  258    HD1  HIS  33           HD1      HIS  33  78.033 -10.249   4.624
  259    HD2  HIS  33           HD2      HIS  33  78.123  -7.523   1.471
  260    HE1  HIS  33           HE1      HIS  33  78.476 -11.596   2.526
  261    HE2  HIS  33           HE2      HIS  33  78.530  -9.950   0.594
  262    H    GLY  34           H        GLY  34  75.813  -4.706   4.105
  263    HA2  GLY  34           HA2      GLY  34  75.264  -2.775   5.313
  264    HA3  GLY  34           HA3      GLY  34  75.584  -3.879   6.648
  265    H    LEU  35           H        LEU  35  78.019  -2.788   4.396
  266    HA   LEU  35           HA       LEU  35  79.998  -2.172   6.172
  267    HB2  LEU  35           HB2      LEU  35  80.380  -2.247   3.781
  268    HB3  LEU  35           HB3      LEU  35  79.346  -0.844   3.534
  269    HG   LEU  35           HG       LEU  35  81.087   0.241   5.282
  270   HD11  LEU  35          HD11      LEU  35  82.904  -1.550   3.700
  271   HD12  LEU  35          HD12      LEU  35  82.272  -2.085   5.256
  272   HD13  LEU  35          HD13      LEU  35  83.258  -0.625   5.156
  273   HD21  LEU  35          HD21      LEU  35  80.519   0.961   2.913
  274   HD22  LEU  35          HD22      LEU  35  81.809  -0.109   2.362
  275   HD23  LEU  35          HD23      LEU  35  82.186   1.263   3.404
  276    H    PHE  36           H        PHE  36  77.812   0.239   4.725
  277    HA   PHE  36           HA       PHE  36  78.658   2.450   6.163
  278    HB2  PHE  36           HB2      PHE  36  75.800   1.928   5.325
  279    HB3  PHE  36           HB1      PHE  36  76.580   3.494   5.551
  280    HD1  PHE  36           HD2      PHE  36  76.585   0.406   3.466
  281    HD2  PHE  36           HD1      PHE  36  77.914   4.481   3.821
  282    HE1  PHE  36           HE2      PHE  36  77.376   0.357   1.118
  283    HE2  PHE  36           HE1      PHE  36  78.693   4.429   1.477
  284    HZ   PHE  36           HZ       PHE  36  78.426   2.370   0.120
  285    H    GLY  37           H        GLY  37  79.067   1.980   8.351
  286    HA2  GLY  37           HA2      GLY  37  77.596   2.738  10.347
  287    HA3  GLY  37           HA3      GLY  37  76.731   1.252  10.001
  288    H    ARG  38           H        ARG  38  79.337  -0.119   9.285
  289    HA   ARG  38           HA       ARG  38  79.970  -0.902  12.025
  290    HB2  ARG  38           HB2      ARG  38  80.294  -2.081   9.336
  291    HB3  ARG  38           HB3      ARG  38  81.582  -2.457  10.479
  292    HG2  ARG  38           HG2      ARG  38  79.751  -3.105  12.136
  293    HG3  ARG  38           HG3      ARG  38  78.618  -2.997  10.790
  294    HD2  ARG  38           HD2      ARG  38  81.083  -4.611  10.339
  295    HD3  ARG  38           HD3      ARG  38  79.885  -5.287  11.434
  296    HE   ARG  38           HE       ARG  38  78.323  -4.658   9.379
  297   HH11  ARG  38          HH21      ARG  38  81.488  -6.084   9.433
  298   HH12  ARG  38          HH22      ARG  38  81.250  -6.981   7.972
  299   HH21  ARG  38          HH11      ARG  38  78.015  -5.852   7.477
  300   HH22  ARG  38          HH12      ARG  38  79.289  -6.858   6.873
  301    H    LYS  39           H        LYS  39  82.126  -1.110  12.826
  302    HA   LYS  39           HA       LYS  39  83.758   1.194  12.256
  303    HB2  LYS  39           HB2      LYS  39  83.791  -1.026  14.255
  304    HB3  LYS  39           HB3      LYS  39  85.274  -0.108  13.998
  305    HG2  LYS  39           HG2      LYS  39  82.688   1.373  14.399
  306    HG3  LYS  39           HG3      LYS  39  83.516   0.696  15.801
  307    HD2  LYS  39           HD2      LYS  39  85.601   1.894  15.086
  308    HD3  LYS  39           HD3      LYS  39  84.673   2.657  13.797
  309    HE2  LYS  39           HE2      LYS  39  84.497   4.273  15.456
  310    HE3  LYS  39           HE3      LYS  39  83.055   3.317  15.791
  311    HZ1  LYS  39           HZ1      LYS  39  85.646   3.304  17.202
  312    HZ2  LYS  39           HZ2      LYS  39  84.592   1.976  17.305
  313    HZ3  LYS  39           HZ3      LYS  39  84.089   3.508  17.841
  314    H    THR  40           H        THR  40  86.139   0.986  11.941
  315    HA   THR  40           HA       THR  40  86.734  -0.418   9.583
  316    HB   THR  40           HB       THR  40  89.148   0.157  10.220
  317    HG1  THR  40           HG1      THR  40  87.916   1.759  12.169
  318   HG21  THR  40          HG21      THR  40  88.704   2.609   9.904
  319   HG22  THR  40          HG22      THR  40  86.984   2.268  10.090
  320   HG23  THR  40          HG23      THR  40  87.878   1.581   8.734
  321    H    GLY  41           H        GLY  41  87.893  -2.254   9.148
  322    HA2  GLY  41           HA2      GLY  41  88.413  -4.476   9.467
  323    HA3  GLY  41           HA3      GLY  41  89.423  -3.840  10.762
  324    H    GLN  42           H        GLN  42  85.899  -4.140  10.343
  325    HA   GLN  42           HA       GLN  42  85.800  -5.508  12.970
  326    HB2  GLN  42           HB2      GLN  42  84.652  -3.319  12.904
  327    HB3  GLN  42           HB1      GLN  42  83.628  -3.911  11.595
  328    HG2  GLN  42           HG2      GLN  42  82.570  -5.506  12.984
  329    HG3  GLN  42           HG1      GLN  42  83.827  -5.396  14.214
  330   HE21  GLN  42          HE21      GLN  42  81.672  -3.013  12.550
  331   HE22  GLN  42          HE22      GLN  42  81.193  -2.240  13.984
  332    H    ALA  43           H        ALA  43  85.134  -5.804   9.605
  333    HA   ALA  43           HA       ALA  43  83.059  -7.704   9.675
  334    HB1  ALA  43           HB1      ALA  43  83.240  -7.292   7.478
  335    HB2  ALA  43           HB2      ALA  43  84.689  -8.294   7.447
  336    HB3  ALA  43           HB3      ALA  43  84.825  -6.555   7.710
  337    HA   PRO  44           HA       PRO  44  85.603 -11.038  11.315
  338    HB2  PRO  44           HB2      PRO  44  83.634 -12.852  11.691
  339    HB3  PRO  44           HB1      PRO  44  83.805 -11.426  12.734
  340    HG2  PRO  44           HG2      PRO  44  81.928 -11.893  10.464
  341    HG3  PRO  44           HG1      PRO  44  81.630 -11.122  12.032
  342    HD2  PRO  44           HD2      PRO  44  82.086  -9.723   9.694
  343    HD3  PRO  44           HD1      PRO  44  82.409  -9.076  11.319
  344    H    GLY  45           H        GLY  45  86.902 -12.003   9.829
  345    HA2  GLY  45           HA2      GLY  45  86.373 -14.316   8.494
  346    HA3  GLY  45           HA3      GLY  45  85.883 -13.072   7.349
  347    H    PHE  46           H        PHE  46  87.487 -11.509   6.661
  348    HA   PHE  46           HA       PHE  46  90.015 -12.730   6.117
  349    HB2  PHE  46           HB2      PHE  46  88.669 -11.018   4.695
  350    HB3  PHE  46           HB1      PHE  46  89.443  -9.804   5.712
  351    HD1  PHE  46           HD2      PHE  46  90.113 -12.652   3.408
  352    HD2  PHE  46           HD1      PHE  46  91.728  -9.206   5.399
  353    HE1  PHE  46           HE2      PHE  46  92.180 -12.837   2.050
  354    HE2  PHE  46           HE1      PHE  46  93.795  -9.391   4.042
  355    HZ   PHE  46           HZ       PHE  46  94.022 -11.207   2.369
  356    H    THR  47           H        THR  47  92.101 -11.916   6.694
  357    HA   THR  47           HA       THR  47  92.256 -11.121   9.468
  358    HB   THR  47           HB       THR  47  94.559 -11.386   7.539
  359    HG1  THR  47           HG1      THR  47  93.152 -13.236   7.516
  360   HG21  THR  47          HG21      THR  47  94.365 -11.977  10.500
  361   HG22  THR  47          HG22      THR  47  94.884 -10.418   9.856
  362   HG23  THR  47          HG23      THR  47  95.829 -11.869   9.522
  363    H    TYR  48           H        TYR  48  91.315  -9.020   9.369
  364    HA   TYR  48           HA       TYR  48  92.204  -6.920   7.724
  365    HB2  TYR  48           HB2      TYR  48  90.707  -7.131  10.293
  366    HB3  TYR  48           HB3      TYR  48  91.361  -5.552   9.866
  367    HD1  TYR  48           HD2      TYR  48  90.824  -4.578   7.591
  368    HD2  TYR  48           HD1      TYR  48  88.767  -7.978   9.215
  369    HE1  TYR  48           HE2      TYR  48  88.967  -4.216   5.991
  370    HE2  TYR  48           HE1      TYR  48  86.907  -7.616   7.615
  371    HH   TYR  48           HH       TYR  48  86.472  -4.787   5.929
  372    H    THR  49           H        THR  49  93.541  -5.113   8.213
  373    HA   THR  49           HA       THR  49  95.972  -5.863   9.597
  374    HB   THR  49           HB       THR  49  96.816  -3.698   8.786
  375    HG1  THR  49           HG1      THR  49  94.327  -3.319   7.532
  376   HG21  THR  49          HG21      THR  49  96.265  -4.120   6.292
  377   HG22  THR  49          HG22      THR  49  95.319  -5.490   6.877
  378   HG23  THR  49          HG23      THR  49  97.053  -5.418   7.188
  379    H    ASP  50           H        ASP  50  96.943  -4.615  11.295
  380    HA   ASP  50           HA       ASP  50  95.320  -4.112  13.490
  381    HB2  ASP  50           HB2      ASP  50  97.777  -4.437  13.594
  382    HB3  ASP  50           HB1      ASP  50  97.998  -2.832  12.898
  383    H    ALA  51           H        ALA  51  96.613  -1.802  11.117
  384    HA   ALA  51           HA       ALA  51  95.705   0.570  12.238
  385    HB1  ALA  51           HB1      ALA  51  97.134   0.589  10.292
  386    HB2  ALA  51           HB2      ALA  51  95.634   1.425   9.888
  387    HB3  ALA  51           HB3      ALA  51  95.903  -0.226   9.326
  388    H    ASN  52           H        ASN  52  93.966  -1.764  10.220
  389    HA   ASN  52           HA       ASN  52  91.541  -0.177  10.216
  390    HB2  ASN  52           HB2      ASN  52  92.525  -2.621   8.917
  391    HB3  ASN  52           HB1      ASN  52  90.830  -2.716   9.383
  392   HD21  ASN  52          HD21      ASN  52  90.197  -2.604   7.090
  393   HD22  ASN  52          HD22      ASN  52  90.261  -1.126   6.253
  394    H    LYS  53           H        LYS  53  92.968  -2.675  12.137
  395    HA   LYS  53           HA       LYS  53  90.476  -3.389  13.455
  396    HB2  LYS  53           HB2      LYS  53  91.636  -5.284  13.835
  397    HB3  LYS  53           HB3      LYS  53  93.088  -4.550  13.166
  398    HG2  LYS  53           HG2      LYS  53  93.606  -3.563  15.377
  399    HG3  LYS  53           HG3      LYS  53  92.153  -4.313  16.045
  400    HD2  LYS  53           HD2      LYS  53  93.014  -6.527  15.605
  401    HD3  LYS  53           HD3      LYS  53  94.391  -5.866  14.722
  402    HE2  LYS  53           HE2      LYS  53  95.256  -4.831  16.745
  403    HE3  LYS  53           HE3      LYS  53  93.825  -5.323  17.650
  404    HZ1  LYS  53           HZ1      LYS  53  94.418  -7.649  17.147
  405    HZ2  LYS  53           HZ2      LYS  53  95.590  -6.855  18.087
  406    HZ3  LYS  53           HZ3      LYS  53  95.856  -7.109  16.429
  407    H    ASN  54           H        ASN  54  92.772  -0.964  13.621
  408    HA   ASN  54           HA       ASN  54  92.937  -0.474  16.403
  409    HB2  ASN  54           HB2      ASN  54  94.024   1.472  15.810
  410    HB3  ASN  54           HB1      ASN  54  94.266   0.517  14.354
  411   HD21  ASN  54          HD21      ASN  54  91.570   0.801  13.291
  412   HD22  ASN  54          HD22      ASN  54  91.372   2.425  12.842
  413    H    LYS  55           H        LYS  55  90.456  -0.048  14.111
  414    HA   LYS  55           HA       LYS  55  88.347   0.883  14.211
  415    HB2  LYS  55           HB2      LYS  55  88.920   0.441  17.141
  416    HB3  LYS  55           HB3      LYS  55  87.371   1.050  16.556
  417    HG2  LYS  55           HG2      LYS  55  87.199  -0.961  15.072
  418    HG3  LYS  55           HG3      LYS  55  88.673  -1.585  15.812
  419    HD2  LYS  55           HD2      LYS  55  87.648  -1.880  17.909
  420    HD3  LYS  55           HD3      LYS  55  86.327  -0.776  17.524
  421    HE2  LYS  55           HE2      LYS  55  85.499  -2.389  15.827
  422    HE3  LYS  55           HE3      LYS  55  86.790  -3.503  16.278
  423    HZ1  LYS  55           HZ1      LYS  55  85.669  -2.880  18.656
  424    HZ2  LYS  55           HZ2      LYS  55  85.327  -4.278  17.750
  425    HZ3  LYS  55           HZ3      LYS  55  84.320  -2.915  17.628
  426    H    GLY  56           H        GLY  56  89.795   2.803  13.436
  427    HA2  GLY  56           HA2      GLY  56  89.929   4.996  15.359
  428    HA3  GLY  56           HA3      GLY  56  90.543   5.014  13.709
  429    H    ILE  57           H        ILE  57  88.112   4.100  12.453
  430    HA   ILE  57           HA       ILE  57  86.147   6.182  13.122
  431    HB   ILE  57           HB       ILE  57  86.073   7.062  10.889
  432   HG12  ILE  57          HG12      ILE  57  87.993   6.171   9.304
  433   HG13  ILE  57          HG13      ILE  57  87.897   4.732  10.312
  434   HG21  ILE  57          HG21      ILE  57  88.235   8.125  10.770
  435   HG22  ILE  57          HG22      ILE  57  88.991   6.803  11.661
  436   HG23  ILE  57          HG23      ILE  57  87.856   7.880  12.476
  437   HD11  ILE  57          HD11      ILE  57  86.359   5.108   8.113
  438   HD12  ILE  57          HD12      ILE  57  85.294   5.794   9.335
  439   HD13  ILE  57          HD13      ILE  57  85.848   4.129   9.480
  440    H    THR  58           H        THR  58  84.200   5.957  11.583
  441    HA   THR  58           HA       THR  58  83.606   3.077  11.265
  442    HB   THR  58           HB       THR  58  81.721   5.367  11.859
  443    HG1  THR  58           HG1      THR  58  83.258   4.342  13.496
  444   HG21  THR  58          HG21      THR  58  80.718   3.557  10.475
  445   HG22  THR  58          HG22      THR  58  80.021   3.624  12.093
  446   HG23  THR  58          HG23      THR  58  81.209   2.386  11.698
  447    H    TRP  59           H        TRP  59  82.720   2.348   9.377
  448    HA   TRP  59           HA       TRP  59  83.110   3.901   7.027
  449    HB2  TRP  59           HB2      TRP  59  81.316   1.483   7.192
  450    HB3  TRP  59           HB1      TRP  59  82.261   2.061   5.819
  451    HD1  TRP  59           HD1      TRP  59  85.041   2.478   7.204
  452    HE1  TRP  59           HE1      TRP  59  86.421   0.431   7.965
  453    HE3  TRP  59           HE3      TRP  59  81.341  -1.012   7.564
  454    HZ2  TRP  59           HZ2      TRP  59  85.994  -2.312   8.670
  455    HZ3  TRP  59           HZ3      TRP  59  81.850  -3.327   8.275
  456    HH2  TRP  59           HH2      TRP  59  84.172  -3.980   8.828
  457    H    LYS  60           H        LYS  60  81.727   5.108   5.855
  458    HA   LYS  60           HA       LYS  60  78.867   5.065   6.323
  459    HB2  LYS  60           HB2      LYS  60  80.556   7.463   7.078
  460    HB3  LYS  60           HB3      LYS  60  78.810   7.530   6.847
  461    HG2  LYS  60           HG2      LYS  60  78.667   5.621   8.560
  462    HG3  LYS  60           HG3      LYS  60  80.351   5.982   8.937
  463    HD2  LYS  60           HD2      LYS  60  78.210   8.119   8.958
  464    HD3  LYS  60           HD3      LYS  60  78.584   7.150  10.383
  465    HE2  LYS  60           HE2      LYS  60  80.982   7.856  10.161
  466    HE3  LYS  60           HE3      LYS  60  80.495   8.941   8.860
  467    HZ1  LYS  60           HZ1      LYS  60  80.547  10.158  10.896
  468    HZ2  LYS  60           HZ2      LYS  60  79.571   9.010  11.679
  469    HZ3  LYS  60           HZ3      LYS  60  78.925   9.976  10.440
  470    H    GLU  61           H        GLU  61  78.252   7.512   5.113
  471    HA   GLU  61           HA       GLU  61  78.801   6.870   2.366
  472    HB2  GLU  61           HB2      GLU  61  76.640   7.851   3.206
  473    HB3  GLU  61           HB3      GLU  61  77.500   9.371   3.462
  474    HG2  GLU  61           HG2      GLU  61  78.118   9.435   1.080
  475    HG3  GLU  61           HG3      GLU  61  77.278   7.907   0.815
  476    H    GLU  62           H        GLU  62  79.445   9.794   4.324
  477    HA   GLU  62           HA       GLU  62  81.205  10.933   2.397
  478    HB2  GLU  62           HB2      GLU  62  80.805  11.509   5.340
  479    HB3  GLU  62           HB3      GLU  62  81.822  12.478   4.274
  480    HG2  GLU  62           HG2      GLU  62  79.932  13.038   2.873
  481    HG3  GLU  62           HG3      GLU  62  78.892  11.917   3.749
  482    H    THR  63           H        THR  63  81.732   9.056   5.363
  483    HA   THR  63           HA       THR  63  84.504   9.271   5.541
  484    HB   THR  63           HB       THR  63  84.433   7.109   6.724
  485    HG1  THR  63           HG1      THR  63  82.065   6.968   5.311
  486   HG21  THR  63          HG21      THR  63  82.225   9.093   7.269
  487   HG22  THR  63          HG22      THR  63  83.807   8.988   8.042
  488   HG23  THR  63          HG23      THR  63  82.586   7.754   8.359
  489    H    LEU  64           H        LEU  64  82.494   7.193   3.537
  490    HA   LEU  64           HA       LEU  64  84.640   5.616   2.515
  491    HB2  LEU  64           HB2      LEU  64  81.763   5.882   2.051
  492    HB3  LEU  64           HB3      LEU  64  82.663   5.549   0.579
  493    HG   LEU  64           HG       LEU  64  83.048   3.937   3.110
  494   HD11  LEU  64          HD11      LEU  64  80.938   3.185   2.732
  495   HD12  LEU  64          HD12      LEU  64  81.656   2.313   1.377
  496   HD13  LEU  64          HD13      LEU  64  80.879   3.872   1.112
  497   HD21  LEU  64          HD21      LEU  64  83.767   2.259   1.241
  498   HD22  LEU  64          HD22      LEU  64  84.877   3.558   1.664
  499   HD23  LEU  64          HD23      LEU  64  83.879   3.688   0.216
  500    H    MET  65           H        MET  65  83.123   8.652   1.565
  501    HA   MET  65           HA       MET  65  84.180   8.842  -1.036
  502    HB2  MET  65           HB2      MET  65  83.466  11.025   0.925
  503    HB3  MET  65           HB1      MET  65  83.819  11.291  -0.781
  504    HG2  MET  65           HG2      MET  65  81.941   9.975  -1.467
  505    HG3  MET  65           HG1      MET  65  81.685   9.378   0.171
  506    HE1  MET  65           HE1      MET  65  81.730  12.406  -2.183
  507    HE2  MET  65           HE2      MET  65  80.172  13.127  -1.785
  508    HE3  MET  65           HE3      MET  65  80.243  11.463  -2.359
  509    H    GLU  66           H        GLU  66  85.416  10.402   1.942
  510    HA   GLU  66           HA       GLU  66  87.788  11.349   0.740
  511    HB2  GLU  66           HB2      GLU  66  88.622  11.610   3.050
  512    HB3  GLU  66           HB3      GLU  66  86.981  12.230   2.879
  513    HG2  GLU  66           HG2      GLU  66  86.162   9.968   3.694
  514    HG3  GLU  66           HG3      GLU  66  87.837   9.598   4.099
  515    H    TYR  67           H        TYR  67  86.857   8.305   2.117
  516    HA   TYR  67           HA       TYR  67  89.520   7.193   2.230
  517    HB2  TYR  67           HB2      TYR  67  87.966   6.333   3.802
  518    HB3  TYR  67           HB3      TYR  67  86.741   6.085   2.568
  519    HD1  TYR  67           HD2      TYR  67  86.981   4.255   0.899
  520    HD2  TYR  67           HD1      TYR  67  89.716   4.721   4.179
  521    HE1  TYR  67           HE2      TYR  67  87.779   1.932   0.562
  522    HE2  TYR  67           HE1      TYR  67  90.514   2.396   3.842
  523    HH   TYR  67           HH       TYR  67  89.736   0.574   1.048
  524    H    LEU  68           H        LEU  68  86.976   7.447  -0.125
  525    HA   LEU  68           HA       LEU  68  87.902   5.280  -1.785
  526    HB2  LEU  68           HB2      LEU  68  85.701   7.244  -1.827
  527    HB3  LEU  68           HB3      LEU  68  86.309   6.808  -3.417
  528    HG   LEU  68           HG       LEU  68  85.526   4.778  -1.308
  529   HD11  LEU  68          HD11      LEU  68  83.571   4.445  -3.004
  530   HD12  LEU  68          HD12      LEU  68  83.951   6.091  -3.516
  531   HD13  LEU  68          HD13      LEU  68  83.480   5.769  -1.848
  532   HD21  LEU  68          HD21      LEU  68  86.572   4.664  -4.097
  533   HD22  LEU  68          HD22      LEU  68  85.312   3.513  -3.672
  534   HD23  LEU  68          HD23      LEU  68  86.815   3.551  -2.755
  535    H    GLU  69           H        GLU  69  88.847   8.534  -1.326
  536    HA   GLU  69           HA       GLU  69  90.095   8.688  -3.993
  537    HB2  GLU  69           HB2      GLU  69  90.598  11.047  -3.323
  538    HB3  GLU  69           HB3      GLU  69  88.874  10.673  -3.368
  539    HG2  GLU  69           HG2      GLU  69  88.813  10.394  -0.967
  540    HG3  GLU  69           HG3      GLU  69  90.562  10.567  -0.856
  541    H    ASN  70           H        ASN  70  90.794   7.811  -0.822
  542    HA   ASN  70           HA       ASN  70  93.549   7.342  -1.394
  543    HB2  ASN  70           HB2      ASN  70  93.211   9.919  -0.763
  544    HB3  ASN  70           HB1      ASN  70  93.293   9.269   0.870
  545   HD21  ASN  70          HD21      ASN  70  95.177   7.200   0.555
  546   HD22  ASN  70          HD22      ASN  70  96.667   7.862   0.084
  547    HA   PRO  71           HA       PRO  71  91.270   4.724   1.758
  548    HB2  PRO  71           HB2      PRO  71  92.865   2.688   0.276
  549    HB3  PRO  71           HB1      PRO  71  91.163   2.652   0.760
  550    HG2  PRO  71           HG2      PRO  71  91.884   3.065  -1.771
  551    HG3  PRO  71           HG1      PRO  71  90.476   3.873  -1.059
  552    HD2  PRO  71           HD2      PRO  71  93.181   4.990  -1.678
  553    HD3  PRO  71           HD1      PRO  71  91.591   5.780  -1.743
  554    H    LYS  72           H        LYS  72  94.654   4.778   0.712
  555    HA   LYS  72           HA       LYS  72  95.611   3.435   3.080
  556    HB2  LYS  72           HB2      LYS  72  96.754   3.274   0.887
  557    HB3  LYS  72           HB3      LYS  72  97.150   4.987   0.991
  558    HG2  LYS  72           HG2      LYS  72  99.092   4.014   1.851
  559    HG3  LYS  72           HG3      LYS  72  98.181   4.333   3.324
  560    HD2  LYS  72           HD2      LYS  72  98.838   2.104   3.624
  561    HD3  LYS  72           HD3      LYS  72  97.220   1.922   2.954
  562    HE2  LYS  72           HE2      LYS  72  98.478   0.436   1.651
  563    HE3  LYS  72           HE3      LYS  72  98.444   1.882   0.646
  564    HZ1  LYS  72           HZ1      LYS  72 100.586   2.437   2.013
  565    HZ2  LYS  72           HZ2      LYS  72 100.662   1.428   0.648
  566    HZ3  LYS  72           HZ3      LYS  72 100.650   0.754   2.208
  567    H    LYS  73           H        LYS  73  95.772   6.782   1.861
  568    HA   LYS  73           HA       LYS  73  97.242   7.852   3.978
  569    HB2  LYS  73           HB2      LYS  73  96.860   9.092   1.916
  570    HB3  LYS  73           HB3      LYS  73  95.136   9.191   2.274
  571    HG2  LYS  73           HG2      LYS  73  95.487  10.611   4.139
  572    HG3  LYS  73           HG3      LYS  73  97.211  10.244   4.197
  573    HD2  LYS  73           HD2      LYS  73  97.684  11.559   2.303
  574    HD3  LYS  73           HD3      LYS  73  96.006  11.545   1.759
  575    HE2  LYS  73           HE2      LYS  73  95.338  13.129   3.352
  576    HE3  LYS  73           HE3      LYS  73  96.718  12.801   4.400
  577    HZ1  LYS  73           HZ1      LYS  73  97.984  13.617   2.236
  578    HZ2  LYS  73           HZ2      LYS  73  97.461  14.689   3.446
  579    HZ3  LYS  73           HZ3      LYS  73  96.543  14.486   2.031
  580    H    TYR  74           H        TYR  74  93.772   7.248   3.700
  581    HA   TYR  74           HA       TYR  74  93.033   8.740   6.002
  582    HB2  TYR  74           HB2      TYR  74  91.604   7.652   4.014
  583    HB3  TYR  74           HB3      TYR  74  91.395   6.380   5.217
  584    HD1  TYR  74           HD1      TYR  74  91.415  10.136   5.067
  585    HD2  TYR  74           HD2      TYR  74  89.574   6.598   6.667
  586    HE1  TYR  74           HE1      TYR  74  89.753  11.537   6.259
  587    HE2  TYR  74           HE2      TYR  74  87.914   8.002   7.858
  588    HH   TYR  74           HH       TYR  74  88.259  11.415   8.139
  589    H    ILE  75           H        ILE  75  93.396   5.213   5.545
  590    HA   ILE  75           HA       ILE  75  93.969   5.011   8.446
  591    HB   ILE  75           HB       ILE  75  92.543   2.935   6.766
  592   HG12  ILE  75          HG12      ILE  75  91.322   4.693   8.906
  593   HG13  ILE  75          HG13      ILE  75  91.299   5.152   7.203
  594   HG21  ILE  75          HG21      ILE  75  93.210   3.204   9.708
  595   HG22  ILE  75          HG22      ILE  75  93.655   1.895   8.612
  596   HG23  ILE  75          HG23      ILE  75  91.976   2.093   9.115
  597   HD11  ILE  75          HD11      ILE  75  89.242   3.891   8.036
  598   HD12  ILE  75          HD12      ILE  75  90.282   2.474   8.175
  599   HD13  ILE  75          HD13      ILE  75  90.021   3.224   6.601
  600    HA   PRO  76           HA       PRO  76  97.637   3.698   5.764
  601    HB2  PRO  76           HB2      PRO  76  98.787   4.428   8.437
  602    HB3  PRO  76           HB1      PRO  76  99.434   4.731   6.813
  603    HG2  PRO  76           HG2      PRO  76  98.236   6.653   8.233
  604    HG3  PRO  76           HG1      PRO  76  98.091   6.557   6.471
  605    HD2  PRO  76           HD2      PRO  76  96.048   5.984   8.546
  606    HD3  PRO  76           HD1      PRO  76  95.831   6.433   6.842
  607    H    GLY  77           H        GLY  77  98.134   1.587   5.671
  608    HA2  GLY  77           HA2      GLY  77  99.138  -0.332   6.861
  609    HA3  GLY  77           HA3      GLY  77  97.980  -0.030   8.154
  610    H    THR  78           H        THR  78  95.814   0.596   6.253
  611    HA   THR  78           HA       THR  78  94.591  -1.901   6.059
  612    HB   THR  78           HB       THR  78  93.360   0.224   5.932
  613    HG1  THR  78           HG1      THR  78  92.006  -1.080   5.019
  614   HG21  THR  78          HG21      THR  78  94.439   0.437   3.119
  615   HG22  THR  78          HG22      THR  78  95.126   1.322   4.482
  616   HG23  THR  78          HG23      THR  78  93.458   1.617   3.989
  617    H    LYS  79           H        LYS  79  94.625  -3.522   4.588
  618    HA   LYS  79           HA       LYS  79  96.679  -3.430   2.541
  619    HB2  LYS  79           HB2      LYS  79  96.316  -5.454   3.908
  620    HB3  LYS  79           HB3      LYS  79  94.703  -5.623   3.214
  621    HG2  LYS  79           HG2      LYS  79  95.506  -6.265   1.139
  622    HG3  LYS  79           HG3      LYS  79  97.009  -5.363   1.322
  623    HD2  LYS  79           HD2      LYS  79  97.463  -7.764   1.441
  624    HD3  LYS  79           HD3      LYS  79  97.774  -7.019   3.007
  625    HE2  LYS  79           HE2      LYS  79  95.646  -7.785   3.869
  626    HE3  LYS  79           HE3      LYS  79  95.162  -8.369   2.276
  627    HZ1  LYS  79           HZ1      LYS  79  97.051  -9.913   2.347
  628    HZ2  LYS  79           HZ2      LYS  79  95.942 -10.194   3.603
  629    HZ3  LYS  79           HZ3      LYS  79  97.408  -9.397   3.922
  630    H    MET  80           H        MET  80  95.945  -1.940   1.001
  631    HA   MET  80           HA       MET  80  94.297  -3.007  -1.047
  632    HB2  MET  80           HB2      MET  80  92.464  -2.413   0.465
  633    HB3  MET  80           HB1      MET  80  93.073  -0.761   0.575
  634    HG2  MET  80           HG2      MET  80  92.655  -0.368  -1.764
  635    HG3  MET  80           HG1      MET  80  92.302  -2.071  -2.045
  636    HE1  MET  80           HE1      MET  80  89.155   0.642  -2.125
  637    HE2  MET  80           HE2      MET  80  90.284  -0.182  -3.197
  638    HE3  MET  80           HE3      MET  80  90.866   1.084  -2.123
  639    H    ILE  81           H        ILE  81  95.955  -2.434  -2.401
  640    HA   ILE  81           HA       ILE  81  96.352   0.469  -2.830
  641    HB   ILE  81           HB       ILE  81  98.377  -1.775  -3.013
  642   HG12  ILE  81          HG12      ILE  81  99.611  -0.147  -1.465
  643   HG13  ILE  81          HG13      ILE  81  98.085   0.720  -1.318
  644   HG21  ILE  81          HG21      ILE  81  98.813  -0.418  -4.915
  645   HG22  ILE  81          HG22      ILE  81  99.916   0.176  -3.673
  646   HG23  ILE  81          HG23      ILE  81  98.438   1.067  -4.039
  647   HD11  ILE  81          HD11      ILE  81  97.742  -2.155  -0.898
  648   HD12  ILE  81          HD12      ILE  81  97.261  -0.805   0.129
  649   HD13  ILE  81          HD13      ILE  81  98.897  -1.452   0.233
  650    H    PHE  82           H        PHE  82  95.435   1.035  -4.699
  651    HA   PHE  82           HA       PHE  82  95.964  -0.529  -7.099
  652    HB2  PHE  82           HB2      PHE  82  93.935  -1.599  -6.326
  653    HB3  PHE  82           HB1      PHE  82  93.156  -0.037  -6.084
  654    HD1  PHE  82           HD1      PHE  82  94.590  -2.307  -8.665
  655    HD2  PHE  82           HD2      PHE  82  92.128   1.127  -7.892
  656    HE1  PHE  82           HE1      PHE  82  93.835  -2.315 -11.027
  657    HE2  PHE  82           HE2      PHE  82  91.373   1.117 -10.254
  658    HZ   PHE  82           HZ       PHE  82  92.227  -0.604 -11.822
  659    H    ALA  83           H        ALA  83  93.411   1.841  -6.435
  660    HA   ALA  83           HA       ALA  83  94.848   4.106  -7.372
  661    HB1  ALA  83           HB1      ALA  83  92.855   2.999  -9.357
  662    HB2  ALA  83           HB2      ALA  83  94.597   2.768  -9.506
  663    HB3  ALA  83           HB3      ALA  83  93.916   4.394  -9.558
  664    H    GLY  84           H        GLY  84  93.917   5.518  -6.035
  665    HA2  GLY  84           HA2      GLY  84  91.288   5.333  -5.021
  666    HA3  GLY  84           HA3      GLY  84  92.314   6.762  -4.948
  667    H    ILE  85           H        ILE  85  89.716   7.249  -5.269
  668    HA   ILE  85           HA       ILE  85  88.990   7.409  -8.076
  669    HB   ILE  85           HB       ILE  85  87.674   8.443  -5.558
  670   HG12  ILE  85          HG12      ILE  85  87.859   5.881  -6.253
  671   HG13  ILE  85          HG13      ILE  85  86.351   6.532  -5.620
  672   HG21  ILE  85          HG21      ILE  85  86.881   8.624  -8.463
  673   HG22  ILE  85          HG22      ILE  85  86.916   9.906  -7.254
  674   HG23  ILE  85          HG23      ILE  85  85.675   8.656  -7.178
  675   HD11  ILE  85          HD11      ILE  85  86.231   5.114  -7.782
  676   HD12  ILE  85          HD12      ILE  85  86.907   6.532  -8.582
  677   HD13  ILE  85          HD13      ILE  85  85.355   6.644  -7.753
  678    H    LYS  86           H        LYS  86  88.430   9.484  -9.097
  679    HA   LYS  86           HA       LYS  86  90.387  11.556  -8.355
  680    HB2  LYS  86           HB2      LYS  86  90.498  10.617 -10.643
  681    HB3  LYS  86           HB3      LYS  86  88.859  11.201 -10.941
  682    HG2  LYS  86           HG2      LYS  86  89.557  13.500 -10.592
  683    HG3  LYS  86           HG3      LYS  86  91.172  12.979 -10.116
  684    HD2  LYS  86           HD2      LYS  86  89.944  12.443 -12.837
  685    HD3  LYS  86           HD3      LYS  86  91.041  13.781 -12.493
  686    HE2  LYS  86           HE2      LYS  86  92.593  12.232 -13.206
  687    HE3  LYS  86           HE3      LYS  86  92.536  11.778 -11.504
  688    HZ1  LYS  86           HZ1      LYS  86  91.976   9.768 -12.229
  689    HZ2  LYS  86           HZ2      LYS  86  91.671  10.319 -13.807
  690    HZ3  LYS  86           HZ3      LYS  86  90.459  10.418 -12.621
  691    H    LYS  87           H        LYS  87  87.199  11.666  -9.977
  692    HA   LYS  87           HA       LYS  87  86.661  14.254  -8.800
  693    HB2  LYS  87           HB2      LYS  87  84.789  12.518 -10.415
  694    HB3  LYS  87           HB3      LYS  87  84.682  14.260 -10.157
  695    HG2  LYS  87           HG2      LYS  87  86.815  14.577 -11.353
  696    HG3  LYS  87           HG3      LYS  87  86.939  12.835 -11.600
  697    HD2  LYS  87           HD2      LYS  87  85.969  13.462 -13.615
  698    HD3  LYS  87           HD3      LYS  87  84.521  13.142 -12.660
  699    HE2  LYS  87           HE2      LYS  87  84.621  15.636 -12.005
  700    HE3  LYS  87           HE3      LYS  87  85.765  15.810 -13.335
  701    HZ1  LYS  87           HZ1      LYS  87  83.809  14.403 -14.492
  702    HZ2  LYS  87           HZ2      LYS  87  83.916  16.098 -14.540
  703    HZ3  LYS  87           HZ3      LYS  87  82.911  15.338 -13.400
  704    H    LYS  88           H        LYS  88  84.620  14.726  -7.682
  705    HA   LYS  88           HA       LYS  88  84.264  12.993  -5.434
  706    HB2  LYS  88           HB2      LYS  88  84.009  15.530  -5.453
  707    HB3  LYS  88           HB3      LYS  88  82.444  15.269  -6.224
  708    HG2  LYS  88           HG2      LYS  88  81.745  13.843  -4.329
  709    HG3  LYS  88           HG3      LYS  88  83.307  14.112  -3.555
  710    HD2  LYS  88           HD2      LYS  88  82.059  15.761  -2.508
  711    HD3  LYS  88           HD3      LYS  88  82.655  16.670  -3.897
  712    HE2  LYS  88           HE2      LYS  88  80.504  15.861  -5.094
  713    HE3  LYS  88           HE3      LYS  88  79.923  15.456  -3.479
  714    HZ1  LYS  88           HZ1      LYS  88  79.418  17.771  -4.400
  715    HZ2  LYS  88           HZ2      LYS  88  81.047  18.122  -4.065
  716    HZ3  LYS  88           HZ3      LYS  88  79.998  17.658  -2.811
  717    H    THR  89           H        THR  89  82.127  13.949  -8.135
  718    HA   THR  89           HA       THR  89  79.917  12.405  -7.484
  719    HB   THR  89           HB       THR  89  79.417  12.375  -9.915
  720    HG1  THR  89           HG1      THR  89  80.905  13.203 -11.321
  721   HG21  THR  89          HG21      THR  89  78.797  14.334  -8.627
  722   HG22  THR  89          HG22      THR  89  79.426  14.869 -10.185
  723   HG23  THR  89          HG23      THR  89  80.436  14.978  -8.743
  724    H    GLU  90           H        GLU  90  83.007  11.429  -8.753
  725    HA   GLU  90           HA       GLU  90  82.229   8.864  -9.715
  726    HB2  GLU  90           HB2      GLU  90  84.862  10.044  -8.832
  727    HB3  GLU  90           HB3      GLU  90  84.724   8.351  -9.299
  728    HG2  GLU  90           HG2      GLU  90  84.084   8.895 -11.510
  729    HG3  GLU  90           HG3      GLU  90  83.697  10.560 -11.078
  730    H    ARG  91           H        ARG  91  83.314  10.142  -6.625
  731    HA   ARG  91           HA       ARG  91  83.366   7.600  -5.284
  732    HB2  ARG  91           HB2      ARG  91  83.235  10.408  -4.147
  733    HB3  ARG  91           HB3      ARG  91  83.636   8.946  -3.251
  734    HG2  ARG  91           HG2      ARG  91  85.555   8.591  -4.839
  735    HG3  ARG  91           HG3      ARG  91  85.210  10.179  -5.522
  736    HD2  ARG  91           HD2      ARG  91  85.316  10.406  -2.653
  737    HD3  ARG  91           HD3      ARG  91  86.769   9.587  -3.216
  738    HE   ARG  91           HE       ARG  91  86.523  11.706  -4.923
  739   HH11  ARG  91          HH21      ARG  91  86.549  11.308  -1.482
  740   HH12  ARG  91          HH22      ARG  91  87.249  12.861  -1.172
  741   HH21  ARG  91          HH11      ARG  91  87.442  13.740  -4.520
  742   HH22  ARG  91          HH12      ARG  91  87.757  14.236  -2.890
  743    H    GLU  92           H        GLU  92  81.171  10.415  -5.227
  744    HA   GLU  92           HA       GLU  92  79.259   9.380  -3.476
  745    HB2  GLU  92           HB2      GLU  92  79.507  11.743  -4.654
  746    HB3  GLU  92           HB3      GLU  92  78.377  11.041  -5.809
  747    HG2  GLU  92           HG2      GLU  92  77.945  11.174  -2.810
  748    HG3  GLU  92           HG3      GLU  92  77.201  12.250  -3.991
  749    H    ASP  93           H        ASP  93  79.253   9.297  -7.054
  750    HA   ASP  93           HA       ASP  93  76.948   7.720  -7.351
  751    HB2  ASP  93           HB2      ASP  93  79.411   7.948  -9.096
  752    HB3  ASP  93           HB1      ASP  93  77.933   7.118  -9.580
  753    H    LEU  94           H        LEU  94  80.373   6.778  -7.227
  754    HA   LEU  94           HA       LEU  94  80.056   4.013  -7.471
  755    HB2  LEU  94           HB2      LEU  94  82.252   5.067  -7.590
  756    HB3  LEU  94           HB3      LEU  94  82.111   5.585  -5.912
  757    HG   LEU  94           HG       LEU  94  82.103   3.289  -5.140
  758   HD11  LEU  94          HD11      LEU  94  80.970   2.040  -6.758
  759   HD12  LEU  94          HD12      LEU  94  82.640   1.534  -7.010
  760   HD13  LEU  94          HD13      LEU  94  81.908   2.726  -8.085
  761   HD21  LEU  94          HD21      LEU  94  84.368   2.715  -5.663
  762   HD22  LEU  94          HD22      LEU  94  84.281   4.474  -5.702
  763   HD23  LEU  94          HD23      LEU  94  84.294   3.557  -7.208
  764    H    ILE  95           H        ILE  95  79.780   6.135  -4.690
  765    HA   ILE  95           HA       ILE  95  79.578   3.993  -2.805
  766    HB   ILE  95           HB       ILE  95  79.240   6.966  -2.665
  767   HG12  ILE  95          HG12      ILE  95  80.940   5.380  -0.804
  768   HG13  ILE  95          HG13      ILE  95  81.419   5.346  -2.496
  769   HG21  ILE  95          HG21      ILE  95  78.287   4.900  -0.707
  770   HG22  ILE  95          HG22      ILE  95  77.566   6.453  -1.130
  771   HG23  ILE  95          HG23      ILE  95  78.987   6.397  -0.089
  772   HD11  ILE  95          HD11      ILE  95  80.743   8.032  -1.469
  773   HD12  ILE  95          HD12      ILE  95  82.090   7.512  -2.479
  774   HD13  ILE  95          HD13      ILE  95  82.163   7.293  -0.735
  775    H    ALA  96           H        ALA  96  77.377   5.815  -4.774
  776    HA   ALA  96           HA       ALA  96  74.980   5.261  -3.377
  777    HB1  ALA  96           HB1      ALA  96  75.339   6.901  -5.312
  778    HB2  ALA  96           HB2      ALA  96  73.853   5.949  -5.348
  779    HB3  ALA  96           HB3      ALA  96  75.215   5.500  -6.375
  780    H    TYR  97           H        TYR  97  76.877   3.486  -5.755
  781    HA   TYR  97           HA       TYR  97  74.947   1.364  -6.036
  782    HB2  TYR  97           HB2      TYR  97  76.386   1.714  -7.909
  783    HB3  TYR  97           HB3      TYR  97  77.829   1.658  -6.896
  784    HD1  TYR  97           HD1      TYR  97  75.034  -0.375  -8.269
  785    HD2  TYR  97           HD2      TYR  97  78.821  -0.425  -6.244
  786    HE1  TYR  97           HE1      TYR  97  75.167  -2.830  -8.580
  787    HE2  TYR  97           HE2      TYR  97  78.952  -2.881  -6.556
  788    HH   TYR  97           HH       TYR  97  77.945  -4.575  -8.250
  789    H    LEU  98           H        LEU  98  78.071   1.765  -4.359
  790    HA   LEU  98           HA       LEU  98  78.308  -0.781  -3.274
  791    HB2  LEU  98           HB2      LEU  98  79.176   1.932  -2.309
  792    HB3  LEU  98           HB3      LEU  98  79.477   0.499  -1.333
  793    HG   LEU  98           HG       LEU  98  80.249   0.484  -4.242
  794   HD11  LEU  98          HD11      LEU  98  82.041   1.518  -2.036
  795   HD12  LEU  98          HD12      LEU  98  81.198   2.568  -3.172
  796   HD13  LEU  98          HD13      LEU  98  82.404   1.428  -3.758
  797   HD21  LEU  98          HD21      LEU  98  80.314  -1.483  -2.467
  798   HD22  LEU  98          HD22      LEU  98  81.798  -0.682  -1.955
  799   HD23  LEU  98          HD23      LEU  98  81.641  -1.271  -3.609
  800    H    LYS  99           H        LYS  99  76.085   1.758  -2.511
  801    HA   LYS  99           HA       LYS  99  75.381   0.741   0.105
  802    HB2  LYS  99           HB2      LYS  99  74.365   2.929  -1.682
  803    HB3  LYS  99           HB3      LYS  99  73.381   2.388  -0.323
  804    HG2  LYS  99           HG2      LYS  99  75.419   2.735   1.155
  805    HG3  LYS  99           HG3      LYS  99  76.189   3.520  -0.223
  806    HD2  LYS  99           HD2      LYS  99  73.504   4.373   0.892
  807    HD3  LYS  99           HD3      LYS  99  75.033   5.101   1.384
  808    HE2  LYS  99           HE2      LYS  99  75.451   5.506  -1.123
  809    HE3  LYS  99           HE3      LYS  99  73.741   5.141  -1.346
  810    HZ1  LYS  99           HZ1      LYS  99  74.943   7.520  -0.398
  811    HZ2  LYS  99           HZ2      LYS  99  73.888   6.899   0.780
  812    HZ3  LYS  99           HZ3      LYS  99  73.319   7.228  -0.787
  813    H    LYS 100           H        LYS 100  73.744   0.899  -3.062
  814    HA   LYS 100           HA       LYS 100  71.557  -0.744  -2.208
  815    HB2  LYS 100           HB2      LYS 100  72.490   0.046  -4.976
  816    HB3  LYS 100           HB3      LYS 100  70.968  -0.770  -4.622
  817    HG2  LYS 100           HG2      LYS 100  70.475   1.167  -3.016
  818    HG3  LYS 100           HG3      LYS 100  71.830   2.002  -3.778
  819    HD2  LYS 100           HD2      LYS 100  70.739   1.739  -5.985
  820    HD3  LYS 100           HD3      LYS 100  69.374   0.940  -5.206
  821    HE2  LYS 100           HE2      LYS 100  70.311   3.775  -4.666
  822    HE3  LYS 100           HE3      LYS 100  68.876   3.320  -5.586
  823    HZ1  LYS 100           HZ1      LYS 100  69.394   2.826  -2.707
  824    HZ2  LYS 100           HZ2      LYS 100  68.092   2.146  -3.560
  825    HZ3  LYS 100           HZ3      LYS 100  68.205   3.831  -3.379
  826    H    ALA 101           H        ALA 101  74.733  -1.376  -3.318
  827    HA   ALA 101           HA       ALA 101  74.150  -4.066  -4.267
  828    HB1  ALA 101           HB1      ALA 101  76.856  -2.809  -3.787
  829    HB2  ALA 101           HB2      ALA 101  75.935  -2.583  -5.274
  830    HB3  ALA 101           HB3      ALA 101  76.477  -4.196  -4.810
  831    H    THR 102           H        THR 102  75.428  -2.461  -1.417
  832    HA   THR 102           HA       THR 102  76.129  -5.017  -0.174
  833    HB   THR 102           HB       THR 102  76.913  -3.603   1.702
  834    HG1  THR 102           HG1      THR 102  75.378  -1.807   0.409
  835   HG21  THR 102          HG21      THR 102  78.530  -4.080   0.022
  836   HG22  THR 102          HG22      THR 102  78.664  -2.349   0.335
  837   HG23  THR 102          HG23      THR 102  77.814  -2.925  -1.099
  838    H    ASN 103           H        ASN 103  73.451  -3.074  -0.560
  839    HA   ASN 103           HA       ASN 103  72.226  -3.811   2.010
  840    HB2  ASN 103           HB2      ASN 103  71.442  -1.912  -0.199
  841    HB3  ASN 103           HB1      ASN 103  70.351  -2.340   1.111
  842   HD21  ASN 103          HD21      ASN 103  73.834  -2.090   1.636
  843   HD22  ASN 103          HD22      ASN 103  73.761  -0.688   2.587
  844    H    GLU 104           H        GLU 104  72.251  -4.571  -1.357
  845    HA   GLU 104           HA       GLU 104  70.787  -5.829  -2.680
  846    HB2  GLU 104           HB2      GLU 104  71.291  -7.702  -0.359
  847    HB3  GLU 104           HB3      GLU 104  70.926  -8.153  -2.024
  848    HG2  GLU 104           HG2      GLU 104  73.237  -8.322  -2.067
  849    HG3  GLU 104           HG3      GLU 104  73.046  -6.640  -2.552
  850    HHA  HEC 201           HA       HEC 105  89.267  -3.403   3.202
  851    HHB  HEC 201           HB       HEC 105  85.525   0.155  -0.445
  852    HHC  HEC 201           HC       HEC 105  88.787  -1.675  -5.549
  853    HHD  HEC 201           HD       HEC 105  92.116  -5.682  -1.966
  854   HMA1  HEC 201          HMA1      HEC 105  85.721   0.982   2.379
  855   HMA2  HEC 201          HMA2      HEC 105  85.015  -0.390   3.232
  856   HMA3  HEC 201          HMA3      HEC 105  84.578  -0.079   1.556
  857   HAA1  HEC 201          HAA1      HEC 105  86.777  -0.871   4.486
  858   HAA2  HEC 201          HAA2      HEC 105  88.325  -1.692   4.457
  859   HBA1  HEC 201          HBA1      HEC 105  87.307  -3.834   4.445
  860   HBA2  HEC 201          HBA2      HEC 105  85.721  -3.164   4.072
  861   HMB1  HEC 201          HMB1      HEC 105  84.797   1.293  -3.979
  862   HMB2  HEC 201          HMB2      HEC 105  85.146   1.688  -2.299
  863   HMB3  HEC 201          HMB3      HEC 105  84.117   0.311  -2.688
  864    HAB  HEC 201           HAB      HEC 105  87.320  -0.444  -6.210
  865   HBB1  HEC 201          HBB1      HEC 105  86.332   1.977  -6.536
  866   HBB2  HEC 201          HBB2      HEC 105  86.659   2.124  -4.812
  867   HBB3  HEC 201          HBB3      HEC 105  87.971   1.768  -5.926
  868   HMC1  HEC 201          HMC1      HEC 105  91.269  -4.191  -6.883
  869   HMC2  HEC 201          HMC2      HEC 105  91.212  -2.446  -6.644
  870   HMC3  HEC 201          HMC3      HEC 105  89.722  -3.351  -6.893
  871    HAC  HEC 201           HAC      HEC 105  92.611  -6.070  -3.889
  872   HBC1  HEC 201          HBC1      HEC 105  94.320  -5.002  -4.926
  873   HBC2  HEC 201          HBC2      HEC 105  93.231  -3.861  -5.715
  874   HBC3  HEC 201          HBC3      HEC 105  93.532  -5.439  -6.440
  875   HMD1  HEC 201          HMD1      HEC 105  93.323  -6.229  -0.198
  876   HMD2  HEC 201          HMD2      HEC 105  92.195  -7.415   0.458
  877   HMD3  HEC 201          HMD3      HEC 105  93.187  -6.444   1.544
  878   HAD1  HEC 201          HAD1      HEC 105  91.807  -6.198   3.205
  879   HAD2  HEC 201          HAD2      HEC 105  90.307  -5.435   3.694
  880   HBD1  HEC 201          HBD1      HEC 105  91.497  -3.263   3.879
  881   HBD2  HEC 201          HBD2      HEC 105  93.003  -4.081   3.473
  882    H1   HOH 301           H2       HOH 200  81.347   3.574  -1.473
  883    H2   HOH 301           H1       HOH 200  79.959   3.662  -0.871
  884    H1   HOH 302           H2       HOH 201  86.134   6.066   5.911
  885    H2   HOH 302           H1       HOH 201  87.438   5.894   6.657
  886    H1   HOH 303           H2       HOH 202  81.571  -5.499   5.925
  887    H2   HOH 303           H1       HOH 202  83.074  -5.325   5.913
  888    H1   HOH 304           H2       HOH 203  82.162  -9.782  -0.030
  889    H2   HOH 304           H1       HOH 203  80.686 -10.089   0.082
  Start of MODEL    9
    1    H1   GLY   1           H1       GLY   1  74.189  11.888  -7.605
    2    H2   GLY   1           H2       GLY   1  74.586  11.933  -5.953
    3    H3   GLY   1           H3       GLY   1  73.046  11.407  -6.447
    4    HA2  GLY   1           HA2      GLY   1  75.631  10.029  -6.939
    5    HA3  GLY   1           HA3      GLY   1  74.352   9.503  -5.844
    6    H    ASP   2           H        ASP   2  75.574   8.344  -8.386
    7    HA   ASP   2           HA       ASP   2  73.009   7.797  -9.760
    8    HB2  ASP   2           HB2      ASP   2  75.717   8.195 -11.055
    9    HB3  ASP   2           HB1      ASP   2  74.254   7.669 -11.888
   10    H    VAL   3           H        VAL   3  72.795   5.880  -8.555
   11    HA   VAL   3           HA       VAL   3  74.663   3.903  -8.111
   12    HB   VAL   3           HB       VAL   3  72.474   3.729  -7.133
   13   HG11  VAL   3          HG11      VAL   3  70.498   3.202  -8.621
   14   HG12  VAL   3          HG12      VAL   3  71.518   3.594 -10.005
   15   HG13  VAL   3          HG13      VAL   3  71.138   4.834  -8.811
   16   HG21  VAL   3          HG21      VAL   3  72.007   1.420  -7.525
   17   HG22  VAL   3          HG22      VAL   3  73.732   1.606  -7.831
   18   HG23  VAL   3          HG23      VAL   3  72.605   1.505  -9.181
   19    H    GLU   4           H        GLU   4  73.376   4.968 -11.101
   20    HA   GLU   4           HA       GLU   4  73.716   2.525 -12.567
   21    HB2  GLU   4           HB2      GLU   4  73.723   5.321 -13.708
   22    HB3  GLU   4           HB3      GLU   4  73.255   3.823 -14.513
   23    HG2  GLU   4           HG2      GLU   4  71.433   3.596 -12.737
   24    HG3  GLU   4           HG3      GLU   4  71.802   5.260 -12.285
   25    H    LYS   5           H        LYS   5  75.560   5.589 -12.609
   26    HA   LYS   5           HA       LYS   5  77.769   4.367 -13.989
   27    HB2  LYS   5           HB2      LYS   5  77.343   7.057 -12.686
   28    HB3  LYS   5           HB3      LYS   5  78.906   6.585 -13.353
   29    HG2  LYS   5           HG2      LYS   5  78.008   6.341 -15.551
   30    HG3  LYS   5           HG3      LYS   5  76.349   6.422 -14.960
   31    HD2  LYS   5           HD2      LYS   5  78.177   8.743 -14.425
   32    HD3  LYS   5           HD3      LYS   5  77.499   8.556 -16.043
   33    HE2  LYS   5           HE2      LYS   5  75.222   8.468 -15.070
   34    HE3  LYS   5           HE3      LYS   5  75.909   8.694 -13.462
   35    HZ1  LYS   5           HZ1      LYS   5  75.884  10.863 -13.815
   36    HZ2  LYS   5           HZ2      LYS   5  75.286  10.639 -15.390
   37    HZ3  LYS   5           HZ3      LYS   5  76.961  10.674 -15.112
   38    H    GLY   6           H        GLY   6  76.731   4.570 -10.754
   39    HA2  GLY   6           HA2      GLY   6  79.287   4.411  -9.467
   40    HA3  GLY   6           HA3      GLY   6  77.726   4.020  -8.738
   41    H    LYS   7           H        LYS   7  76.905   2.142 -10.702
   42    HA   LYS   7           HA       LYS   7  78.141  -0.225  -9.699
   43    HB2  LYS   7           HB2      LYS   7  75.760  -0.098 -10.434
   44    HB3  LYS   7           HB3      LYS   7  76.319   0.086 -12.097
   45    HG2  LYS   7           HG2      LYS   7  77.516  -2.085 -11.916
   46    HG3  LYS   7           HG3      LYS   7  76.888  -2.275 -10.281
   47    HD2  LYS   7           HD2      LYS   7  75.278  -3.458 -11.452
   48    HD3  LYS   7           HD3      LYS   7  74.556  -1.850 -11.496
   49    HE2  LYS   7           HE2      LYS   7  75.692  -1.472 -13.708
   50    HE3  LYS   7           HE3      LYS   7  76.214  -3.156 -13.671
   51    HZ1  LYS   7           HZ1      LYS   7  73.857  -3.792 -13.465
   52    HZ2  LYS   7           HZ2      LYS   7  74.198  -2.988 -14.922
   53    HZ3  LYS   7           HZ3      LYS   7  73.416  -2.166 -13.656
   54    H    LYS   8           H        LYS   8  78.281   1.565 -12.763
   55    HA   LYS   8           HA       LYS   8  79.875  -0.221 -14.218
   56    HB2  LYS   8           HB2      LYS   8  78.816   1.666 -15.298
   57    HB3  LYS   8           HB3      LYS   8  79.742   2.798 -14.315
   58    HG2  LYS   8           HG2      LYS   8  81.416   0.848 -15.766
   59    HG3  LYS   8           HG3      LYS   8  80.490   1.909 -16.824
   60    HD2  LYS   8           HD2      LYS   8  82.167   2.929 -14.515
   61    HD3  LYS   8           HD3      LYS   8  82.778   2.787 -16.162
   62    HE2  LYS   8           HE2      LYS   8  80.519   4.153 -16.688
   63    HE3  LYS   8           HE3      LYS   8  80.790   4.707 -15.037
   64    HZ1  LYS   8           HZ1      LYS   8  82.135   6.172 -16.036
   65    HZ2  LYS   8           HZ2      LYS   8  82.313   5.232 -17.440
   66    HZ3  LYS   8           HZ3      LYS   8  83.247   4.890 -16.062
   67    H    ILE   9           H        ILE   9  80.837   2.519 -12.163
   68    HA   ILE   9           HA       ILE   9  83.624   2.176 -12.486
   69    HB   ILE   9           HB       ILE   9  82.078   3.426 -10.204
   70   HG12  ILE   9          HG12      ILE   9  83.490   4.825 -12.482
   71   HG13  ILE   9          HG13      ILE   9  81.805   4.319 -12.617
   72   HG21  ILE   9          HG21      ILE   9  85.000   3.562 -11.006
   73   HG22  ILE   9          HG22      ILE   9  84.343   2.929  -9.496
   74   HG23  ILE   9          HG23      ILE   9  84.247   4.655  -9.845
   75   HD11  ILE   9          HD11      ILE   9  82.918   6.109 -10.434
   76   HD12  ILE   9          HD12      ILE   9  81.230   5.635 -10.625
   77   HD13  ILE   9          HD13      ILE   9  81.997   6.666 -11.832
   78    H    PHE  10           H        PHE  10  81.274   0.585 -10.474
   79    HA   PHE  10           HA       PHE  10  83.182  -0.453  -8.585
   80    HB2  PHE  10           HB2      PHE  10  81.069  -0.346  -7.644
   81    HB3  PHE  10           HB1      PHE  10  80.268  -0.862  -9.127
   82    HD1  PHE  10           HD1      PHE  10  80.206  -3.232  -9.771
   83    HD2  PHE  10           HD2      PHE  10  82.030  -1.965  -6.103
   84    HE1  PHE  10           HE1      PHE  10  80.230  -5.580  -8.981
   85    HE2  PHE  10           HE2      PHE  10  82.059  -4.314  -5.306
   86    HZ   PHE  10           HZ       PHE  10  81.159  -6.122  -6.749
   87    H    VAL  11           H        VAL  11  81.300  -1.947 -11.230
   88    HA   VAL  11           HA       VAL  11  82.312  -4.525 -11.028
   89    HB   VAL  11           HB       VAL  11  81.720  -4.765 -13.430
   90   HG11  VAL  11          HG11      VAL  11  79.386  -4.481 -13.096
   91   HG12  VAL  11          HG12      VAL  11  79.630  -3.134 -11.986
   92   HG13  VAL  11          HG13      VAL  11  80.045  -4.774 -11.487
   93   HG21  VAL  11          HG21      VAL  11  80.835  -2.841 -14.635
   94   HG22  VAL  11          HG22      VAL  11  82.469  -2.466 -14.087
   95   HG23  VAL  11          HG23      VAL  11  81.076  -1.816 -13.224
   96    H    GLN  12           H        GLN  12  83.750  -1.666 -12.408
   97    HA   GLN  12           HA       GLN  12  85.917  -3.257 -13.583
   98    HB2  GLN  12           HB2      GLN  12  86.603  -1.236 -14.682
   99    HB3  GLN  12           HB1      GLN  12  84.861  -1.421 -14.876
  100    HG2  GLN  12           HG2      GLN  12  84.539   0.100 -12.906
  101    HG3  GLN  12           HG1      GLN  12  86.282   0.373 -12.894
  102   HE21  GLN  12          HE21      GLN  12  85.579  -0.088 -16.084
  103   HE22  GLN  12          HE22      GLN  12  85.299   1.516 -16.552
  104    H    LYS  13           H        LYS  13  85.346  -1.160 -10.820
  105    HA   LYS  13           HA       LYS  13  88.248  -1.038 -10.322
  106    HB2  LYS  13           HB2      LYS  13  85.952   0.477  -9.085
  107    HB3  LYS  13           HB3      LYS  13  87.616   0.594  -8.527
  108    HG2  LYS  13           HG2      LYS  13  87.976   0.981 -11.208
  109    HG3  LYS  13           HG3      LYS  13  86.375   1.684 -10.995
  110    HD2  LYS  13           HD2      LYS  13  87.190   3.191  -9.289
  111    HD3  LYS  13           HD3      LYS  13  88.765   2.397  -9.274
  112    HE2  LYS  13           HE2      LYS  13  89.170   3.088 -11.585
  113    HE3  LYS  13           HE3      LYS  13  87.569   3.821 -11.667
  114    HZ1  LYS  13           HZ1      LYS  13  89.978   4.760 -10.332
  115    HZ2  LYS  13           HZ2      LYS  13  88.514   5.016  -9.508
  116    HZ3  LYS  13           HZ3      LYS  13  88.732   5.643 -11.071
  117    H    CYS  14           H        CYS  14  85.397  -1.497  -8.176
  118    HA   CYS  14           HA       CYS  14  87.090  -2.822  -6.250
  119    HB2  CYS  14           HB2      CYS  14  84.122  -2.762  -5.992
  120    HB3  CYS  14           HB1      CYS  14  85.353  -2.593  -4.746
  121    H    ALA  15           H        ALA  15  84.596  -3.947  -8.508
  122    HA   ALA  15           HA       ALA  15  84.076  -6.442  -7.480
  123    HB1  ALA  15           HB1      ALA  15  84.103  -7.141 -10.028
  124    HB2  ALA  15           HB2      ALA  15  84.300  -5.406 -10.274
  125    HB3  ALA  15           HB3      ALA  15  82.887  -6.020  -9.416
  126    H    GLN  16           H        GLN  16  87.033  -5.278  -8.890
  127    HA   GLN  16           HA       GLN  16  88.349  -7.564  -9.663
  128    HB2  GLN  16           HB2      GLN  16  89.221  -4.981  -8.460
  129    HB3  GLN  16           HB1      GLN  16  90.407  -6.282  -8.539
  130    HG2  GLN  16           HG2      GLN  16  89.966  -6.522 -10.964
  131    HG3  GLN  16           HG1      GLN  16  88.807  -5.196 -10.876
  132   HE21  GLN  16          HE21      GLN  16  92.253  -5.858 -10.003
  133   HE22  GLN  16          HE22      GLN  16  92.805  -4.314 -10.442
  134    H    CYS  17           H        CYS  17  88.598  -6.176  -6.356
  135    HA   CYS  17           HA       CYS  17  89.005  -8.941  -5.369
  136    HB2  CYS  17           HB2      CYS  17  90.214  -6.756  -3.786
  137    HB3  CYS  17           HB1      CYS  17  90.851  -8.346  -4.183
  138    H    HIS  18           H        HSD  18  86.436  -8.056  -5.418
  139    HA   HIS  18           HA       HSD  18  85.817  -7.958  -2.581
  140    HB2  HIS  18           HB2      HSD  18  85.254  -5.641  -4.407
  141    HB3  HIS  18           HB1      HSD  18  84.163  -5.996  -3.071
  142    HD1  HIS  18           HD1      HSD  18  85.120  -5.763  -0.645
  143    HD2  HIS  18           HD2      HSD  18  87.779  -4.631  -3.642
  144    HE1  HIS  18           HE1      HSD  18  86.997  -4.502   0.502
  145    H    THR  19           H        THR  19  83.209  -7.567  -2.516
  146    HA   THR  19           HA       THR  19  81.945  -9.160  -4.639
  147    HB   THR  19           HB       THR  19  80.853 -10.097  -2.193
  148    HG1  THR  19           HG1      THR  19  83.180 -11.050  -1.721
  149   HG21  THR  19          HG21      THR  19  81.096 -11.322  -4.355
  150   HG22  THR  19          HG22      THR  19  81.688 -12.247  -2.975
  151   HG23  THR  19          HG23      THR  19  82.830 -11.446  -4.054
  152    H    VAL  20           H        VAL  20  81.556  -7.266  -1.675
  153    HA   VAL  20           HA       VAL  20  79.809  -6.000  -0.888
  154    HB   VAL  20           HB       VAL  20  79.150  -4.234  -2.378
  155   HG11  VAL  20          HG11      VAL  20  81.976  -5.182  -2.948
  156   HG12  VAL  20          HG12      VAL  20  81.470  -4.174  -1.594
  157   HG13  VAL  20          HG13      VAL  20  81.381  -3.548  -3.238
  158   HG21  VAL  20          HG21      VAL  20  80.390  -5.770  -4.661
  159   HG22  VAL  20          HG22      VAL  20  79.396  -4.320  -4.741
  160   HG23  VAL  20          HG23      VAL  20  78.667  -5.864  -4.309
  161    H    GLU  21           H        GLU  21  79.075  -8.723  -1.842
  162    HA   GLU  21           HA       GLU  21  76.214  -8.196  -2.412
  163    HB2  GLU  21           HB2      GLU  21  76.255 -10.573  -3.373
  164    HB3  GLU  21           HB3      GLU  21  77.018  -9.307  -4.334
  165    HG2  GLU  21           HG2      GLU  21  79.180 -10.038  -3.824
  166    HG3  GLU  21           HG3      GLU  21  78.666 -10.867  -2.362
  167    H    LYS  22           H        LYS  22  75.212  -8.376  -0.503
  168    HA   LYS  22           HA       LYS  22  76.023  -9.773   1.740
  169    HB2  LYS  22           HB2      LYS  22  73.921  -8.169   1.170
  170    HB3  LYS  22           HB3      LYS  22  73.103  -9.728   1.273
  171    HG2  LYS  22           HG2      LYS  22  74.498 -10.031   3.469
  172    HG3  LYS  22           HG3      LYS  22  74.675  -8.277   3.392
  173    HD2  LYS  22           HD2      LYS  22  72.134  -8.188   3.111
  174    HD3  LYS  22           HD3      LYS  22  72.131  -9.882   3.598
  175    HE2  LYS  22           HE2      LYS  22  71.788  -8.630   5.607
  176    HE3  LYS  22           HE3      LYS  22  73.471  -9.157   5.647
  177    HZ1  LYS  22           HZ1      LYS  22  74.236  -7.068   5.278
  178    HZ2  LYS  22           HZ2      LYS  22  72.788  -6.664   6.069
  179    HZ3  LYS  22           HZ3      LYS  22  72.882  -6.594   4.374
  180    H    GLY  23           H        GLY  23  76.482 -11.858   1.946
  181    HA2  GLY  23           HA2      GLY  23  75.827 -14.117   2.176
  182    HA3  GLY  23           HA3      GLY  23  74.550 -13.853   0.995
  183    H    GLY  24           H        GLY  24  77.619 -12.562   0.169
  184    HA2  GLY  24           HA2      GLY  24  77.900 -14.577  -1.944
  185    HA3  GLY  24           HA3      GLY  24  78.744 -13.036  -1.855
  186    H    LYS  25           H        LYS  25  80.821 -13.740  -2.043
  187    HA   LYS  25           HA       LYS  25  81.939 -15.124   0.278
  188    HB2  LYS  25           HB2      LYS  25  83.294 -16.592  -1.320
  189    HB3  LYS  25           HB3      LYS  25  81.601 -17.024  -1.094
  190    HG2  LYS  25           HG2      LYS  25  82.131 -15.087  -3.283
  191    HG3  LYS  25           HG3      LYS  25  82.760 -16.712  -3.545
  192    HD2  LYS  25           HD2      LYS  25  80.613 -17.697  -3.367
  193    HD3  LYS  25           HD3      LYS  25  79.920 -16.253  -2.628
  194    HE2  LYS  25           HE2      LYS  25  79.319 -16.562  -5.062
  195    HE3  LYS  25           HE3      LYS  25  80.095 -15.022  -4.695
  196    HZ1  LYS  25           HZ1      LYS  25  81.966 -15.594  -5.790
  197    HZ2  LYS  25           HZ2      LYS  25  80.903 -16.604  -6.649
  198    HZ3  LYS  25           HZ3      LYS  25  81.851 -17.238  -5.389
  199    H    HIS  26           H        HIS  26  83.660 -14.015   0.927
  200    HA   HIS  26           HA       HIS  26  84.731 -11.809  -0.380
  201    HB2  HIS  26           HB2      HIS  26  86.800 -12.419   1.170
  202    HB3  HIS  26           HB1      HIS  26  85.287 -11.834   1.859
  203    HD1  HIS  26           HD1      HIS  26  85.913 -15.335   0.533
  204    HD2  HIS  26           HD2      HIS  26  85.202 -13.412   4.164
  205    HE1  HIS  26           HE1      HIS  26  85.590 -17.160   2.259
  206    HE2  HIS  26           HE2      HIS  26  85.155 -16.004   4.478
  207    H    LYS  27           H        LYS  27  85.956 -11.597  -2.107
  208    HA   LYS  27           HA       LYS  27  87.644 -13.876  -2.967
  209    HB2  LYS  27           HB2      LYS  27  85.706 -13.257  -4.475
  210    HB3  LYS  27           HB3      LYS  27  86.505 -11.707  -4.741
  211    HG2  LYS  27           HG2      LYS  27  88.582 -13.085  -5.393
  212    HG3  LYS  27           HG3      LYS  27  87.488 -14.465  -5.485
  213    HD2  LYS  27           HD2      LYS  27  87.133 -11.865  -7.006
  214    HD3  LYS  27           HD3      LYS  27  87.772 -13.359  -7.692
  215    HE2  LYS  27           HE2      LYS  27  85.587 -14.456  -6.867
  216    HE3  LYS  27           HE3      LYS  27  84.983 -12.810  -6.677
  217    HZ1  LYS  27           HZ1      LYS  27  84.911 -14.245  -8.966
  218    HZ2  LYS  27           HZ2      LYS  27  86.290 -13.279  -9.195
  219    HZ3  LYS  27           HZ3      LYS  27  84.789 -12.555  -8.870
  220    H    THR  28           H        THR  28  89.545 -13.274  -1.967
  221    HA   THR  28           HA       THR  28  91.518 -12.140  -1.665
  222    HB   THR  28           HB       THR  28  90.794 -10.673  -4.210
  223    HG1  THR  28           HG1      THR  28  92.247 -12.564  -4.943
  224   HG21  THR  28          HG21      THR  28  93.406 -11.030  -4.399
  225   HG22  THR  28          HG22      THR  28  93.306 -11.172  -2.645
  226   HG23  THR  28          HG23      THR  28  92.760  -9.697  -3.442
  227    H    GLY  29           H        GLY  29  88.942 -11.084  -0.648
  228    HA2  GLY  29           HA2      GLY  29  89.849  -8.730   0.567
  229    HA3  GLY  29           HA3      GLY  29  88.838  -8.268  -0.799
  230    HA   PRO  30           HA       PRO  30  86.306  -9.698   3.016
  231    HB2  PRO  30           HB2      PRO  30  85.818  -7.311   4.254
  232    HB3  PRO  30           HB1      PRO  30  87.211  -8.338   4.649
  233    HG2  PRO  30           HG2      PRO  30  87.082  -5.905   2.929
  234    HG3  PRO  30           HG1      PRO  30  88.319  -6.393   4.101
  235    HD2  PRO  30           HD2      PRO  30  88.625  -6.729   1.401
  236    HD3  PRO  30           HD1      PRO  30  89.381  -7.801   2.601
  237    H    ASN  31           H        ASN  31  84.010  -9.113   3.437
  238    HA   ASN  31           HA       ASN  31  82.756  -8.058   0.996
  239    HB2  ASN  31           HB2      ASN  31  80.762  -9.172   1.722
  240    HB3  ASN  31           HB1      ASN  31  82.097 -10.300   1.945
  241   HD21  ASN  31          HD21      ASN  31  82.550 -11.015   4.080
  242   HD22  ASN  31          HD22      ASN  31  81.689 -10.484   5.443
  243    H    LEU  32           H        LEU  32  82.043  -6.057   0.948
  244    HA   LEU  32           HA       LEU  32  81.952  -4.418   3.307
  245    HB2  LEU  32           HB2      LEU  32  80.884  -3.639   0.599
  246    HB3  LEU  32           HB3      LEU  32  81.564  -2.603   1.851
  247    HG   LEU  32           HG       LEU  32  83.026  -4.563   0.068
  248   HD11  LEU  32          HD11      LEU  32  82.893  -2.467  -1.000
  249   HD12  LEU  32          HD12      LEU  32  84.453  -2.400  -0.185
  250   HD13  LEU  32          HD13      LEU  32  83.060  -1.578   0.513
  251   HD21  LEU  32          HD21      LEU  32  84.039  -4.973   2.164
  252   HD22  LEU  32          HD22      LEU  32  83.863  -3.296   2.675
  253   HD23  LEU  32          HD23      LEU  32  85.055  -3.722   1.451
  254    H    HIS  33           H        HIS  33  80.108  -6.642   3.354
  255    HA   HIS  33           HA       HIS  33  77.455  -5.873   2.752
  256    HB2  HIS  33           HB2      HIS  33  78.478  -7.727   4.922
  257    HB3  HIS  33           HB1      HIS  33  76.799  -7.610   4.394
  258    HD1  HIS  33           HD1      HIS  33  78.249 -10.284   4.064
  259    HD2  HIS  33           HD2      HIS  33  78.175  -7.357   1.094
  260    HE1  HIS  33           HE1      HIS  33  78.687 -11.476   1.873
  261    HE2  HIS  33           HE2      HIS  33  78.643  -9.708   0.053
  262    H    GLY  34           H        GLY  34  75.909  -4.763   3.929
  263    HA2  GLY  34           HA2      GLY  34  75.299  -2.952   5.278
  264    HA3  GLY  34           HA3      GLY  34  75.664  -4.133   6.534
  265    H    LEU  35           H        LEU  35  78.072  -2.860   4.361
  266    HA   LEU  35           HA       LEU  35  80.003  -2.264   6.214
  267    HB2  LEU  35           HB2      LEU  35  80.463  -2.316   3.842
  268    HB3  LEU  35           HB3      LEU  35  79.410  -0.935   3.564
  269    HG   LEU  35           HG       LEU  35  81.099   0.156   5.382
  270   HD11  LEU  35          HD11      LEU  35  82.352  -2.110   5.335
  271   HD12  LEU  35          HD12      LEU  35  83.311  -0.637   5.189
  272   HD13  LEU  35          HD13      LEU  35  82.934  -1.588   3.755
  273   HD21  LEU  35          HD21      LEU  35  81.807  -0.097   2.450
  274   HD22  LEU  35          HD22      LEU  35  82.198   1.242   3.529
  275   HD23  LEU  35          HD23      LEU  35  80.525   0.952   3.053
  276    H    PHE  36           H        PHE  36  77.821   0.137   4.733
  277    HA   PHE  36           HA       PHE  36  78.593   2.341   6.224
  278    HB2  PHE  36           HB2      PHE  36  75.760   1.788   5.320
  279    HB3  PHE  36           HB1      PHE  36  76.516   3.360   5.576
  280    HD1  PHE  36           HD2      PHE  36  76.583   0.301   3.454
  281    HD2  PHE  36           HD1      PHE  36  77.881   4.378   3.885
  282    HE1  PHE  36           HE2      PHE  36  77.413   0.286   1.121
  283    HE2  PHE  36           HE1      PHE  36  78.701   4.360   1.556
  284    HZ   PHE  36           HZ       PHE  36  78.470   2.318   0.167
  285    H    GLY  37           H        GLY  37  78.954   1.866   8.409
  286    HA2  GLY  37           HA2      GLY  37  77.422   2.544  10.385
  287    HA3  GLY  37           HA3      GLY  37  76.605   1.039   9.995
  288    H    ARG  38           H        ARG  38  79.249  -0.246   9.295
  289    HA   ARG  38           HA       ARG  38  79.881  -1.064  12.026
  290    HB2  ARG  38           HB2      ARG  38  80.281  -2.174   9.309
  291    HB3  ARG  38           HB3      ARG  38  81.531  -2.564  10.489
  292    HG2  ARG  38           HG2      ARG  38  79.659  -3.280  12.061
  293    HG3  ARG  38           HG3      ARG  38  78.564  -3.136  10.688
  294    HD2  ARG  38           HD2      ARG  38  81.006  -4.684  10.110
  295    HD3  ARG  38           HD3      ARG  38  79.974  -5.412  11.333
  296    HE   ARG  38           HE       ARG  38  78.136  -4.978   9.529
  297   HH11  ARG  38          HH21      ARG  38  81.446  -5.895   8.976
  298   HH12  ARG  38          HH22      ARG  38  81.102  -6.725   7.497
  299   HH21  ARG  38          HH11      ARG  38  77.699  -6.085   7.606
  300   HH22  ARG  38          HH12      ARG  38  78.987  -6.843   6.730
  301    H    LYS  39           H        LYS  39  81.923  -1.038  12.961
  302    HA   LYS  39           HA       LYS  39  83.530   1.249  12.389
  303    HB2  LYS  39           HB2      LYS  39  83.593  -0.992  14.353
  304    HB3  LYS  39           HB3      LYS  39  85.076  -0.072  14.109
  305    HG2  LYS  39           HG2      LYS  39  82.512   1.437  14.498
  306    HG3  LYS  39           HG3      LYS  39  83.275   0.701  15.907
  307    HD2  LYS  39           HD2      LYS  39  85.400   1.868  15.334
  308    HD3  LYS  39           HD3      LYS  39  84.577   2.659  13.990
  309    HE2  LYS  39           HE2      LYS  39  83.115   3.847  15.454
  310    HE3  LYS  39           HE3      LYS  39  83.572   2.849  16.834
  311    HZ1  LYS  39           HZ1      LYS  39  85.675   3.827  16.934
  312    HZ2  LYS  39           HZ2      LYS  39  84.623   5.133  16.661
  313    HZ3  LYS  39           HZ3      LYS  39  85.548   4.502  15.383
  314    H    THR  40           H        THR  40  85.969   1.052  12.172
  315    HA   THR  40           HA       THR  40  86.586  -0.292   9.759
  316    HB   THR  40           HB       THR  40  88.981   0.393  10.394
  317    HG1  THR  40           HG1      THR  40  87.507   1.745  12.400
  318   HG21  THR  40          HG21      THR  40  88.257   2.902  10.208
  319   HG22  THR  40          HG22      THR  40  86.638   2.234  10.008
  320   HG23  THR  40          HG23      THR  40  87.913   1.808   8.869
  321    H    GLY  41           H        GLY  41  87.786  -2.078   9.306
  322    HA2  GLY  41           HA2      GLY  41  88.398  -4.275   9.618
  323    HA3  GLY  41           HA3      GLY  41  89.421  -3.595  10.881
  324    H    GLN  42           H        GLN  42  85.896  -4.031  10.568
  325    HA   GLN  42           HA       GLN  42  85.926  -5.439  13.177
  326    HB2  GLN  42           HB2      GLN  42  84.773  -3.192  13.099
  327    HB3  GLN  42           HB1      GLN  42  83.606  -3.912  11.988
  328    HG2  GLN  42           HG2      GLN  42  82.992  -5.586  13.651
  329    HG3  GLN  42           HG1      GLN  42  84.233  -4.990  14.751
  330   HE21  GLN  42          HE21      GLN  42  81.296  -3.840  13.003
  331   HE22  GLN  42          HE22      GLN  42  80.833  -2.743  14.212
  332    H    ALA  43           H        ALA  43  85.093  -5.638   9.843
  333    HA   ALA  43           HA       ALA  43  83.029  -7.564   9.991
  334    HB1  ALA  43           HB1      ALA  43  84.502  -7.998   7.609
  335    HB2  ALA  43           HB2      ALA  43  84.578  -6.269   7.947
  336    HB3  ALA  43           HB3      ALA  43  83.015  -7.069   7.801
  337    HA   PRO  44           HA       PRO  44  85.719 -10.950  11.223
  338    HB2  PRO  44           HB2      PRO  44  83.819 -12.850  11.542
  339    HB3  PRO  44           HB1      PRO  44  84.004 -11.505  12.686
  340    HG2  PRO  44           HG2      PRO  44  82.027 -11.856  10.483
  341    HG3  PRO  44           HG1      PRO  44  81.792 -11.206  12.115
  342    HD2  PRO  44           HD2      PRO  44  82.097  -9.634   9.857
  343    HD3  PRO  44           HD1      PRO  44  82.473  -9.091  11.509
  344    H    GLY  45           H        GLY  45  86.976 -11.896   9.695
  345    HA2  GLY  45           HA2      GLY  45  86.443 -14.074   8.197
  346    HA3  GLY  45           HA3      GLY  45  85.859 -12.776   7.164
  347    H    PHE  46           H        PHE  46  87.391 -11.105   6.527
  348    HA   PHE  46           HA       PHE  46  89.890 -12.216   5.711
  349    HB2  PHE  46           HB2      PHE  46  88.521 -10.465   4.475
  350    HB3  PHE  46           HB1      PHE  46  89.125  -9.296   5.648
  351    HD1  PHE  46           HD1      PHE  46  90.163 -11.754   3.054
  352    HD2  PHE  46           HD2      PHE  46  91.345  -8.436   5.512
  353    HE1  PHE  46           HE1      PHE  46  92.272 -11.552   1.766
  354    HE2  PHE  46           HE2      PHE  46  93.455  -8.234   4.225
  355    HZ   PHE  46           HZ       PHE  46  93.919  -9.792   2.352
  356    H    THR  47           H        THR  47  91.993 -11.538   6.269
  357    HA   THR  47           HA       THR  47  92.349 -11.000   9.070
  358    HB   THR  47           HB       THR  47  94.493 -10.996   6.947
  359    HG1  THR  47           HG1      THR  47  94.364 -13.104   6.875
  360   HG21  THR  47          HG21      THR  47  95.847 -11.861   8.852
  361   HG22  THR  47          HG22      THR  47  94.443 -11.663   9.902
  362   HG23  THR  47          HG23      THR  47  95.196 -10.251   9.160
  363    H    TYR  48           H        TYR  48  91.354  -8.933   9.272
  364    HA   TYR  48           HA       TYR  48  92.097  -6.642   7.810
  365    HB2  TYR  48           HB2      TYR  48  90.734  -7.167  10.408
  366    HB3  TYR  48           HB3      TYR  48  91.307  -5.530  10.104
  367    HD1  TYR  48           HD2      TYR  48  90.801  -4.626   7.663
  368    HD2  TYR  48           HD1      TYR  48  88.596  -7.732   9.640
  369    HE1  TYR  48           HE2      TYR  48  88.862  -4.184   6.189
  370    HE2  TYR  48           HE1      TYR  48  86.653  -7.290   8.165
  371    HH   TYR  48           HH       TYR  48  86.259  -4.558   6.422
  372    H    THR  49           H        THR  49  93.426  -4.889   8.369
  373    HA   THR  49           HA       THR  49  95.890  -5.674   9.709
  374    HB   THR  49           HB       THR  49  96.724  -3.491   8.910
  375    HG1  THR  49           HG1      THR  49  95.035  -2.159   8.923
  376   HG21  THR  49          HG21      THR  49  96.216  -3.931   6.410
  377   HG22  THR  49          HG22      THR  49  95.282  -5.312   6.986
  378   HG23  THR  49          HG23      THR  49  97.011  -5.214   7.322
  379    H    ASP  50           H        ASP  50  96.868  -4.350  11.377
  380    HA   ASP  50           HA       ASP  50  95.237  -3.874  13.580
  381    HB2  ASP  50           HB2      ASP  50  97.251  -2.366  14.297
  382    HB3  ASP  50           HB1      ASP  50  97.497  -4.100  14.096
  383    H    ALA  51           H        ALA  51  96.519  -1.544  11.217
  384    HA   ALA  51           HA       ALA  51  95.560   0.809  12.322
  385    HB1  ALA  51           HB1      ALA  51  97.025   0.651  10.317
  386    HB2  ALA  51           HB2      ALA  51  95.663   1.747  10.091
  387    HB3  ALA  51           HB3      ALA  51  95.626   0.137   9.373
  388    H    ASN  52           H        ASN  52  93.859  -1.539  10.282
  389    HA   ASN  52           HA       ASN  52  91.424   0.031  10.270
  390    HB2  ASN  52           HB2      ASN  52  92.460  -1.981   8.660
  391    HB3  ASN  52           HB1      ASN  52  91.176  -2.803   9.537
  392   HD21  ASN  52          HD21      ASN  52  90.182  -2.844   7.248
  393   HD22  ASN  52          HD22      ASN  52  89.273  -1.493   6.770
  394    H    LYS  53           H        LYS  53  92.857  -2.486  12.165
  395    HA   LYS  53           HA       LYS  53  90.413  -3.253  13.493
  396    HB2  LYS  53           HB2      LYS  53  92.672  -4.606  13.017
  397    HB3  LYS  53           HB3      LYS  53  93.112  -3.928  14.585
  398    HG2  LYS  53           HG2      LYS  53  90.883  -4.766  15.440
  399    HG3  LYS  53           HG3      LYS  53  90.725  -5.648  13.921
  400    HD2  LYS  53           HD2      LYS  53  92.999  -6.679  14.421
  401    HD3  LYS  53           HD3      LYS  53  92.859  -5.991  16.040
  402    HE2  LYS  53           HE2      LYS  53  90.744  -7.213  16.382
  403    HE3  LYS  53           HE3      LYS  53  90.877  -7.901  14.764
  404    HZ1  LYS  53           HZ1      LYS  53  91.714  -9.464  16.349
  405    HZ2  LYS  53           HZ2      LYS  53  92.753  -8.305  17.029
  406    HZ3  LYS  53           HZ3      LYS  53  93.022  -8.870  15.449
  407    H    ASN  54           H        ASN  54  92.646  -0.755  13.671
  408    HA   ASN  54           HA       ASN  54  92.812  -0.308  16.457
  409    HB2  ASN  54           HB2      ASN  54  93.863   1.668  15.892
  410    HB3  ASN  54           HB1      ASN  54  94.113   0.738  14.421
  411   HD21  ASN  54          HD21      ASN  54  91.416   0.988  13.366
  412   HD22  ASN  54          HD22      ASN  54  91.185   2.615  12.942
  413    H    LYS  55           H        LYS  55  90.314   0.111  14.189
  414    HA   LYS  55           HA       LYS  55  88.185   0.994  14.322
  415    HB2  LYS  55           HB2      LYS  55  88.750   0.615  17.267
  416    HB3  LYS  55           HB3      LYS  55  87.169   1.031  16.608
  417    HG2  LYS  55           HG2      LYS  55  87.139  -1.024  15.285
  418    HG3  LYS  55           HG3      LYS  55  88.763  -1.432  15.841
  419    HD2  LYS  55           HD2      LYS  55  87.832  -1.350  18.214
  420    HD3  LYS  55           HD3      LYS  55  86.228  -1.289  17.483
  421    HE2  LYS  55           HE2      LYS  55  86.686  -3.402  16.293
  422    HE3  LYS  55           HE3      LYS  55  88.288  -3.467  17.028
  423    HZ1  LYS  55           HZ1      LYS  55  85.985  -3.161  18.801
  424    HZ2  LYS  55           HZ2      LYS  55  87.448  -3.987  19.055
  425    HZ3  LYS  55           HZ3      LYS  55  86.232  -4.683  18.094
  426    H    GLY  56           H        GLY  56  89.587   2.963  13.573
  427    HA2  GLY  56           HA2      GLY  56  89.705   5.124  15.525
  428    HA3  GLY  56           HA3      GLY  56  90.256   5.191  13.854
  429    H    ILE  57           H        ILE  57  87.878   4.289  12.596
  430    HA   ILE  57           HA       ILE  57  85.801   6.193  13.419
  431    HB   ILE  57           HB       ILE  57  85.651   7.213  11.229
  432   HG12  ILE  57          HG12      ILE  57  87.670   6.657   9.640
  433   HG13  ILE  57          HG13      ILE  57  87.754   5.155  10.558
  434   HG21  ILE  57          HG21      ILE  57  88.557   7.204  12.081
  435   HG22  ILE  57          HG22      ILE  57  87.294   8.088  12.937
  436   HG23  ILE  57          HG23      ILE  57  87.686   8.504  11.269
  437   HD11  ILE  57          HD11      ILE  57  85.857   4.329   9.607
  438   HD12  ILE  57          HD12      ILE  57  86.170   5.529   8.359
  439   HD13  ILE  57          HD13      ILE  57  85.031   5.885   9.652
  440    H    THR  58           H        THR  58  83.896   5.974  11.743
  441    HA   THR  58           HA       THR  58  83.467   3.076  11.333
  442    HB   THR  58           HB       THR  58  81.512   5.283  11.996
  443    HG1  THR  58           HG1      THR  58  82.765   3.205  13.353
  444   HG21  THR  58          HG21      THR  58  80.381   3.826  10.473
  445   HG22  THR  58          HG22      THR  58  79.875   3.336  12.090
  446   HG23  THR  58          HG23      THR  58  81.084   2.394  11.222
  447    H    TRP  59           H        TRP  59  82.687   2.328   9.411
  448    HA   TRP  59           HA       TRP  59  83.102   3.867   7.073
  449    HB2  TRP  59           HB2      TRP  59  81.310   1.446   7.219
  450    HB3  TRP  59           HB1      TRP  59  82.275   2.015   5.856
  451    HD1  TRP  59           HD1      TRP  59  85.018   2.478   7.317
  452    HE1  TRP  59           HE1      TRP  59  86.399   0.452   8.119
  453    HE3  TRP  59           HE3      TRP  59  81.354  -1.063   7.561
  454    HZ2  TRP  59           HZ2      TRP  59  85.988  -2.299   8.808
  455    HZ3  TRP  59           HZ3      TRP  59  81.874  -3.372   8.284
  456    HH2  TRP  59           HH2      TRP  59  84.187  -3.993   8.908
  457    H    LYS  60           H        LYS  60  81.766   5.097   5.876
  458    HA   LYS  60           HA       LYS  60  78.889   5.023   6.218
  459    HB2  LYS  60           HB2      LYS  60  80.488   7.473   7.013
  460    HB3  LYS  60           HB3      LYS  60  78.739   7.441   6.803
  461    HG2  LYS  60           HG2      LYS  60  78.691   5.555   8.514
  462    HG3  LYS  60           HG3      LYS  60  80.378   5.946   8.856
  463    HD2  LYS  60           HD2      LYS  60  78.056   7.887   9.042
  464    HD3  LYS  60           HD3      LYS  60  78.859   7.118  10.413
  465    HE2  LYS  60           HE2      LYS  60  80.044   9.102  10.347
  466    HE3  LYS  60           HE3      LYS  60  81.030   8.145   9.244
  467    HZ1  LYS  60           HZ1      LYS  60  80.608   9.661   7.706
  468    HZ2  LYS  60           HZ2      LYS  60  79.505  10.471   8.712
  469    HZ3  LYS  60           HZ3      LYS  60  78.978   9.192   7.725
  470    H    GLU  61           H        GLU  61  78.393   7.563   5.055
  471    HA   GLU  61           HA       GLU  61  78.941   6.944   2.309
  472    HB2  GLU  61           HB2      GLU  61  76.846   8.071   3.190
  473    HB3  GLU  61           HB3      GLU  61  77.816   9.529   3.396
  474    HG2  GLU  61           HG2      GLU  61  78.455   9.366   0.970
  475    HG3  GLU  61           HG3      GLU  61  77.307   8.038   0.809
  476    H    GLU  62           H        GLU  62  79.761   9.775   4.342
  477    HA   GLU  62           HA       GLU  62  81.593  10.862   2.456
  478    HB2  GLU  62           HB2      GLU  62  81.460  11.349   5.440
  479    HB3  GLU  62           HB3      GLU  62  82.226  12.388   4.238
  480    HG2  GLU  62           HG2      GLU  62  80.084  12.825   3.175
  481    HG3  GLU  62           HG3      GLU  62  79.281  11.674   4.242
  482    H    THR  63           H        THR  63  82.114   9.081   5.502
  483    HA   THR  63           HA       THR  63  84.854   9.029   5.603
  484    HB   THR  63           HB       THR  63  84.634   6.826   6.721
  485    HG1  THR  63           HG1      THR  63  82.133   6.432   6.865
  486   HG21  THR  63          HG21      THR  63  82.409   8.733   7.459
  487   HG22  THR  63          HG22      THR  63  84.104   8.983   7.873
  488   HG23  THR  63          HG23      THR  63  83.231   7.599   8.531
  489    H    LEU  64           H        LEU  64  82.715   7.101   3.571
  490    HA   LEU  64           HA       LEU  64  84.790   5.453   2.505
  491    HB2  LEU  64           HB2      LEU  64  81.916   5.839   2.050
  492    HB3  LEU  64           HB3      LEU  64  82.815   5.416   0.600
  493    HG   LEU  64           HG       LEU  64  83.135   3.879   3.183
  494   HD11  LEU  64          HD11      LEU  64  81.009   3.164   2.877
  495   HD12  LEU  64          HD12      LEU  64  81.633   2.285   1.481
  496   HD13  LEU  64          HD13      LEU  64  80.908   3.876   1.269
  497   HD21  LEU  64          HD21      LEU  64  84.920   3.368   1.718
  498   HD22  LEU  64          HD22      LEU  64  83.897   3.476   0.286
  499   HD23  LEU  64          HD23      LEU  64  83.746   2.100   1.375
  500    H    MET  65           H        MET  65  83.362   8.547   1.604
  501    HA   MET  65           HA       MET  65  84.399   8.731  -1.008
  502    HB2  MET  65           HB2      MET  65  83.773  10.904   0.999
  503    HB3  MET  65           HB1      MET  65  84.136  11.193  -0.702
  504    HG2  MET  65           HG2      MET  65  82.213   9.960  -1.415
  505    HG3  MET  65           HG1      MET  65  81.937   9.333   0.207
  506    HE1  MET  65           HE1      MET  65  82.037  12.190  -2.165
  507    HE2  MET  65           HE2      MET  65  80.722  13.247  -1.654
  508    HE3  MET  65           HE3      MET  65  80.365  11.612  -2.202
  509    H    GLU  66           H        GLU  66  85.702  10.156   2.003
  510    HA   GLU  66           HA       GLU  66  88.117  11.061   0.872
  511    HB2  GLU  66           HB2      GLU  66  87.486  10.211   3.711
  512    HB3  GLU  66           HB3      GLU  66  88.956  11.056   3.224
  513    HG2  GLU  66           HG2      GLU  66  86.165  12.114   2.711
  514    HG3  GLU  66           HG3      GLU  66  87.141  12.569   4.107
  515    H    TYR  67           H        TYR  67  87.073   7.959   2.059
  516    HA   TYR  67           HA       TYR  67  89.699   6.759   2.071
  517    HB2  TYR  67           HB2      TYR  67  88.085   5.855   3.584
  518    HB3  TYR  67           HB3      TYR  67  86.897   5.667   2.301
  519    HD1  TYR  67           HD1      TYR  67  89.977   4.314   3.791
  520    HD2  TYR  67           HD2      TYR  67  87.052   3.849   0.679
  521    HE1  TYR  67           HE1      TYR  67  90.812   2.021   3.349
  522    HE2  TYR  67           HE2      TYR  67  87.890   1.557   0.235
  523    HH   TYR  67           HH       TYR  67  89.483   0.063   0.693
  524    H    LEU  68           H        LEU  68  87.109   7.215  -0.206
  525    HA   LEU  68           HA       LEU  68  88.077   5.217  -2.069
  526    HB2  LEU  68           HB2      LEU  68  85.769   7.091  -1.922
  527    HB3  LEU  68           HB3      LEU  68  86.292   6.592  -3.524
  528    HG   LEU  68           HG       LEU  68  85.689   4.656  -1.273
  529   HD11  LEU  68          HD11      LEU  68  83.583   5.530  -1.742
  530   HD12  LEU  68          HD12      LEU  68  83.665   4.190  -2.881
  531   HD13  LEU  68          HD13      LEU  68  83.963   5.839  -3.435
  532   HD21  LEU  68          HD21      LEU  68  85.386   3.272  -3.574
  533   HD22  LEU  68          HD22      LEU  68  86.918   3.367  -2.711
  534   HD23  LEU  68          HD23      LEU  68  86.619   4.417  -4.091
  535    H    GLU  69           H        GLU  69  89.156   8.216  -1.230
  536    HA   GLU  69           HA       GLU  69  90.104   8.820  -3.969
  537    HB2  GLU  69           HB2      GLU  69  89.974  11.068  -3.518
  538    HB3  GLU  69           HB3      GLU  69  88.699  10.501  -2.447
  539    HG2  GLU  69           HG2      GLU  69  89.931  11.848  -1.003
  540    HG3  GLU  69           HG3      GLU  69  90.653  10.273  -0.696
  541    H    ASN  70           H        ASN  70  90.983   7.607  -0.985
  542    HA   ASN  70           HA       ASN  70  93.702   7.254  -1.684
  543    HB2  ASN  70           HB2      ASN  70  93.464   9.780  -0.950
  544    HB3  ASN  70           HB1      ASN  70  93.484   9.096   0.671
  545   HD21  ASN  70          HD21      ASN  70  95.312   6.949   0.290
  546   HD22  ASN  70          HD22      ASN  70  96.833   7.589  -0.103
  547    HA   PRO  71           HA       PRO  71  91.379   4.497   1.414
  548    HB2  PRO  71           HB2      PRO  71  93.110   2.650  -0.190
  549    HB3  PRO  71           HB1      PRO  71  91.457   2.411   0.405
  550    HG2  PRO  71           HG2      PRO  71  91.966   3.027  -2.147
  551    HG3  PRO  71           HG1      PRO  71  90.520   3.612  -1.306
  552    HD2  PRO  71           HD2      PRO  71  92.935   5.118  -2.146
  553    HD3  PRO  71           HD1      PRO  71  91.293   5.711  -1.819
  554    H    LYS  72           H        LYS  72  94.778   4.610   0.392
  555    HA   LYS  72           HA       LYS  72  95.763   3.285   2.737
  556    HB2  LYS  72           HB2      LYS  72  96.929   3.291   0.531
  557    HB3  LYS  72           HB3      LYS  72  97.280   5.001   0.768
  558    HG2  LYS  72           HG2      LYS  72  99.105   4.437   1.971
  559    HG3  LYS  72           HG3      LYS  72  98.053   3.693   3.172
  560    HD2  LYS  72           HD2      LYS  72  98.946   2.252   0.660
  561    HD3  LYS  72           HD3      LYS  72  99.832   2.164   2.182
  562    HE2  LYS  72           HE2      LYS  72  96.936   1.359   1.766
  563    HE3  LYS  72           HE3      LYS  72  98.295   0.259   1.989
  564    HZ1  LYS  72           HZ1      LYS  72  97.067   2.100   3.936
  565    HZ2  LYS  72           HZ2      LYS  72  98.673   1.581   4.138
  566    HZ3  LYS  72           HZ3      LYS  72  97.408   0.447   4.100
  567    H    LYS  73           H        LYS  73  95.773   6.682   1.655
  568    HA   LYS  73           HA       LYS  73  97.131   7.673   3.918
  569    HB2  LYS  73           HB2      LYS  73  96.857   8.870   1.728
  570    HB3  LYS  73           HB3      LYS  73  95.192   9.215   2.195
  571    HG2  LYS  73           HG2      LYS  73  96.002  10.350   4.238
  572    HG3  LYS  73           HG3      LYS  73  97.665  10.019   3.755
  573    HD2  LYS  73           HD2      LYS  73  97.416  12.166   2.909
  574    HD3  LYS  73           HD3      LYS  73  96.909  11.221   1.510
  575    HE2  LYS  73           HE2      LYS  73  95.295  13.018   1.942
  576    HE3  LYS  73           HE3      LYS  73  94.545  11.449   2.236
  577    HZ1  LYS  73           HZ1      LYS  73  95.875  12.666   4.510
  578    HZ2  LYS  73           HZ2      LYS  73  94.400  11.827   4.432
  579    HZ3  LYS  73           HZ3      LYS  73  94.477  13.460   3.972
  580    H    TYR  74           H        TYR  74  93.754   6.924   3.377
  581    HA   TYR  74           HA       TYR  74  92.707   8.501   5.497
  582    HB2  TYR  74           HB2      TYR  74  91.519   7.220   3.502
  583    HB3  TYR  74           HB3      TYR  74  91.383   5.940   4.703
  584    HD1  TYR  74           HD1      TYR  74  90.969   9.673   4.524
  585    HD2  TYR  74           HD2      TYR  74  89.439   5.941   6.004
  586    HE1  TYR  74           HE1      TYR  74  89.064  10.867   5.570
  587    HE2  TYR  74           HE2      TYR  74  87.538   7.135   7.049
  588    HH   TYR  74           HH       TYR  74  87.274   9.779   7.906
  589    H    ILE  75           H        ILE  75  93.329   4.984   5.336
  590    HA   ILE  75           HA       ILE  75  93.772   5.027   8.264
  591    HB   ILE  75           HB       ILE  75  92.686   2.645   6.769
  592   HG12  ILE  75          HG12      ILE  75  91.168   4.927   8.070
  593   HG13  ILE  75          HG13      ILE  75  91.110   4.449   6.375
  594   HG21  ILE  75          HG21      ILE  75  92.089   1.872   8.945
  595   HG22  ILE  75          HG22      ILE  75  92.346   3.463   9.662
  596   HG23  ILE  75          HG23      ILE  75  93.723   2.510   9.111
  597   HD11  ILE  75          HD11      ILE  75  90.285   2.179   7.162
  598   HD12  ILE  75          HD12      ILE  75  89.161   3.516   7.402
  599   HD13  ILE  75          HD13      ILE  75  90.098   2.895   8.762
  600    HA   PRO  76           HA       PRO  76  97.675   3.852   5.867
  601    HB2  PRO  76           HB2      PRO  76  98.558   4.681   8.615
  602    HB3  PRO  76           HB1      PRO  76  99.337   4.978   7.047
  603    HG2  PRO  76           HG2      PRO  76  97.928   6.875   8.285
  604    HG3  PRO  76           HG1      PRO  76  97.926   6.712   6.520
  605    HD2  PRO  76           HD2      PRO  76  95.759   6.104   8.452
  606    HD3  PRO  76           HD1      PRO  76  95.653   6.473   6.718
  607    H    GLY  77           H        GLY  77  98.159   1.740   5.792
  608    HA2  GLY  77           HA2      GLY  77  99.211  -0.139   6.998
  609    HA3  GLY  77           HA3      GLY  77  98.055   0.150   8.294
  610    H    THR  78           H        THR  78  95.915   0.729   6.286
  611    HA   THR  78           HA       THR  78  94.677  -1.767   6.186
  612    HB   THR  78           HB       THR  78  93.523   0.420   5.888
  613    HG1  THR  78           HG1      THR  78  92.881  -1.806   4.963
  614   HG21  THR  78          HG21      THR  78  93.649   1.591   3.816
  615   HG22  THR  78          HG22      THR  78  94.541   0.276   3.049
  616   HG23  THR  78          HG23      THR  78  95.316   1.263   4.289
  617    H    LYS  79           H        LYS  79  94.606  -3.416   4.701
  618    HA   LYS  79           HA       LYS  79  96.768  -3.436   2.738
  619    HB2  LYS  79           HB2      LYS  79  95.803  -5.366   4.398
  620    HB3  LYS  79           HB3      LYS  79  94.948  -5.768   2.913
  621    HG2  LYS  79           HG2      LYS  79  96.927  -6.973   2.644
  622    HG3  LYS  79           HG3      LYS  79  97.318  -5.475   1.799
  623    HD2  LYS  79           HD2      LYS  79  98.432  -4.609   3.813
  624    HD3  LYS  79           HD3      LYS  79  98.012  -6.080   4.690
  625    HE2  LYS  79           HE2      LYS  79  99.376  -7.426   3.205
  626    HE3  LYS  79           HE3      LYS  79  99.683  -6.037   2.162
  627    HZ1  LYS  79           HZ1      LYS  79 100.624  -4.969   4.264
  628    HZ2  LYS  79           HZ2      LYS  79 101.559  -6.164   3.497
  629    HZ3  LYS  79           HZ3      LYS  79 100.673  -6.542   4.896
  630    H    MET  80           H        MET  80  96.058  -2.034   1.128
  631    HA   MET  80           HA       MET  80  94.485  -3.183  -0.925
  632    HB2  MET  80           HB2      MET  80  92.574  -2.607   0.473
  633    HB3  MET  80           HB1      MET  80  93.156  -0.949   0.630
  634    HG2  MET  80           HG2      MET  80  92.858  -0.546  -1.737
  635    HG3  MET  80           HG1      MET  80  92.501  -2.247  -2.030
  636    HE1  MET  80           HE1      MET  80  90.562  -0.419  -3.296
  637    HE2  MET  80           HE2      MET  80  91.074   0.892  -2.239
  638    HE3  MET  80           HE3      MET  80  89.374   0.439  -2.305
  639    H    ILE  81           H        ILE  81  96.175  -2.604  -2.239
  640    HA   ILE  81           HA       ILE  81  96.741   0.284  -2.530
  641    HB   ILE  81           HB       ILE  81  98.374  -2.187  -3.120
  642   HG12  ILE  81          HG12      ILE  81 100.038  -0.945  -1.743
  643   HG13  ILE  81          HG13      ILE  81  98.869   0.358  -1.537
  644   HG21  ILE  81          HG21      ILE  81  98.656   0.611  -4.221
  645   HG22  ILE  81          HG22      ILE  81  98.746  -0.922  -5.086
  646   HG23  ILE  81          HG23      ILE  81 100.061  -0.435  -4.017
  647   HD11  ILE  81          HD11      ILE  81  99.117  -1.633   0.249
  648   HD12  ILE  81          HD12      ILE  81  97.956  -2.396  -0.836
  649   HD13  ILE  81          HD13      ILE  81  97.571  -0.852  -0.073
  650    H    PHE  82           H        PHE  82  95.190   0.953  -3.950
  651    HA   PHE  82           HA       PHE  82  95.391  -0.087  -6.682
  652    HB2  PHE  82           HB2      PHE  82  93.495  -1.263  -5.411
  653    HB3  PHE  82           HB1      PHE  82  92.679   0.301  -5.418
  654    HD1  PHE  82           HD2      PHE  82  94.373  -2.131  -7.708
  655    HD2  PHE  82           HD1      PHE  82  91.407   0.947  -7.284
  656    HE1  PHE  82           HE2      PHE  82  93.617  -2.541 -10.034
  657    HE2  PHE  82           HE1      PHE  82  90.650   0.538  -9.610
  658    HZ   PHE  82           HZ       PHE  82  91.755  -1.205 -10.986
  659    H    ALA  83           H        ALA  83  93.846   1.324  -8.124
  660    HA   ALA  83           HA       ALA  83  94.696   4.047  -7.762
  661    HB1  ALA  83           HB1      ALA  83  93.805   4.443  -9.915
  662    HB2  ALA  83           HB2      ALA  83  92.685   3.086  -9.792
  663    HB3  ALA  83           HB3      ALA  83  94.413   2.789  -9.983
  664    H    GLY  84           H        GLY  84  93.719   5.303  -6.298
  665    HA2  GLY  84           HA2      GLY  84  91.133   4.927  -5.249
  666    HA3  GLY  84           HA3      GLY  84  92.067   6.416  -5.142
  667    H    ILE  85           H        ILE  85  89.914   7.430  -5.391
  668    HA   ILE  85           HA       ILE  85  88.925   7.405  -8.174
  669    HB   ILE  85           HB       ILE  85  87.653   8.377  -5.607
  670   HG12  ILE  85          HG12      ILE  85  87.851   5.828  -6.326
  671   HG13  ILE  85          HG13      ILE  85  86.338   6.456  -5.685
  672   HG21  ILE  85          HG21      ILE  85  85.629   8.562  -7.218
  673   HG22  ILE  85          HG22      ILE  85  86.838   8.605  -8.497
  674   HG23  ILE  85          HG23      ILE  85  86.833   9.850  -7.249
  675   HD11  ILE  85          HD11      ILE  85  86.875   6.501  -8.648
  676   HD12  ILE  85          HD12      ILE  85  85.328   6.563  -7.805
  677   HD13  ILE  85          HD13      ILE  85  86.241   5.055  -7.864
  678    H    LYS  86           H        LYS  86  88.347   9.487  -9.145
  679    HA   LYS  86           HA       LYS  86  90.295  11.560  -8.382
  680    HB2  LYS  86           HB2      LYS  86  89.999  10.413 -10.774
  681    HB3  LYS  86           HB3      LYS  86  88.798  11.689 -10.959
  682    HG2  LYS  86           HG2      LYS  86  90.721  12.778 -11.706
  683    HG3  LYS  86           HG3      LYS  86  90.714  13.233 -10.003
  684    HD2  LYS  86           HD2      LYS  86  92.907  12.490 -10.240
  685    HD3  LYS  86           HD3      LYS  86  92.116  11.003  -9.721
  686    HE2  LYS  86           HE2      LYS  86  93.356  10.313 -11.596
  687    HE3  LYS  86           HE3      LYS  86  91.750  10.585 -12.269
  688    HZ1  LYS  86           HZ1      LYS  86  92.621  12.077 -13.626
  689    HZ2  LYS  86           HZ2      LYS  86  94.161  11.845 -12.948
  690    HZ3  LYS  86           HZ3      LYS  86  93.113  13.016 -12.304
  691    H    LYS  87           H        LYS  87  87.097  11.652  -9.992
  692    HA   LYS  87           HA       LYS  87  86.551  14.250  -8.873
  693    HB2  LYS  87           HB2      LYS  87  84.824  12.363 -10.483
  694    HB3  LYS  87           HB3      LYS  87  84.384  14.017 -10.059
  695    HG2  LYS  87           HG2      LYS  87  86.318  14.884 -11.269
  696    HG3  LYS  87           HG3      LYS  87  86.865  13.243 -11.621
  697    HD2  LYS  87           HD2      LYS  87  84.823  12.821 -12.920
  698    HD3  LYS  87           HD3      LYS  87  84.234  14.441 -12.542
  699    HE2  LYS  87           HE2      LYS  87  86.146  15.437 -13.707
  700    HE3  LYS  87           HE3      LYS  87  86.799  13.832 -14.042
  701    HZ1  LYS  87           HZ1      LYS  87  84.465  15.172 -15.206
  702    HZ2  LYS  87           HZ2      LYS  87  84.443  13.478 -15.072
  703    HZ3  LYS  87           HZ3      LYS  87  85.668  14.246 -15.964
  704    H    LYS  88           H        LYS  88  84.620  14.772  -7.651
  705    HA   LYS  88           HA       LYS  88  84.324  13.102  -5.350
  706    HB2  LYS  88           HB2      LYS  88  84.141  15.631  -5.396
  707    HB3  LYS  88           HB3      LYS  88  82.552  15.419  -6.129
  708    HG2  LYS  88           HG2      LYS  88  82.051  13.847  -4.134
  709    HG3  LYS  88           HG3      LYS  88  83.476  14.565  -3.384
  710    HD2  LYS  88           HD2      LYS  88  81.838  16.007  -2.597
  711    HD3  LYS  88           HD3      LYS  88  82.289  16.840  -4.084
  712    HE2  LYS  88           HE2      LYS  88  80.428  15.744  -5.272
  713    HE3  LYS  88           HE3      LYS  88  79.982  14.890  -3.796
  714    HZ1  LYS  88           HZ1      LYS  88  78.650  16.656  -3.511
  715    HZ2  LYS  88           HZ2      LYS  88  79.561  17.662  -4.534
  716    HZ3  LYS  88           HZ3      LYS  88  80.054  17.407  -2.928
  717    H    THR  89           H        THR  89  82.353  13.771  -8.211
  718    HA   THR  89           HA       THR  89  80.047  12.362  -7.323
  719    HB   THR  89           HB       THR  89  79.445  12.322  -9.752
  720    HG1  THR  89           HG1      THR  89  81.042  13.835 -10.898
  721   HG21  THR  89          HG21      THR  89  79.232  14.771  -9.940
  722   HG22  THR  89          HG22      THR  89  80.428  14.975  -8.659
  723   HG23  THR  89          HG23      THR  89  78.868  14.233  -8.300
  724    H    GLU  90           H        GLU  90  83.090  11.368  -8.633
  725    HA   GLU  90           HA       GLU  90  82.253   8.842  -9.654
  726    HB2  GLU  90           HB2      GLU  90  84.911  10.006  -8.863
  727    HB3  GLU  90           HB3      GLU  90  84.764   8.298  -9.285
  728    HG2  GLU  90           HG2      GLU  90  84.058   8.779 -11.483
  729    HG3  GLU  90           HG3      GLU  90  83.657  10.449 -11.085
  730    H    ARG  91           H        ARG  91  83.545   9.926  -6.510
  731    HA   ARG  91           HA       ARG  91  83.411   7.267  -5.393
  732    HB2  ARG  91           HB2      ARG  91  83.386   9.179  -3.284
  733    HB3  ARG  91           HB3      ARG  91  84.732   8.188  -3.828
  734    HG2  ARG  91           HG2      ARG  91  85.228   9.929  -5.563
  735    HG3  ARG  91           HG3      ARG  91  83.976  10.934  -4.839
  736    HD2  ARG  91           HD2      ARG  91  85.239  10.576  -2.616
  737    HD3  ARG  91           HD3      ARG  91  86.574  10.010  -3.613
  738    HE   ARG  91           HE       ARG  91  85.693  12.742  -3.308
  739   HH11  ARG  91          HH21      ARG  91  87.235  10.434  -5.379
  740   HH12  ARG  91          HH22      ARG  91  88.143  11.622  -6.252
  741   HH21  ARG  91          HH11      ARG  91  86.881  14.300  -4.451
  742   HH22  ARG  91          HH12      ARG  91  87.943  13.809  -5.728
  743    H    GLU  92           H        GLU  92  81.482  10.246  -5.165
  744    HA   GLU  92           HA       GLU  92  79.546   9.379  -3.355
  745    HB2  GLU  92           HB2      GLU  92  79.859  11.703  -4.455
  746    HB3  GLU  92           HB3      GLU  92  78.857  11.065  -5.759
  747    HG2  GLU  92           HG2      GLU  92  77.163  10.411  -3.976
  748    HG3  GLU  92           HG3      GLU  92  78.116  11.365  -2.841
  749    H    ASP  93           H        ASP  93  79.466   9.211  -6.924
  750    HA   ASP  93           HA       ASP  93  77.067   7.745  -7.125
  751    HB2  ASP  93           HB2      ASP  93  79.461   7.887  -8.972
  752    HB3  ASP  93           HB1      ASP  93  77.935   7.111  -9.393
  753    H    LEU  94           H        LEU  94  80.462   6.680  -7.095
  754    HA   LEU  94           HA       LEU  94  80.032   3.925  -7.341
  755    HB2  LEU  94           HB2      LEU  94  82.267   4.906  -7.509
  756    HB3  LEU  94           HB3      LEU  94  82.184   5.403  -5.822
  757    HG   LEU  94           HG       LEU  94  82.108   3.099  -5.078
  758   HD11  LEU  94          HD11      LEU  94  81.821   2.581  -8.025
  759   HD12  LEU  94          HD12      LEU  94  80.898   1.907  -6.682
  760   HD13  LEU  94          HD13      LEU  94  82.542   1.352  -6.987
  761   HD21  LEU  94          HD21      LEU  94  84.339   2.485  -5.603
  762   HD22  LEU  94          HD22      LEU  94  84.314   4.241  -5.733
  763   HD23  LEU  94          HD23      LEU  94  84.264   3.247  -7.189
  764    H    ILE  95           H        ILE  95  79.855   6.068  -4.583
  765    HA   ILE  95           HA       ILE  95  79.640   3.954  -2.668
  766    HB   ILE  95           HB       ILE  95  79.392   6.936  -2.559
  767   HG12  ILE  95          HG12      ILE  95  81.025   5.359  -0.646
  768   HG13  ILE  95          HG13      ILE  95  81.502   5.202  -2.330
  769   HG21  ILE  95          HG21      ILE  95  77.690   6.491  -1.026
  770   HG22  ILE  95          HG22      ILE  95  79.106   6.419   0.022
  771   HG23  ILE  95          HG23      ILE  95  78.371   4.930  -0.572
  772   HD11  ILE  95          HD11      ILE  95  80.972   7.979  -1.460
  773   HD12  ILE  95          HD12      ILE  95  82.288   7.330  -2.436
  774   HD13  ILE  95          HD13      ILE  95  82.349   7.205  -0.682
  775    H    ALA  96           H        ALA  96  77.445   5.855  -4.592
  776    HA   ALA  96           HA       ALA  96  75.059   5.316  -3.172
  777    HB1  ALA  96           HB1      ALA  96  73.910   5.951  -5.194
  778    HB2  ALA  96           HB2      ALA  96  75.346   5.640  -6.168
  779    HB3  ALA  96           HB3      ALA  96  75.324   6.994  -5.037
  780    H    TYR  97           H        TYR  97  76.916   3.549  -5.574
  781    HA   TYR  97           HA       TYR  97  74.979   1.450  -5.903
  782    HB2  TYR  97           HB2      TYR  97  76.472   1.801  -7.734
  783    HB3  TYR  97           HB3      TYR  97  77.887   1.717  -6.685
  784    HD1  TYR  97           HD1      TYR  97  75.024  -0.286  -8.001
  785    HD2  TYR  97           HD2      TYR  97  78.913  -0.362  -6.180
  786    HE1  TYR  97           HE1      TYR  97  75.133  -2.740  -8.336
  787    HE2  TYR  97           HE2      TYR  97  79.021  -2.816  -6.515
  788    HH   TYR  97           HH       TYR  97  76.366  -4.570  -8.127
  789    H    LEU  98           H        LEU  98  78.126   1.725  -4.224
  790    HA   LEU  98           HA       LEU  98  78.277  -0.808  -3.128
  791    HB2  LEU  98           HB2      LEU  98  79.204   1.884  -2.172
  792    HB3  LEU  98           HB3      LEU  98  79.434   0.466  -1.158
  793    HG   LEU  98           HG       LEU  98  80.269   0.330  -4.042
  794   HD11  LEU  98          HD11      LEU  98  81.235   2.447  -3.044
  795   HD12  LEU  98          HD12      LEU  98  82.432   1.263  -3.560
  796   HD13  LEU  98          HD13      LEU  98  82.040   1.432  -1.850
  797   HD21  LEU  98          HD21      LEU  98  81.433  -0.809  -1.487
  798   HD22  LEU  98          HD22      LEU  98  81.889  -1.249  -3.134
  799   HD23  LEU  98          HD23      LEU  98  80.287  -1.661  -2.521
  800    H    LYS  99           H        LYS  99  76.118   1.785  -2.351
  801    HA   LYS  99           HA       LYS  99  75.372   0.777   0.249
  802    HB2  LYS  99           HB2      LYS  99  74.393   2.968  -1.552
  803    HB3  LYS  99           HB3      LYS  99  73.400   2.449  -0.191
  804    HG2  LYS  99           HG2      LYS  99  75.466   2.760   1.275
  805    HG3  LYS  99           HG3      LYS  99  76.212   3.566  -0.104
  806    HD2  LYS  99           HD2      LYS  99  73.538   4.399   1.049
  807    HD3  LYS  99           HD3      LYS  99  75.069   5.113   1.551
  808    HE2  LYS  99           HE2      LYS  99  75.497   5.609  -0.915
  809    HE3  LYS  99           HE3      LYS  99  73.810   5.181  -1.197
  810    HZ1  LYS  99           HZ1      LYS  99  74.678   7.633  -0.521
  811    HZ2  LYS  99           HZ2      LYS  99  74.221   7.010   0.992
  812    HZ3  LYS  99           HZ3      LYS  99  73.096   7.071  -0.279
  813    H    LYS 100           H        LYS 100  73.736   0.953  -2.921
  814    HA   LYS 100           HA       LYS 100  71.563  -0.717  -2.045
  815    HB2  LYS 100           HB2      LYS 100  72.398   0.134  -4.828
  816    HB3  LYS 100           HB3      LYS 100  70.874  -0.653  -4.414
  817    HG2  LYS 100           HG2      LYS 100  70.491   1.267  -2.769
  818    HG3  LYS 100           HG3      LYS 100  71.840   2.083  -3.560
  819    HD2  LYS 100           HD2      LYS 100  70.626   1.739  -5.758
  820    HD3  LYS 100           HD3      LYS 100  69.232   1.203  -4.821
  821    HE2  LYS 100           HE2      LYS 100  70.540   3.925  -4.826
  822    HE3  LYS 100           HE3      LYS 100  68.862   3.521  -5.190
  823    HZ1  LYS 100           HZ1      LYS 100  68.638   4.212  -3.055
  824    HZ2  LYS 100           HZ2      LYS 100  70.208   3.743  -2.604
  825    HZ3  LYS 100           HZ3      LYS 100  68.980   2.579  -2.753
  826    H    ALA 101           H        ALA 101  74.719  -1.283  -3.186
  827    HA   ALA 101           HA       ALA 101  74.166  -3.929  -4.266
  828    HB1  ALA 101           HB1      ALA 101  76.450  -3.995  -4.875
  829    HB2  ALA 101           HB2      ALA 101  76.885  -2.755  -3.697
  830    HB3  ALA 101           HB3      ALA 101  75.963  -2.321  -5.136
  831    H    THR 102           H        THR 102  75.351  -2.446  -1.326
  832    HA   THR 102           HA       THR 102  76.150  -5.019  -0.189
  833    HB   THR 102           HB       THR 102  76.758  -3.638   1.795
  834    HG1  THR 102           HG1      THR 102  75.516  -1.706   0.196
  835   HG21  THR 102          HG21      THR 102  77.789  -2.992  -0.955
  836   HG22  THR 102          HG22      THR 102  78.559  -3.923   0.329
  837   HG23  THR 102          HG23      THR 102  78.455  -2.167   0.455
  838    H    ASN 103           H        ASN 103  73.350  -3.324  -0.627
  839    HA   ASN 103           HA       ASN 103  72.102  -4.128   1.905
  840    HB2  ASN 103           HB2      ASN 103  71.313  -2.345  -0.384
  841    HB3  ASN 103           HB1      ASN 103  70.102  -2.935   0.746
  842   HD21  ASN 103          HD21      ASN 103  73.414  -2.285   1.786
  843   HD22  ASN 103          HD22      ASN 103  73.032  -0.926   2.726
  844    H    GLU 104           H        GLU 104  72.310  -5.010  -1.441
  845    HA   GLU 104           HA       GLU 104  69.990  -6.793  -1.285
  846    HB2  GLU 104           HB2      GLU 104  71.909  -6.219  -3.556
  847    HB3  GLU 104           HB3      GLU 104  70.459  -7.218  -3.668
  848    HG2  GLU 104           HG2      GLU 104  70.332  -4.365  -2.690
  849    HG3  GLU 104           HG3      GLU 104  70.256  -4.753  -4.408
  850    HHA  HEC 201           HA       HEC 105  89.522  -3.610   3.133
  851    HHB  HEC 201           HB       HEC 105  85.680  -0.082  -0.437
  852    HHC  HEC 201           HC       HEC 105  88.892  -1.832  -5.600
  853    HHD  HEC 201           HD       HEC 105  92.337  -5.810  -2.084
  854   HMA1  HEC 201          HMA1      HEC 105  85.369  -0.500   3.302
  855   HMA2  HEC 201          HMA2      HEC 105  84.739  -0.413   1.658
  856   HMA3  HEC 201          HMA3      HEC 105  85.905   0.786   2.221
  857   HAA1  HEC 201          HAA1      HEC 105  87.324  -0.921   4.448
  858   HAA2  HEC 201          HAA2      HEC 105  88.588  -2.131   4.392
  859   HBA1  HEC 201          HBA1      HEC 105  87.146  -3.856   4.810
  860   HBA2  HEC 201          HBA2      HEC 105  85.816  -3.105   3.938
  861   HMB1  HEC 201          HMB1      HEC 105  85.198   1.404  -2.243
  862   HMB2  HEC 201          HMB2      HEC 105  84.215   0.019  -2.714
  863   HMB3  HEC 201          HMB3      HEC 105  84.888   1.079  -3.945
  864    HAB  HEC 201           HAB      HEC 105  87.360  -0.655  -6.237
  865   HBB1  HEC 201          HBB1      HEC 105  87.968   1.569  -6.042
  866   HBB2  HEC 201          HBB2      HEC 105  86.282   1.755  -6.519
  867   HBB3  HEC 201          HBB3      HEC 105  86.743   1.911  -4.825
  868   HMC1  HEC 201          HMC1      HEC 105  89.833  -3.391  -6.952
  869   HMC2  HEC 201          HMC2      HEC 105  91.291  -4.374  -6.998
  870   HMC3  HEC 201          HMC3      HEC 105  91.409  -2.634  -6.744
  871    HAC  HEC 201           HAC      HEC 105  92.774  -6.212  -4.015
  872   HBC1  HEC 201          HBC1      HEC 105  94.439  -5.063  -5.065
  873   HBC2  HEC 201          HBC2      HEC 105  93.307  -4.053  -5.962
  874   HBC3  HEC 201          HBC3      HEC 105  93.696  -5.671  -6.543
  875   HMD1  HEC 201          HMD1      HEC 105  93.582  -6.347  -0.317
  876   HMD2  HEC 201          HMD2      HEC 105  92.458  -7.562   0.289
  877   HMD3  HEC 201          HMD3      HEC 105  93.432  -6.618   1.414
  878   HAD1  HEC 201          HAD1      HEC 105  92.097  -6.384   3.077
  879   HAD2  HEC 201          HAD2      HEC 105  90.548  -5.728   3.559
  880   HBD1  HEC 201          HBD1      HEC 105  91.769  -3.445   3.653
  881   HBD2  HEC 201          HBD2      HEC 105  93.246  -4.404   3.641
  882    H1   HOH 301           H2       HOH 200  81.688   3.155  -0.699
  883    H2   HOH 301           H1       HOH 200  80.592   2.109  -0.678
  884    H1   HOH 302           H2       HOH 201  86.489   5.723   5.184
  885    H2   HOH 302           H1       HOH 201  87.215   5.204   6.407
  886    H1   HOH 303           H2       HOH 202  83.792  -5.473   5.890
  887    H2   HOH 303           H1       HOH 202  83.183  -6.618   5.112
  888    H1   HOH 304           H2       HOH 203  82.933  -9.912  -0.075
  889    H2   HOH 304           H1       HOH 203  84.389  -9.533  -0.254
  Start of MODEL   10
    1    H1   GLY   1           H1       GLY   1  76.280   9.241  -6.424
    2    H2   GLY   1           H2       GLY   1  75.122   8.035  -6.726
    3    H3   GLY   1           H3       GLY   1  75.018   8.983  -5.320
    4    HA2  GLY   1           HA2      GLY   1  73.643  10.320  -6.410
    5    HA3  GLY   1           HA3      GLY   1  75.046  10.810  -7.361
    6    H    ASP   2           H        ASP   2  75.356   8.015  -8.384
    7    HA   ASP   2           HA       ASP   2  72.968   7.684 -10.057
    8    HB2  ASP   2           HB2      ASP   2  75.742   8.228 -11.126
    9    HB3  ASP   2           HB1      ASP   2  74.434   7.549 -12.094
   10    H    VAL   3           H        VAL   3  72.718   5.753  -8.856
   11    HA   VAL   3           HA       VAL   3  74.493   3.735  -8.364
   12    HB   VAL   3           HB       VAL   3  72.141   3.657  -7.676
   13   HG11  VAL   3          HG11      VAL   3  71.212   4.592  -9.790
   14   HG12  VAL   3          HG12      VAL   3  70.386   3.116  -9.290
   15   HG13  VAL   3          HG13      VAL   3  71.571   3.064 -10.595
   16   HG21  VAL   3          HG21      VAL   3  72.804   1.314  -9.484
   17   HG22  VAL   3          HG22      VAL   3  71.752   1.292  -8.069
   18   HG23  VAL   3          HG23      VAL   3  73.485   1.547  -7.875
   19    H    GLU   4           H        GLU   4  73.402   4.876 -11.423
   20    HA   GLU   4           HA       GLU   4  73.938   2.512 -12.947
   21    HB2  GLU   4           HB2      GLU   4  73.727   5.417 -13.773
   22    HB3  GLU   4           HB3      GLU   4  73.831   4.060 -14.896
   23    HG2  GLU   4           HG2      GLU   4  71.762   3.126 -14.055
   24    HG3  GLU   4           HG3      GLU   4  71.691   4.328 -12.768
   25    H    LYS   5           H        LYS   5  75.698   5.622 -12.727
   26    HA   LYS   5           HA       LYS   5  78.021   4.519 -14.014
   27    HB2  LYS   5           HB2      LYS   5  77.439   7.139 -12.629
   28    HB3  LYS   5           HB3      LYS   5  79.055   6.738 -13.213
   29    HG2  LYS   5           HG2      LYS   5  78.311   6.575 -15.471
   30    HG3  LYS   5           HG3      LYS   5  76.615   6.565 -14.991
   31    HD2  LYS   5           HD2      LYS   5  78.318   8.925 -14.246
   32    HD3  LYS   5           HD3      LYS   5  77.731   8.787 -15.902
   33    HE2  LYS   5           HE2      LYS   5  75.409   8.542 -15.025
   34    HE3  LYS   5           HE3      LYS   5  76.027   8.796 -13.393
   35    HZ1  LYS   5           HZ1      LYS   5  75.301  10.882 -14.136
   36    HZ2  LYS   5           HZ2      LYS   5  76.025  10.696 -15.662
   37    HZ3  LYS   5           HZ3      LYS   5  76.990  10.931 -14.284
   38    H    GLY   6           H        GLY   6  76.804   4.484 -10.843
   39    HA2  GLY   6           HA2      GLY   6  79.360   4.285  -9.500
   40    HA3  GLY   6           HA3      GLY   6  77.775   3.957  -8.792
   41    H    LYS   7           H        LYS   7  77.015   2.222 -11.009
   42    HA   LYS   7           HA       LYS   7  77.995  -0.260  -9.970
   43    HB2  LYS   7           HB2      LYS   7  75.694  -0.030 -10.779
   44    HB3  LYS   7           HB3      LYS   7  76.286   0.346 -12.395
   45    HG2  LYS   7           HG2      LYS   7  77.539  -2.096 -11.550
   46    HG3  LYS   7           HG3      LYS   7  75.810  -2.238 -11.245
   47    HD2  LYS   7           HD2      LYS   7  75.290  -1.681 -13.544
   48    HD3  LYS   7           HD3      LYS   7  76.980  -1.308 -13.882
   49    HE2  LYS   7           HE2      LYS   7  77.623  -3.548 -13.844
   50    HE3  LYS   7           HE3      LYS   7  76.253  -4.032 -12.844
   51    HZ1  LYS   7           HZ1      LYS   7  75.121  -4.513 -14.665
   52    HZ2  LYS   7           HZ2      LYS   7  76.458  -4.090 -15.624
   53    HZ3  LYS   7           HZ3      LYS   7  75.287  -2.923 -15.232
   54    H    LYS   8           H        LYS   8  78.457   1.558 -13.022
   55    HA   LYS   8           HA       LYS   8  80.115  -0.443 -14.190
   56    HB2  LYS   8           HB2      LYS   8  80.479   1.056 -15.954
   57    HB3  LYS   8           HB3      LYS   8  78.869   1.462 -15.373
   58    HG2  LYS   8           HG2      LYS   8  79.688   3.593 -15.357
   59    HG3  LYS   8           HG3      LYS   8  80.370   3.110 -13.810
   60    HD2  LYS   8           HD2      LYS   8  82.251   3.960 -14.914
   61    HD3  LYS   8           HD3      LYS   8  82.378   2.239 -15.272
   62    HE2  LYS   8           HE2      LYS   8  81.248   2.607 -17.439
   63    HE3  LYS   8           HE3      LYS   8  81.121   4.328 -17.079
   64    HZ1  LYS   8           HZ1      LYS   8  83.430   4.584 -17.162
   65    HZ2  LYS   8           HZ2      LYS   8  83.062   3.599 -18.497
   66    HZ3  LYS   8           HZ3      LYS   8  83.718   2.914 -17.088
   67    H    ILE   9           H        ILE   9  80.754   2.287 -12.066
   68    HA   ILE   9           HA       ILE   9  83.608   2.217 -12.398
   69    HB   ILE   9           HB       ILE   9  81.829   3.463 -10.287
   70   HG12  ILE   9          HG12      ILE   9  83.556   4.776 -12.399
   71   HG13  ILE   9          HG13      ILE   9  81.868   4.364 -12.680
   72   HG21  ILE   9          HG21      ILE   9  83.963   4.726  -9.700
   73   HG22  ILE   9          HG22      ILE   9  84.837   3.514 -10.638
   74   HG23  ILE   9          HG23      ILE   9  83.929   3.034  -9.205
   75   HD11  ILE   9          HD11      ILE   9  81.187   5.750 -10.769
   76   HD12  ILE   9          HD12      ILE   9  82.115   6.711 -11.922
   77   HD13  ILE   9          HD13      ILE   9  82.877   6.137 -10.438
   78    H    PHE  10           H        PHE  10  81.273   0.513 -10.486
   79    HA   PHE  10           HA       PHE  10  83.170  -0.438  -8.526
   80    HB2  PHE  10           HB2      PHE  10  81.041  -0.391  -7.616
   81    HB3  PHE  10           HB1      PHE  10  80.273  -0.908  -9.118
   82    HD1  PHE  10           HD1      PHE  10  80.281  -3.273  -9.795
   83    HD2  PHE  10           HD2      PHE  10  81.997  -2.004  -6.074
   84    HE1  PHE  10           HE1      PHE  10  80.352  -5.629  -9.031
   85    HE2  PHE  10           HE2      PHE  10  82.072  -4.361  -5.305
   86    HZ   PHE  10           HZ       PHE  10  81.250  -6.176  -6.787
   87    H    VAL  11           H        VAL  11  81.360  -1.967 -11.204
   88    HA   VAL  11           HA       VAL  11  82.430  -4.522 -11.013
   89    HB   VAL  11           HB       VAL  11  81.900  -4.750 -13.429
   90   HG11  VAL  11          HG11      VAL  11  79.561  -4.569 -13.139
   91   HG12  VAL  11          HG12      VAL  11  79.717  -3.199 -12.043
   92   HG13  VAL  11          HG13      VAL  11  80.186  -4.812 -11.510
   93   HG21  VAL  11          HG21      VAL  11  82.505  -2.635 -14.328
   94   HG22  VAL  11          HG22      VAL  11  81.537  -1.769 -13.137
   95   HG23  VAL  11          HG23      VAL  11  80.744  -2.677 -14.423
   96    H    GLN  12           H        GLN  12  83.795  -1.629 -12.442
   97    HA   GLN  12           HA       GLN  12  86.025  -3.168 -13.558
   98    HB2  GLN  12           HB2      GLN  12  86.662  -1.154 -14.672
   99    HB3  GLN  12           HB1      GLN  12  84.915  -1.327 -14.837
  100    HG2  GLN  12           HG2      GLN  12  84.667   0.173 -12.815
  101    HG3  GLN  12           HG1      GLN  12  86.403   0.473 -12.910
  102   HE21  GLN  12          HE21      GLN  12  85.606   0.015 -16.053
  103   HE22  GLN  12          HE22      GLN  12  85.235   1.605 -16.503
  104    H    LYS  13           H        LYS  13  85.355  -1.097 -10.809
  105    HA   LYS  13           HA       LYS  13  88.240  -0.879 -10.271
  106    HB2  LYS  13           HB2      LYS  13  86.638   1.125 -10.222
  107    HB3  LYS  13           HB3      LYS  13  86.094   0.482  -8.672
  108    HG2  LYS  13           HG2      LYS  13  88.291   0.658  -7.728
  109    HG3  LYS  13           HG3      LYS  13  89.015   0.976  -9.301
  110    HD2  LYS  13           HD2      LYS  13  86.873   2.839  -8.349
  111    HD3  LYS  13           HD3      LYS  13  88.468   2.964  -7.608
  112    HE2  LYS  13           HE2      LYS  13  89.517   3.326  -9.752
  113    HE3  LYS  13           HE3      LYS  13  88.013   2.973 -10.603
  114    HZ1  LYS  13           HZ1      LYS  13  88.230   5.173  -8.638
  115    HZ2  LYS  13           HZ2      LYS  13  87.032   4.929  -9.818
  116    HZ3  LYS  13           HZ3      LYS  13  88.599   5.395 -10.280
  117    H    CYS  14           H        CYS  14  85.385  -1.391  -8.136
  118    HA   CYS  14           HA       CYS  14  87.101  -2.660  -6.190
  119    HB2  CYS  14           HB2      CYS  14  84.123  -2.639  -5.970
  120    HB3  CYS  14           HB1      CYS  14  85.329  -2.522  -4.696
  121    H    ALA  15           H        ALA  15  84.623  -3.857  -8.426
  122    HA   ALA  15           HA       ALA  15  84.163  -6.359  -7.387
  123    HB1  ALA  15           HB1      ALA  15  82.957  -5.904  -9.323
  124    HB2  ALA  15           HB2      ALA  15  84.133  -7.085  -9.900
  125    HB3  ALA  15           HB3      ALA  15  84.384  -5.367 -10.205
  126    H    GLN  16           H        GLN  16  87.084  -5.141  -8.823
  127    HA   GLN  16           HA       GLN  16  88.448  -7.377  -9.625
  128    HB2  GLN  16           HB2      GLN  16  89.350  -4.893  -8.196
  129    HB3  GLN  16           HB1      GLN  16  90.504  -6.160  -8.605
  130    HG2  GLN  16           HG2      GLN  16  89.824  -6.021 -10.971
  131    HG3  GLN  16           HG1      GLN  16  88.665  -4.757 -10.565
  132   HE21  GLN  16          HE21      GLN  16  91.227  -4.706 -12.271
  133   HE22  GLN  16          HE22      GLN  16  92.117  -3.410 -11.630
  134    H    CYS  17           H        CYS  17  88.493  -6.091  -6.277
  135    HA   CYS  17           HA       CYS  17  88.978  -8.857  -5.338
  136    HB2  CYS  17           HB2      CYS  17  90.141  -6.677  -3.709
  137    HB3  CYS  17           HB1      CYS  17  90.801  -8.256  -4.109
  138    H    HIS  18           H        HSD  18  86.408  -8.081  -5.392
  139    HA   HIS  18           HA       HSD  18  85.742  -7.980  -2.576
  140    HB2  HIS  18           HB2      HSD  18  85.206  -5.643  -4.383
  141    HB3  HIS  18           HB1      HSD  18  84.094  -6.012  -3.067
  142    HD1  HIS  18           HD1      HSD  18  85.089  -5.943  -0.614
  143    HD2  HIS  18           HD2      HSD  18  87.654  -4.538  -3.578
  144    HE1  HIS  18           HE1      HSD  18  86.948  -4.701   0.578
  145    H    THR  19           H        THR  19  83.149  -7.613  -2.505
  146    HA   THR  19           HA       THR  19  81.892  -9.202  -4.638
  147    HB   THR  19           HB       THR  19  81.186  -9.845  -1.803
  148    HG1  THR  19           HG1      THR  19  83.077 -11.505  -2.692
  149   HG21  THR  19          HG21      THR  19  80.168 -10.746  -4.046
  150   HG22  THR  19          HG22      THR  19  80.486 -11.869  -2.724
  151   HG23  THR  19          HG23      THR  19  81.611 -11.757  -4.077
  152    H    VAL  20           H        VAL  20  81.522  -7.198  -1.760
  153    HA   VAL  20           HA       VAL  20  79.796  -5.891  -0.994
  154    HB   VAL  20           HB       VAL  20  79.092  -4.192  -2.565
  155   HG11  VAL  20          HG11      VAL  20  81.306  -3.437  -3.317
  156   HG12  VAL  20          HG12      VAL  20  81.951  -5.062  -3.086
  157   HG13  VAL  20          HG13      VAL  20  81.407  -4.124  -1.698
  158   HG21  VAL  20          HG21      VAL  20  79.458  -4.358  -4.921
  159   HG22  VAL  20          HG22      VAL  20  78.676  -5.862  -4.446
  160   HG23  VAL  20          HG23      VAL  20  80.412  -5.825  -4.735
  161    H    GLU  21           H        GLU  21  78.923  -8.583  -1.598
  162    HA   GLU  21           HA       GLU  21  76.085  -7.970  -2.136
  163    HB2  GLU  21           HB2      GLU  21  75.794  -9.806  -3.561
  164    HB3  GLU  21           HB3      GLU  21  77.332  -9.125  -4.088
  165    HG2  GLU  21           HG2      GLU  21  78.437 -10.773  -2.464
  166    HG3  GLU  21           HG3      GLU  21  76.863 -11.567  -2.379
  167    H    LYS  22           H        LYS  22  74.956  -8.398  -0.385
  168    HA   LYS  22           HA       LYS  22  75.873  -9.696   1.892
  169    HB2  LYS  22           HB2      LYS  22  73.872  -8.186   1.723
  170    HB3  LYS  22           HB3      LYS  22  72.984  -9.532   1.016
  171    HG2  LYS  22           HG2      LYS  22  74.406 -10.184   3.536
  172    HG3  LYS  22           HG3      LYS  22  73.106  -9.008   3.711
  173    HD2  LYS  22           HD2      LYS  22  71.607 -10.606   2.445
  174    HD3  LYS  22           HD3      LYS  22  72.904 -11.799   2.550
  175    HE2  LYS  22           HE2      LYS  22  71.253 -12.070   4.384
  176    HE3  LYS  22           HE3      LYS  22  72.855 -11.666   4.999
  177    HZ1  LYS  22           HZ1      LYS  22  72.165  -9.679   5.732
  178    HZ2  LYS  22           HZ2      LYS  22  70.614 -10.368   5.667
  179    HZ3  LYS  22           HZ3      LYS  22  71.171  -9.396   4.388
  180    H    GLY  23           H        GLY  23  75.963 -11.759   2.578
  181    HA2  GLY  23           HA2      GLY  23  75.765 -14.054   2.601
  182    HA3  GLY  23           HA3      GLY  23  74.365 -13.880   1.547
  183    H    GLY  24           H        GLY  24  77.472 -12.547   0.675
  184    HA2  GLY  24           HA2      GLY  24  77.568 -14.337  -1.648
  185    HA3  GLY  24           HA3      GLY  24  78.483 -12.849  -1.441
  186    H    LYS  25           H        LYS  25  80.534 -13.539  -1.718
  187    HA   LYS  25           HA       LYS  25  81.675 -15.220   0.375
  188    HB2  LYS  25           HB2      LYS  25  82.734 -16.765  -1.171
  189    HB3  LYS  25           HB3      LYS  25  80.988 -16.803  -1.420
  190    HG2  LYS  25           HG2      LYS  25  81.634 -14.845  -3.173
  191    HG3  LYS  25           HG3      LYS  25  83.136 -15.766  -3.209
  192    HD2  LYS  25           HD2      LYS  25  81.906 -16.850  -4.865
  193    HD3  LYS  25           HD3      LYS  25  81.516 -17.838  -3.457
  194    HE2  LYS  25           HE2      LYS  25  79.415 -17.387  -4.459
  195    HE3  LYS  25           HE3      LYS  25  79.514 -16.243  -3.122
  196    HZ1  LYS  25           HZ1      LYS  25  79.044 -14.750  -4.703
  197    HZ2  LYS  25           HZ2      LYS  25  79.543 -15.763  -5.973
  198    HZ3  LYS  25           HZ3      LYS  25  80.691 -14.870  -5.093
  199    H    HIS  26           H        HIS  26  83.341 -14.059   1.089
  200    HA   HIS  26           HA       HIS  26  84.497 -11.870  -0.176
  201    HB2  HIS  26           HB2      HIS  26  86.512 -12.523   1.411
  202    HB3  HIS  26           HB1      HIS  26  84.988 -11.947   2.084
  203    HD1  HIS  26           HD1      HIS  26  86.005 -15.403   0.810
  204    HD2  HIS  26           HD2      HIS  26  84.475 -13.591   4.238
  205    HE1  HIS  26           HE1      HIS  26  85.534 -17.269   2.458
  206    HE2  HIS  26           HE2      HIS  26  84.602 -16.180   4.553
  207    H    LYS  27           H        LYS  27  85.779 -11.683  -1.870
  208    HA   LYS  27           HA       LYS  27  87.484 -13.979  -2.652
  209    HB2  LYS  27           HB2      LYS  27  85.719 -13.799  -4.274
  210    HB3  LYS  27           HB3      LYS  27  85.930 -12.053  -4.392
  211    HG2  LYS  27           HG2      LYS  27  88.022 -12.268  -5.493
  212    HG3  LYS  27           HG3      LYS  27  88.172 -13.968  -5.047
  213    HD2  LYS  27           HD2      LYS  27  87.501 -13.589  -7.451
  214    HD3  LYS  27           HD3      LYS  27  86.375 -14.592  -6.536
  215    HE2  LYS  27           HE2      LYS  27  84.796 -12.848  -6.337
  216    HE3  LYS  27           HE3      LYS  27  85.983 -11.607  -6.742
  217    HZ1  LYS  27           HZ1      LYS  27  84.764 -13.615  -8.547
  218    HZ2  LYS  27           HZ2      LYS  27  86.140 -12.715  -8.974
  219    HZ3  LYS  27           HZ3      LYS  27  84.670 -11.925  -8.654
  220    H    THR  28           H        THR  28  89.551 -13.481  -2.321
  221    HA   THR  28           HA       THR  28  91.485 -12.255  -2.066
  222    HB   THR  28           HB       THR  28  90.504 -10.537  -4.334
  223    HG1  THR  28           HG1      THR  28  90.937 -12.198  -5.720
  224   HG21  THR  28          HG21      THR  28  93.195 -11.845  -3.981
  225   HG22  THR  28          HG22      THR  28  92.806 -10.345  -3.139
  226   HG23  THR  28          HG23      THR  28  92.785 -10.399  -4.902
  227    H    GLY  29           H        GLY  29  89.047 -11.356  -0.650
  228    HA2  GLY  29           HA2      GLY  29  89.969  -9.174   0.730
  229    HA3  GLY  29           HA3      GLY  29  89.048  -8.485  -0.602
  230    HA   PRO  30           HA       PRO  30  86.261 -10.017   2.952
  231    HB2  PRO  30           HB2      PRO  30  85.796  -7.665   4.260
  232    HB3  PRO  30           HB1      PRO  30  87.137  -8.751   4.676
  233    HG2  PRO  30           HG2      PRO  30  87.162  -6.249   3.055
  234    HG3  PRO  30           HG1      PRO  30  88.332  -6.829   4.254
  235    HD2  PRO  30           HD2      PRO  30  88.729  -7.063   1.549
  236    HD3  PRO  30           HD1      PRO  30  89.417  -8.195   2.735
  237    H    ASN  31           H        ASN  31  83.977  -9.106   3.420
  238    HA   ASN  31           HA       ASN  31  82.902  -8.009   0.899
  239    HB2  ASN  31           HB2      ASN  31  82.157 -10.272   2.111
  240    HB3  ASN  31           HB1      ASN  31  81.119  -9.160   3.001
  241   HD21  ASN  31          HD21      ASN  31  80.581 -11.232   0.738
  242   HD22  ASN  31          HD22      ASN  31  79.670 -10.348  -0.390
  243    H    LEU  32           H        LEU  32  81.994  -6.064   0.852
  244    HA   LEU  32           HA       LEU  32  82.072  -4.374   3.180
  245    HB2  LEU  32           HB2      LEU  32  80.799  -3.722   0.521
  246    HB3  LEU  32           HB3      LEU  32  81.456  -2.602   1.711
  247    HG   LEU  32           HG       LEU  32  82.971  -4.504  -0.088
  248   HD11  LEU  32          HD11      LEU  32  82.992  -1.512   0.399
  249   HD12  LEU  32          HD12      LEU  32  82.540  -2.349  -1.081
  250   HD13  LEU  32          HD13      LEU  32  84.219  -2.345  -0.554
  251   HD21  LEU  32          HD21      LEU  32  84.039  -4.804   2.026
  252   HD22  LEU  32          HD22      LEU  32  83.873  -3.097   2.432
  253   HD23  LEU  32          HD23      LEU  32  85.007  -3.597   1.180
  254    H    HIS  33           H        HIS  33  80.252  -6.657   3.345
  255    HA   HIS  33           HA       HIS  33  77.572  -6.114   2.947
  256    HB2  HIS  33           HB2      HIS  33  78.966  -7.561   5.202
  257    HB3  HIS  33           HB1      HIS  33  77.210  -7.498   5.059
  258    HD1  HIS  33           HD1      HIS  33  78.152 -10.244   4.833
  259    HD2  HIS  33           HD2      HIS  33  78.246  -7.728   1.510
  260    HE1  HIS  33           HE1      HIS  33  78.234 -11.747   2.797
  261    HE2  HIS  33           HE2      HIS  33  78.292 -10.228   0.766
  262    H    GLY  34           H        GLY  34  76.241  -4.566   3.633
  263    HA2  GLY  34           HA2      GLY  34  75.625  -2.587   4.699
  264    HA3  GLY  34           HA3      GLY  34  75.685  -3.649   6.101
  265    H    LEU  35           H        LEU  35  78.398  -2.530   4.120
  266    HA   LEU  35           HA       LEU  35  80.197  -2.028   6.120
  267    HB2  LEU  35           HB2      LEU  35  80.672  -1.898   3.680
  268    HB3  LEU  35           HB3      LEU  35  79.850  -0.341   3.630
  269    HG   LEU  35           HG       LEU  35  81.525   0.270   5.576
  270   HD11  LEU  35          HD11      LEU  35  83.713  -0.859   5.268
  271   HD12  LEU  35          HD12      LEU  35  82.955  -1.976   4.136
  272   HD13  LEU  35          HD13      LEU  35  82.470  -1.974   5.829
  273   HD21  LEU  35          HD21      LEU  35  81.842   1.606   3.754
  274   HD22  LEU  35          HD22      LEU  35  81.865   0.255   2.621
  275   HD23  LEU  35          HD23      LEU  35  83.298   0.634   3.576
  276    H    PHE  36           H        PHE  36  78.059   0.424   4.669
  277    HA   PHE  36           HA       PHE  36  78.671   2.584   6.263
  278    HB2  PHE  36           HB2      PHE  36  75.856   1.915   5.391
  279    HB3  PHE  36           HB1      PHE  36  76.566   3.513   5.631
  280    HD1  PHE  36           HD2      PHE  36  76.562   0.502   3.474
  281    HD2  PHE  36           HD1      PHE  36  78.002   4.521   3.964
  282    HE1  PHE  36           HE2      PHE  36  77.361   0.503   1.127
  283    HE2  PHE  36           HE1      PHE  36  78.799   4.520   1.625
  284    HZ   PHE  36           HZ       PHE  36  78.479   2.514   0.203
  285    H    GLY  37           H        GLY  37  79.095   2.027   8.383
  286    HA2  GLY  37           HA2      GLY  37  77.712   2.478  10.486
  287    HA3  GLY  37           HA3      GLY  37  76.829   1.031  10.006
  288    H    ARG  38           H        ARG  38  79.388  -0.117   8.928
  289    HA   ARG  38           HA       ARG  38  80.191  -1.508  11.313
  290    HB2  ARG  38           HB2      ARG  38  81.000  -1.590   8.416
  291    HB3  ARG  38           HB3      ARG  38  81.928  -2.471   9.626
  292    HG2  ARG  38           HG2      ARG  38  78.938  -2.776   9.595
  293    HG3  ARG  38           HG3      ARG  38  79.886  -3.625   8.378
  294    HD2  ARG  38           HD2      ARG  38  81.334  -4.305  10.535
  295    HD3  ARG  38           HD3      ARG  38  79.786  -4.042  11.332
  296    HE   ARG  38           HE       ARG  38  79.086  -6.031  10.398
  297   HH11  ARG  38          HH21      ARG  38  81.645  -4.654   8.517
  298   HH12  ARG  38          HH22      ARG  38  81.725  -5.977   7.400
  299   HH21  ARG  38          HH11      ARG  38  79.180  -7.768   8.935
  300   HH22  ARG  38          HH12      ARG  38  80.329  -7.740   7.639
  301    H    LYS  39           H        LYS  39  82.319  -1.561  12.203
  302    HA   LYS  39           HA       LYS  39  83.694   1.021  12.010
  303    HB2  LYS  39           HB2      LYS  39  83.151   0.199  14.254
  304    HB3  LYS  39           HB3      LYS  39  84.063  -1.276  13.946
  305    HG2  LYS  39           HG2      LYS  39  85.916  -0.226  14.704
  306    HG3  LYS  39           HG3      LYS  39  85.827   0.855  13.320
  307    HD2  LYS  39           HD2      LYS  39  85.862   2.219  15.309
  308    HD3  LYS  39           HD3      LYS  39  84.235   2.297  14.635
  309    HE2  LYS  39           HE2      LYS  39  84.157   0.075  16.341
  310    HE3  LYS  39           HE3      LYS  39  85.103   1.273  17.225
  311    HZ1  LYS  39           HZ1      LYS  39  82.610   2.070  15.881
  312    HZ2  LYS  39           HZ2      LYS  39  83.379   2.770  17.225
  313    HZ3  LYS  39           HZ3      LYS  39  82.543   1.301  17.391
  314    H    THR  40           H        THR  40  85.710   1.277  11.222
  315    HA   THR  40           HA       THR  40  86.786  -0.195   9.242
  316    HB   THR  40           HB       THR  40  89.004   0.737   9.853
  317    HG1  THR  40           HG1      THR  40  87.720   1.858  12.093
  318   HG21  THR  40          HG21      THR  40  87.318   2.127   8.690
  319   HG22  THR  40          HG22      THR  40  88.328   3.095   9.761
  320   HG23  THR  40          HG23      THR  40  86.693   2.656  10.251
  321    H    GLY  41           H        GLY  41  87.760  -2.100   8.955
  322    HA2  GLY  41           HA2      GLY  41  88.554  -4.204   9.404
  323    HA3  GLY  41           HA3      GLY  41  89.504  -3.420  10.660
  324    H    GLN  42           H        GLN  42  86.007  -4.020  10.267
  325    HA   GLN  42           HA       GLN  42  86.029  -5.339  12.922
  326    HB2  GLN  42           HB2      GLN  42  84.815  -3.237  13.014
  327    HB3  GLN  42           HB1      GLN  42  83.844  -3.701  11.617
  328    HG2  GLN  42           HG2      GLN  42  82.797  -5.486  12.830
  329    HG3  GLN  42           HG1      GLN  42  83.931  -5.324  14.169
  330   HE21  GLN  42          HE21      GLN  42  81.538  -3.286  12.381
  331   HE22  GLN  42          HE22      GLN  42  80.991  -2.472  13.767
  332    H    ALA  43           H        ALA  43  85.260  -5.624   9.580
  333    HA   ALA  43           HA       ALA  43  83.221  -7.546   9.656
  334    HB1  ALA  43           HB1      ALA  43  83.574  -6.685   7.534
  335    HB2  ALA  43           HB2      ALA  43  84.367  -8.253   7.396
  336    HB3  ALA  43           HB3      ALA  43  85.328  -6.799   7.668
  337    HA   PRO  44           HA       PRO  44  85.763 -10.875  11.320
  338    HB2  PRO  44           HB2      PRO  44  83.792 -12.686  11.705
  339    HB3  PRO  44           HB1      PRO  44  83.961 -11.255  12.740
  340    HG2  PRO  44           HG2      PRO  44  82.087 -11.734  10.472
  341    HG3  PRO  44           HG1      PRO  44  81.789 -10.953  12.035
  342    HD2  PRO  44           HD2      PRO  44  82.248  -9.570   9.685
  343    HD3  PRO  44           HD1      PRO  44  82.564  -8.910  11.306
  344    H    GLY  45           H        GLY  45  87.056 -11.956   9.920
  345    HA2  GLY  45           HA2      GLY  45  86.579 -14.237   8.591
  346    HA3  GLY  45           HA3      GLY  45  85.996 -13.042   7.436
  347    H    PHE  46           H        PHE  46  87.528 -11.364   6.743
  348    HA   PHE  46           HA       PHE  46  90.043 -12.508   6.025
  349    HB2  PHE  46           HB2      PHE  46  88.649 -10.804   4.706
  350    HB3  PHE  46           HB1      PHE  46  89.325  -9.588   5.789
  351    HD1  PHE  46           HD2      PHE  46  90.131 -12.126   3.215
  352    HD2  PHE  46           HD1      PHE  46  91.643  -8.930   5.655
  353    HE1  PHE  46           HE2      PHE  46  92.212 -12.079   1.865
  354    HE2  PHE  46           HE1      PHE  46  93.723  -8.883   4.304
  355    HZ   PHE  46           HZ       PHE  46  94.007 -10.458   2.410
  356    H    THR  47           H        THR  47  92.130 -11.854   6.620
  357    HA   THR  47           HA       THR  47  92.416 -11.109   9.382
  358    HB   THR  47           HB       THR  47  94.579 -11.376   7.289
  359    HG1  THR  47           HG1      THR  47  92.895 -13.193   8.245
  360   HG21  THR  47          HG21      THR  47  95.240 -10.299   9.412
  361   HG22  THR  47          HG22      THR  47  95.985 -11.889   9.239
  362   HG23  THR  47          HG23      THR  47  94.596 -11.677  10.304
  363    H    TYR  48           H        TYR  48  91.467  -9.002   9.391
  364    HA   TYR  48           HA       TYR  48  92.372  -6.859   7.784
  365    HB2  TYR  48           HB2      TYR  48  90.871  -7.067  10.374
  366    HB3  TYR  48           HB3      TYR  48  91.411  -5.490   9.799
  367    HD1  TYR  48           HD2      TYR  48  90.623  -4.599   7.636
  368    HD2  TYR  48           HD1      TYR  48  89.104  -8.277   9.247
  369    HE1  TYR  48           HE2      TYR  48  88.713  -4.496   6.063
  370    HE2  TYR  48           HE1      TYR  48  87.191  -8.177   7.672
  371    HH   TYR  48           HH       TYR  48  86.299  -5.438   6.049
  372    H    THR  49           H        THR  49  93.726  -5.104   8.308
  373    HA   THR  49           HA       THR  49  96.086  -5.864   9.796
  374    HB   THR  49           HB       THR  49  96.992  -3.726   9.011
  375    HG1  THR  49           HG1      THR  49  95.465  -2.267   8.928
  376   HG21  THR  49          HG21      THR  49  96.458  -4.097   6.493
  377   HG22  THR  49          HG22      THR  49  95.510  -5.473   7.055
  378   HG23  THR  49          HG23      THR  49  97.242  -5.403   7.383
  379    H    ASP  50           H        ASP  50  97.010  -4.575  11.510
  380    HA   ASP  50           HA       ASP  50  95.288  -4.069  13.639
  381    HB2  ASP  50           HB2      ASP  50  98.012  -2.840  13.174
  382    HB3  ASP  50           HB1      ASP  50  97.184  -2.986  14.723
  383    H    ALA  51           H        ALA  51  96.677  -1.804  11.285
  384    HA   ALA  51           HA       ALA  51  95.785   0.594  12.377
  385    HB1  ALA  51           HB1      ALA  51  96.118  -0.235   9.490
  386    HB2  ALA  51           HB2      ALA  51  97.278   0.629  10.501
  387    HB3  ALA  51           HB3      ALA  51  95.784   1.420   9.996
  388    H    ASN  52           H        ASN  52  94.076  -1.639  10.200
  389    HA   ASN  52           HA       ASN  52  91.694   0.006  10.180
  390    HB2  ASN  52           HB2      ASN  52  92.729  -1.933   8.500
  391    HB3  ASN  52           HB1      ASN  52  91.409  -2.785   9.293
  392   HD21  ASN  52          HD21      ASN  52  90.331  -2.733   7.107
  393   HD22  ASN  52          HD22      ASN  52  89.515  -1.323   6.628
  394    H    LYS  53           H        LYS  53  92.962  -2.626  12.029
  395    HA   LYS  53           HA       LYS  53  90.396  -3.307  13.217
  396    HB2  LYS  53           HB2      LYS  53  91.605  -5.252  13.167
  397    HB3  LYS  53           HB3      LYS  53  93.149  -4.414  13.218
  398    HG2  LYS  53           HG2      LYS  53  92.919  -4.026  15.610
  399    HG3  LYS  53           HG3      LYS  53  91.295  -4.717  15.596
  400    HD2  LYS  53           HD2      LYS  53  93.577  -6.369  14.558
  401    HD3  LYS  53           HD3      LYS  53  93.377  -6.198  16.301
  402    HE2  LYS  53           HE2      LYS  53  91.031  -6.980  16.097
  403    HE3  LYS  53           HE3      LYS  53  91.269  -7.198  14.363
  404    HZ1  LYS  53           HZ1      LYS  53  93.099  -8.737  14.896
  405    HZ2  LYS  53           HZ2      LYS  53  91.594  -9.279  15.469
  406    HZ3  LYS  53           HZ3      LYS  53  92.719  -8.596  16.542
  407    H    ASN  54           H        ASN  54  92.699  -0.943  13.531
  408    HA   ASN  54           HA       ASN  54  92.895  -0.631  16.342
  409    HB2  ASN  54           HB2      ASN  54  93.947   1.381  15.871
  410    HB3  ASN  54           HB1      ASN  54  94.239   0.481  14.389
  411   HD21  ASN  54          HD21      ASN  54  91.557   0.762  13.281
  412   HD22  ASN  54          HD22      ASN  54  91.347   2.396  12.878
  413    H    LYS  55           H        LYS  55  90.409  -0.047  14.079
  414    HA   LYS  55           HA       LYS  55  88.275   0.816  14.286
  415    HB2  LYS  55           HB2      LYS  55  88.717   0.788  17.273
  416    HB3  LYS  55           HB3      LYS  55  87.196   0.636  16.398
  417    HG2  LYS  55           HG2      LYS  55  88.369  -1.482  15.335
  418    HG3  LYS  55           HG3      LYS  55  89.370  -1.393  16.784
  419    HD2  LYS  55           HD2      LYS  55  87.199  -1.282  18.121
  420    HD3  LYS  55           HD3      LYS  55  86.369  -1.724  16.628
  421    HE2  LYS  55           HE2      LYS  55  88.352  -3.336  18.226
  422    HE3  LYS  55           HE3      LYS  55  86.746  -3.804  17.667
  423    HZ1  LYS  55           HZ1      LYS  55  87.537  -3.832  15.414
  424    HZ2  LYS  55           HZ2      LYS  55  88.544  -4.817  16.365
  425    HZ3  LYS  55           HZ3      LYS  55  89.065  -3.270  15.892
  426    H    GLY  56           H        GLY  56  89.692   2.750  13.472
  427    HA2  GLY  56           HA2      GLY  56  89.997   4.916  15.368
  428    HA3  GLY  56           HA3      GLY  56  90.343   4.980  13.645
  429    H    ILE  57           H        ILE  57  87.886   4.217  12.583
  430    HA   ILE  57           HA       ILE  57  85.900   6.067  13.706
  431    HB   ILE  57           HB       ILE  57  85.557   7.157  11.532
  432   HG12  ILE  57          HG12      ILE  57  87.772   6.703  10.001
  433   HG13  ILE  57          HG13      ILE  57  87.556   5.103  10.708
  434   HG21  ILE  57          HG21      ILE  57  87.459   8.595  11.636
  435   HG22  ILE  57          HG22      ILE  57  88.489   7.306  12.259
  436   HG23  ILE  57          HG23      ILE  57  87.225   7.995  13.277
  437   HD11  ILE  57          HD11      ILE  57  85.006   5.571  10.002
  438   HD12  ILE  57          HD12      ILE  57  86.169   4.874   8.882
  439   HD13  ILE  57          HD13      ILE  57  85.800   6.596   8.813
  440    H    THR  58           H        THR  58  83.885   5.994  12.151
  441    HA   THR  58           HA       THR  58  83.331   3.140  11.621
  442    HB   THR  58           HB       THR  58  81.588   5.416  12.541
  443    HG1  THR  58           HG1      THR  58  82.426   4.244  14.183
  444   HG21  THR  58          HG21      THR  58  80.221   4.497  10.858
  445   HG22  THR  58          HG22      THR  58  79.729   3.621  12.308
  446   HG23  THR  58          HG23      THR  58  80.815   2.861  11.144
  447    H    TRP  59           H        TRP  59  82.544   2.515   9.652
  448    HA   TRP  59           HA       TRP  59  83.019   4.161   7.404
  449    HB2  TRP  59           HB2      TRP  59  81.389   1.629   7.674
  450    HB3  TRP  59           HB1      TRP  59  81.774   2.404   6.140
  451    HD1  TRP  59           HD1      TRP  59  83.001  -0.220   8.297
  452    HE1  TRP  59           HE1      TRP  59  85.482  -0.759   7.837
  453    HE3  TRP  59           HE3      TRP  59  84.299   3.881   5.539
  454    HZ2  TRP  59           HZ2      TRP  59  87.718   0.401   6.486
  455    HZ3  TRP  59           HZ3      TRP  59  86.608   4.136   4.682
  456    HH2  TRP  59           HH2      TRP  59  88.317   2.404   5.149
  457    H    LYS  60           H        LYS  60  81.695   5.335   6.112
  458    HA   LYS  60           HA       LYS  60  78.830   5.440   6.546
  459    HB2  LYS  60           HB2      LYS  60  80.624   7.782   7.223
  460    HB3  LYS  60           HB3      LYS  60  78.891   7.932   6.945
  461    HG2  LYS  60           HG2      LYS  60  78.609   6.112   8.738
  462    HG3  LYS  60           HG3      LYS  60  80.299   6.410   9.142
  463    HD2  LYS  60           HD2      LYS  60  78.259   8.640   9.011
  464    HD3  LYS  60           HD3      LYS  60  78.568   7.730  10.489
  465    HE2  LYS  60           HE2      LYS  60  81.003   8.320  10.264
  466    HE3  LYS  60           HE3      LYS  60  80.571   9.371   8.915
  467    HZ1  LYS  60           HZ1      LYS  60  79.468  10.822  10.274
  468    HZ2  LYS  60           HZ2      LYS  60  80.700  10.308  11.323
  469    HZ3  LYS  60           HZ3      LYS  60  79.138   9.656  11.460
  470    H    GLU  61           H        GLU  61  78.249   7.759   5.197
  471    HA   GLU  61           HA       GLU  61  78.816   7.007   2.499
  472    HB2  GLU  61           HB2      GLU  61  76.699   8.117   3.288
  473    HB3  GLU  61           HB3      GLU  61  77.622   9.610   3.472
  474    HG2  GLU  61           HG2      GLU  61  78.223   9.560   1.096
  475    HG3  GLU  61           HG3      GLU  61  77.368   8.031   0.896
  476    H    GLU  62           H        GLU  62  79.587   9.995   4.315
  477    HA   GLU  62           HA       GLU  62  81.388  10.960   2.331
  478    HB2  GLU  62           HB2      GLU  62  81.967  12.671   3.961
  479    HB3  GLU  62           HB3      GLU  62  80.220  12.424   3.963
  480    HG2  GLU  62           HG2      GLU  62  80.626  10.758   5.878
  481    HG3  GLU  62           HG3      GLU  62  82.242  11.452   5.985
  482    H    THR  63           H        THR  63  81.875   9.292   5.433
  483    HA   THR  63           HA       THR  63  84.643   9.402   5.597
  484    HB   THR  63           HB       THR  63  84.487   7.287   6.872
  485    HG1  THR  63           HG1      THR  63  82.742   6.554   5.347
  486   HG21  THR  63          HG21      THR  63  82.326   9.345   7.348
  487   HG22  THR  63          HG22      THR  63  83.940   9.304   8.056
  488   HG23  THR  63          HG23      THR  63  82.747   8.088   8.512
  489    H    LEU  64           H        LEU  64  82.566   7.297   3.702
  490    HA   LEU  64           HA       LEU  64  84.635   5.587   2.753
  491    HB2  LEU  64           HB2      LEU  64  81.775   5.976   2.263
  492    HB3  LEU  64           HB3      LEU  64  82.655   5.542   0.805
  493    HG   LEU  64           HG       LEU  64  82.833   4.026   3.422
  494   HD11  LEU  64          HD11      LEU  64  81.658   2.316   1.655
  495   HD12  LEU  64          HD12      LEU  64  80.975   3.846   1.113
  496   HD13  LEU  64          HD13      LEU  64  80.753   3.326   2.782
  497   HD21  LEU  64          HD21      LEU  64  83.651   2.355   1.384
  498   HD22  LEU  64          HD22      LEU  64  84.736   3.278   2.420
  499   HD23  LEU  64          HD23      LEU  64  84.275   3.916   0.844
  500    H    MET  65           H        MET  65  83.205   8.609   1.584
  501    HA   MET  65           HA       MET  65  84.347   8.671  -0.970
  502    HB2  MET  65           HB2      MET  65  83.836  10.986   0.911
  503    HB3  MET  65           HB1      MET  65  84.152  11.132  -0.815
  504    HG2  MET  65           HG2      MET  65  82.149   9.912  -1.361
  505    HG3  MET  65           HG1      MET  65  81.882   9.497   0.331
  506    HE1  MET  65           HE1      MET  65  80.534  13.091  -1.949
  507    HE2  MET  65           HE2      MET  65  80.312  11.366  -2.230
  508    HE3  MET  65           HE3      MET  65  81.911  12.082  -2.412
  509    H    GLU  66           H        GLU  66  85.631  10.187   2.001
  510    HA   GLU  66           HA       GLU  66  88.084  10.998   0.911
  511    HB2  GLU  66           HB2      GLU  66  87.473  10.183   3.764
  512    HB3  GLU  66           HB3      GLU  66  88.869  11.125   3.237
  513    HG2  GLU  66           HG2      GLU  66  86.005  11.973   2.740
  514    HG3  GLU  66           HG3      GLU  66  86.947  12.506   4.131
  515    H    TYR  67           H        TYR  67  86.976   7.918   2.100
  516    HA   TYR  67           HA       TYR  67  89.591   6.705   2.239
  517    HB2  TYR  67           HB2      TYR  67  87.822   5.845   3.647
  518    HB3  TYR  67           HB3      TYR  67  86.792   5.561   2.246
  519    HD1  TYR  67           HD1      TYR  67  89.889   4.481   3.977
  520    HD2  TYR  67           HD2      TYR  67  87.061   3.626   0.858
  521    HE1  TYR  67           HE1      TYR  67  90.864   2.215   3.714
  522    HE2  TYR  67           HE2      TYR  67  88.038   1.363   0.593
  523    HH   TYR  67           HH       TYR  67  90.467   0.335   1.121
  524    H    LEU  68           H        LEU  68  87.088   7.127  -0.146
  525    HA   LEU  68           HA       LEU  68  88.103   5.145  -1.977
  526    HB2  LEU  68           HB2      LEU  68  86.003   7.298  -2.128
  527    HB3  LEU  68           HB3      LEU  68  86.500   6.421  -3.569
  528    HG   LEU  68           HG       LEU  68  85.442   5.152  -1.028
  529   HD11  LEU  68          HD11      LEU  68  83.773   6.428  -2.416
  530   HD12  LEU  68          HD12      LEU  68  83.444   4.699  -2.296
  531   HD13  LEU  68          HD13      LEU  68  84.161   5.359  -3.763
  532   HD21  LEU  68          HD21      LEU  68  85.231   3.272  -2.972
  533   HD22  LEU  68          HD22      LEU  68  86.607   3.385  -1.879
  534   HD23  LEU  68          HD23      LEU  68  86.703   4.087  -3.494
  535    H    GLU  69           H        GLU  69  88.799   8.456  -1.278
  536    HA   GLU  69           HA       GLU  69  90.065   8.935  -3.864
  537    HB2  GLU  69           HB2      GLU  69  89.007  10.878  -3.150
  538    HB3  GLU  69           HB3      GLU  69  89.390  10.587  -1.455
  539    HG2  GLU  69           HG2      GLU  69  91.641  11.266  -1.734
  540    HG3  GLU  69           HG3      GLU  69  91.536  11.164  -3.491
  541    H    ASN  70           H        ASN  70  90.849   7.646  -0.843
  542    HA   ASN  70           HA       ASN  70  93.561   7.181  -1.527
  543    HB2  ASN  70           HB2      ASN  70  94.600   8.555   0.275
  544    HB3  ASN  70           HB1      ASN  70  93.897   9.522  -1.018
  545   HD21  ASN  70          HD21      ASN  70  93.525   8.581   2.373
  546   HD22  ASN  70          HD22      ASN  70  92.318   9.719   2.736
  547    HA   PRO  71           HA       PRO  71  91.358   4.427   1.556
  548    HB2  PRO  71           HB2      PRO  71  93.083   2.521   0.033
  549    HB3  PRO  71           HB1      PRO  71  91.391   2.355   0.537
  550    HG2  PRO  71           HG2      PRO  71  92.051   2.885  -1.993
  551    HG3  PRO  71           HG1      PRO  71  90.600   3.573  -1.241
  552    HD2  PRO  71           HD2      PRO  71  93.190   4.904  -1.901
  553    HD3  PRO  71           HD1      PRO  71  91.550   5.587  -1.850
  554    H    LYS  72           H        LYS  72  94.743   4.670   0.557
  555    HA   LYS  72           HA       LYS  72  95.734   3.397   2.965
  556    HB2  LYS  72           HB2      LYS  72  96.888   3.151   0.800
  557    HB3  LYS  72           HB3      LYS  72  97.212   4.882   0.784
  558    HG2  LYS  72           HG2      LYS  72  99.198   4.067   1.693
  559    HG3  LYS  72           HG3      LYS  72  98.281   4.412   3.155
  560    HD2  LYS  72           HD2      LYS  72  99.069   2.237   3.548
  561    HD3  LYS  72           HD3      LYS  72  97.445   1.947   2.931
  562    HE2  LYS  72           HE2      LYS  72  98.603   0.493   1.570
  563    HE3  LYS  72           HE3      LYS  72  98.754   1.950   0.589
  564    HZ1  LYS  72           HZ1      LYS  72 100.793   0.441   1.753
  565    HZ2  LYS  72           HZ2      LYS  72 100.785   1.956   2.519
  566    HZ3  LYS  72           HZ3      LYS  72 100.935   1.856   0.829
  567    H    LYS  73           H        LYS  73  95.820   6.703   1.604
  568    HA   LYS  73           HA       LYS  73  97.223   7.832   3.776
  569    HB2  LYS  73           HB2      LYS  73  96.640   8.777   1.370
  570    HB3  LYS  73           HB3      LYS  73  95.274   9.490   2.227
  571    HG2  LYS  73           HG2      LYS  73  96.762  10.604   3.789
  572    HG3  LYS  73           HG3      LYS  73  98.163   9.786   3.099
  573    HD2  LYS  73           HD2      LYS  73  98.029  12.058   2.207
  574    HD3  LYS  73           HD3      LYS  73  97.705  10.898   0.919
  575    HE2  LYS  73           HE2      LYS  73  95.410  11.378   0.887
  576    HE3  LYS  73           HE3      LYS  73  95.426  12.039   2.523
  577    HZ1  LYS  73           HZ1      LYS  73  95.761  13.393   0.087
  578    HZ2  LYS  73           HZ2      LYS  73  97.196  13.541   0.984
  579    HZ3  LYS  73           HZ3      LYS  73  95.717  14.036   1.655
  580    H    TYR  74           H        TYR  74  94.034   6.694   3.583
  581    HA   TYR  74           HA       TYR  74  92.953   8.522   5.566
  582    HB2  TYR  74           HB2      TYR  74  91.730   7.188   3.604
  583    HB3  TYR  74           HB3      TYR  74  91.563   5.972   4.868
  584    HD1  TYR  74           HD1      TYR  74  91.258   9.705   4.510
  585    HD2  TYR  74           HD2      TYR  74  89.630   6.092   6.170
  586    HE1  TYR  74           HE1      TYR  74  89.392  11.001   5.502
  587    HE2  TYR  74           HE2      TYR  74  87.765   7.391   7.162
  588    HH   TYR  74           HH       TYR  74  87.669  10.929   6.945
  589    H    ILE  75           H        ILE  75  93.560   5.007   5.427
  590    HA   ILE  75           HA       ILE  75  94.034   5.062   8.352
  591    HB   ILE  75           HB       ILE  75  92.689   2.842   6.791
  592   HG12  ILE  75          HG12      ILE  75  91.388   4.542   8.915
  593   HG13  ILE  75          HG13      ILE  75  91.429   5.101   7.245
  594   HG21  ILE  75          HG21      ILE  75  93.801   1.850   8.632
  595   HG22  ILE  75          HG22      ILE  75  92.163   2.125   9.224
  596   HG23  ILE  75          HG23      ILE  75  93.463   3.223   9.687
  597   HD11  ILE  75          HD11      ILE  75  90.298   2.449   8.183
  598   HD12  ILE  75          HD12      ILE  75  90.345   3.010   6.512
  599   HD13  ILE  75          HD13      ILE  75  89.351   3.856   7.698
  600    HA   PRO  76           HA       PRO  76  97.847   3.725   5.941
  601    HB2  PRO  76           HB2      PRO  76  98.826   4.559   8.653
  602    HB3  PRO  76           HB1      PRO  76  99.562   4.827   7.060
  603    HG2  PRO  76           HG2      PRO  76  98.251   6.771   8.321
  604    HG3  PRO  76           HG1      PRO  76  98.167   6.586   6.560
  605    HD2  PRO  76           HD2      PRO  76  96.083   6.014   8.605
  606    HD3  PRO  76           HD1      PRO  76  95.895   6.434   6.888
  607    H    GLY  77           H        GLY  77  98.313   1.609   5.895
  608    HA2  GLY  77           HA2      GLY  77  99.339  -0.268   7.133
  609    HA3  GLY  77           HA3      GLY  77  98.172   0.049   8.414
  610    H    THR  78           H        THR  78  96.023   0.601   6.435
  611    HA   THR  78           HA       THR  78  94.806  -1.905   6.327
  612    HB   THR  78           HB       THR  78  93.619   0.260   6.065
  613    HG1  THR  78           HG1      THR  78  92.724  -0.737   3.808
  614   HG21  THR  78          HG21      THR  78  93.727   1.481   4.021
  615   HG22  THR  78          HG22      THR  78  94.628   0.193   3.221
  616   HG23  THR  78          HG23      THR  78  95.399   1.160   4.479
  617    H    LYS  79           H        LYS  79  94.542  -3.447   4.693
  618    HA   LYS  79           HA       LYS  79  96.729  -3.490   2.736
  619    HB2  LYS  79           HB2      LYS  79  95.338  -5.474   4.286
  620    HB3  LYS  79           HB3      LYS  79  95.169  -5.867   2.578
  621    HG2  LYS  79           HG2      LYS  79  97.842  -5.149   3.802
  622    HG3  LYS  79           HG3      LYS  79  97.238  -6.805   3.767
  623    HD2  LYS  79           HD2      LYS  79  96.968  -6.599   1.282
  624    HD3  LYS  79           HD3      LYS  79  97.739  -5.015   1.371
  625    HE2  LYS  79           HE2      LYS  79  99.507  -6.503   0.842
  626    HE3  LYS  79           HE3      LYS  79  99.674  -6.215   2.574
  627    HZ1  LYS  79           HZ1      LYS  79  99.825  -8.580   1.965
  628    HZ2  LYS  79           HZ2      LYS  79  98.229  -8.520   1.383
  629    HZ3  LYS  79           HZ3      LYS  79  98.545  -8.261   3.032
  630    H    MET  80           H        MET  80  96.003  -2.042   1.181
  631    HA   MET  80           HA       MET  80  94.388  -3.091  -0.880
  632    HB2  MET  80           HB2      MET  80  92.485  -2.648   0.543
  633    HB3  MET  80           HB1      MET  80  93.062  -1.015   0.882
  634    HG2  MET  80           HG2      MET  80  92.668  -0.305  -1.364
  635    HG3  MET  80           HG1      MET  80  92.443  -1.962  -1.923
  636    HE1  MET  80           HE1      MET  80  90.559   0.136  -2.772
  637    HE2  MET  80           HE2      MET  80  90.653   1.160  -1.343
  638    HE3  MET  80           HE3      MET  80  89.107   0.469  -1.819
  639    H    ILE  81           H        ILE  81  96.049  -2.405  -2.192
  640    HA   ILE  81           HA       ILE  81  96.541   0.509  -2.337
  641    HB   ILE  81           HB       ILE  81  98.243  -1.868  -3.104
  642   HG12  ILE  81          HG12      ILE  81  99.865  -0.666  -1.604
  643   HG13  ILE  81          HG13      ILE  81  98.595   0.497  -1.233
  644   HG21  ILE  81          HG21      ILE  81  98.479   1.042  -3.885
  645   HG22  ILE  81          HG22      ILE  81  98.564  -0.380  -4.926
  646   HG23  ILE  81          HG23      ILE  81  99.888  -0.018  -3.818
  647   HD11  ILE  81          HD11      ILE  81  97.866  -2.368  -0.899
  648   HD12  ILE  81          HD12      ILE  81  97.453  -0.973   0.098
  649   HD13  ILE  81          HD13      ILE  81  99.039  -1.724   0.249
  650    H    PHE  82           H        PHE  82  95.055   1.263  -3.756
  651    HA   PHE  82           HA       PHE  82  95.301   0.405  -6.528
  652    HB2  PHE  82           HB2      PHE  82  93.436  -0.948  -5.260
  653    HB3  PHE  82           HB1      PHE  82  92.509   0.542  -5.429
  654    HD1  PHE  82           HD2      PHE  82  94.203  -2.191  -7.255
  655    HD2  PHE  82           HD1      PHE  82  91.752   1.320  -7.599
  656    HE1  PHE  82           HE2      PHE  82  93.697  -2.776  -9.610
  657    HE2  PHE  82           HE1      PHE  82  91.246   0.735  -9.955
  658    HZ   PHE  82           HZ       PHE  82  92.219  -1.313 -10.961
  659    H    ALA  83           H        ALA  83  94.625   1.976  -8.002
  660    HA   ALA  83           HA       ALA  83  94.914   4.641  -7.277
  661    HB1  ALA  83           HB1      ALA  83  93.408   3.502  -9.644
  662    HB2  ALA  83           HB2      ALA  83  95.134   3.861  -9.586
  663    HB3  ALA  83           HB3      ALA  83  93.957   5.171  -9.491
  664    H    GLY  84           H        GLY  84  93.685   5.717  -5.865
  665    HA2  GLY  84           HA2      GLY  84  91.064   5.124  -5.103
  666    HA3  GLY  84           HA3      GLY  84  91.838   6.693  -4.898
  667    H    ILE  85           H        ILE  85  89.666   7.552  -5.322
  668    HA   ILE  85           HA       ILE  85  88.811   7.393  -8.138
  669    HB   ILE  85           HB       ILE  85  87.467   8.467  -5.654
  670   HG12  ILE  85          HG12      ILE  85  87.658   5.909  -6.305
  671   HG13  ILE  85          HG13      ILE  85  86.122   6.563  -5.746
  672   HG21  ILE  85          HG21      ILE  85  86.718   9.920  -7.361
  673   HG22  ILE  85          HG22      ILE  85  85.482   8.662  -7.293
  674   HG23  ILE  85          HG23      ILE  85  86.700   8.633  -8.565
  675   HD11  ILE  85          HD11      ILE  85  86.177   5.108  -7.926
  676   HD12  ILE  85          HD12      ILE  85  86.753   6.591  -8.685
  677   HD13  ILE  85          HD13      ILE  85  85.183   6.563  -7.882
  678    H    LYS  86           H        LYS  86  88.236   9.389  -9.260
  679    HA   LYS  86           HA       LYS  86  90.178  11.511  -8.664
  680    HB2  LYS  86           HB2      LYS  86  88.517  11.020 -11.144
  681    HB3  LYS  86           HB3      LYS  86  89.789  12.229 -10.969
  682    HG2  LYS  86           HG2      LYS  86  91.482  10.564 -10.750
  683    HG3  LYS  86           HG3      LYS  86  90.293   9.283 -10.506
  684    HD2  LYS  86           HD2      LYS  86  89.447   9.721 -12.835
  685    HD3  LYS  86           HD3      LYS  86  90.794  10.837 -13.059
  686    HE2  LYS  86           HE2      LYS  86  91.548   8.762 -13.952
  687    HE3  LYS  86           HE3      LYS  86  92.320   8.895 -12.372
  688    HZ1  LYS  86           HZ1      LYS  86  90.906   6.773 -13.185
  689    HZ2  LYS  86           HZ2      LYS  86  89.709   7.651 -12.357
  690    HZ3  LYS  86           HZ3      LYS  86  91.138   7.194 -11.558
  691    H    LYS  87           H        LYS  87  86.901  11.553 -10.105
  692    HA   LYS  87           HA       LYS  87  86.427  14.180  -8.975
  693    HB2  LYS  87           HB2      LYS  87  84.739  12.351 -10.686
  694    HB3  LYS  87           HB3      LYS  87  84.213  13.946 -10.144
  695    HG2  LYS  87           HG2      LYS  87  86.176  14.968 -11.235
  696    HG3  LYS  87           HG3      LYS  87  86.704  13.375 -11.780
  697    HD2  LYS  87           HD2      LYS  87  84.657  13.113 -13.096
  698    HD3  LYS  87           HD3      LYS  87  84.056  14.662 -12.506
  699    HE2  LYS  87           HE2      LYS  87  84.996  15.114 -14.655
  700    HE3  LYS  87           HE3      LYS  87  86.176  15.701 -13.483
  701    HZ1  LYS  87           HZ1      LYS  87  86.456  13.659 -15.432
  702    HZ2  LYS  87           HZ2      LYS  87  86.778  13.045 -13.881
  703    HZ3  LYS  87           HZ3      LYS  87  87.644  14.386 -14.464
  704    H    LYS  88           H        LYS  88  84.422  14.679  -7.803
  705    HA   LYS  88           HA       LYS  88  84.144  13.007  -5.500
  706    HB2  LYS  88           HB2      LYS  88  83.898  15.355  -5.173
  707    HB3  LYS  88           HB3      LYS  88  82.695  15.481  -6.452
  708    HG2  LYS  88           HG2      LYS  88  81.985  13.573  -4.295
  709    HG3  LYS  88           HG3      LYS  88  82.097  15.252  -3.774
  710    HD2  LYS  88           HD2      LYS  88  80.600  15.867  -5.720
  711    HD3  LYS  88           HD3      LYS  88  80.359  14.142  -5.995
  712    HE2  LYS  88           HE2      LYS  88  79.374  13.859  -3.813
  713    HE3  LYS  88           HE3      LYS  88  79.811  15.502  -3.345
  714    HZ1  LYS  88           HZ1      LYS  88  77.834  16.110  -4.108
  715    HZ2  LYS  88           HZ2      LYS  88  77.545  14.586  -4.801
  716    HZ3  LYS  88           HZ3      LYS  88  78.390  15.773  -5.676
  717    H    THR  89           H        THR  89  81.965  13.835  -8.208
  718    HA   THR  89           HA       THR  89  79.778  12.293  -7.405
  719    HB   THR  89           HB       THR  89  79.191  12.216  -9.831
  720    HG1  THR  89           HG1      THR  89  81.808  12.635 -10.038
  721   HG21  THR  89          HG21      THR  89  78.530  14.134  -8.488
  722   HG22  THR  89          HG22      THR  89  79.048  14.701 -10.077
  723   HG23  THR  89          HG23      THR  89  80.123  14.864  -8.687
  724    H    GLU  90           H        GLU  90  82.843  11.337  -8.718
  725    HA   GLU  90           HA       GLU  90  82.034   8.744  -9.629
  726    HB2  GLU  90           HB2      GLU  90  84.697   9.994  -8.966
  727    HB3  GLU  90           HB3      GLU  90  84.565   8.281  -9.364
  728    HG2  GLU  90           HG2      GLU  90  83.694   8.757 -11.534
  729    HG3  GLU  90           HG3      GLU  90  83.426  10.452 -11.130
  730    H    ARG  91           H        ARG  91  83.180  10.131  -6.616
  731    HA   ARG  91           HA       ARG  91  83.418   7.608  -5.233
  732    HB2  ARG  91           HB2      ARG  91  83.327  10.488  -4.291
  733    HB3  ARG  91           HB3      ARG  91  83.485   9.120  -3.190
  734    HG2  ARG  91           HG2      ARG  91  85.519   8.402  -4.456
  735    HG3  ARG  91           HG3      ARG  91  85.389   9.872  -5.421
  736    HD2  ARG  91           HD2      ARG  91  85.455  10.036  -2.419
  737    HD3  ARG  91           HD3      ARG  91  86.950   9.883  -3.332
  738    HE   ARG  91           HE       ARG  91  85.339  12.233  -3.108
  739   HH11  ARG  91          HH21      ARG  91  87.340  10.396  -5.251
  740   HH12  ARG  91          HH22      ARG  91  87.815  11.765  -6.202
  741   HH21  ARG  91          HH11      ARG  91  85.957  14.031  -4.349
  742   HH22  ARG  91          HH12      ARG  91  87.031  13.822  -5.690
  743    H    GLU  92           H        GLU  92  81.106  10.324  -5.178
  744    HA   GLU  92           HA       GLU  92  79.273   9.227  -3.366
  745    HB2  GLU  92           HB2      GLU  92  79.317  11.596  -4.327
  746    HB3  GLU  92           HB3      GLU  92  78.497  10.930  -5.739
  747    HG2  GLU  92           HG2      GLU  92  76.762   9.979  -4.143
  748    HG3  GLU  92           HG3      GLU  92  77.513  10.949  -2.876
  749    H    ASP  93           H        ASP  93  79.221   9.145  -6.942
  750    HA   ASP  93           HA       ASP  93  76.974   7.491  -7.221
  751    HB2  ASP  93           HB2      ASP  93  79.419   7.750  -8.990
  752    HB3  ASP  93           HB1      ASP  93  77.929   6.933  -9.457
  753    H    LEU  94           H        LEU  94  80.436   6.625  -7.168
  754    HA   LEU  94           HA       LEU  94  80.182   3.858  -7.375
  755    HB2  LEU  94           HB2      LEU  94  82.367   4.940  -7.475
  756    HB3  LEU  94           HB3      LEU  94  82.193   5.486  -5.809
  757    HG   LEU  94           HG       LEU  94  82.222   3.210  -4.988
  758   HD11  LEU  94          HD11      LEU  94  82.041   2.572  -7.916
  759   HD12  LEU  94          HD12      LEU  94  81.103   1.917  -6.574
  760   HD13  LEU  94          HD13      LEU  94  82.776   1.414  -6.808
  761   HD21  LEU  94          HD21      LEU  94  84.399   4.492  -5.894
  762   HD22  LEU  94          HD22      LEU  94  84.457   3.093  -6.963
  763   HD23  LEU  94          HD23      LEU  94  84.487   2.869  -5.217
  764    H    ILE  95           H        ILE  95  79.963   5.980  -4.583
  765    HA   ILE  95           HA       ILE  95  79.735   3.859  -2.687
  766    HB   ILE  95           HB       ILE  95  79.310   6.836  -2.554
  767   HG12  ILE  95          HG12      ILE  95  81.259   5.126  -1.012
  768   HG13  ILE  95          HG13      ILE  95  81.587   5.572  -2.684
  769   HG21  ILE  95          HG21      ILE  95  79.311   6.154   0.041
  770   HG22  ILE  95          HG22      ILE  95  78.557   4.697  -0.605
  771   HG23  ILE  95          HG23      ILE  95  77.813   6.271  -0.882
  772   HD11  ILE  95          HD11      ILE  95  82.443   7.103  -0.718
  773   HD12  ILE  95          HD12      ILE  95  80.791   7.715  -0.752
  774   HD13  ILE  95          HD13      ILE  95  81.804   7.821  -2.191
  775    H    ALA  96           H        ALA  96  77.532   5.692  -4.654
  776    HA   ALA  96           HA       ALA  96  75.146   5.104  -3.219
  777    HB1  ALA  96           HB1      ALA  96  73.990   5.916  -5.139
  778    HB2  ALA  96           HB2      ALA  96  75.365   5.581  -6.194
  779    HB3  ALA  96           HB3      ALA  96  75.458   6.886  -5.011
  780    H    TYR  97           H        TYR  97  77.021   3.470  -5.698
  781    HA   TYR  97           HA       TYR  97  75.078   1.411  -6.196
  782    HB2  TYR  97           HB2      TYR  97  76.723   1.915  -7.911
  783    HB3  TYR  97           HB3      TYR  97  78.043   1.568  -6.795
  784    HD1  TYR  97           HD1      TYR  97  75.076   0.023  -8.458
  785    HD2  TYR  97           HD2      TYR  97  78.848  -0.640  -6.519
  786    HE1  TYR  97           HE1      TYR  97  74.967  -2.376  -9.069
  787    HE2  TYR  97           HE2      TYR  97  78.741  -3.040  -7.129
  788    HH   TYR  97           HH       TYR  97  76.008  -4.330  -9.026
  789    H    LEU  98           H        LEU  98  77.837   1.877  -4.075
  790    HA   LEU  98           HA       LEU  98  78.153  -0.756  -3.145
  791    HB2  LEU  98           HB2      LEU  98  78.753   1.957  -2.005
  792    HB3  LEU  98           HB3      LEU  98  78.993   0.517  -1.022
  793    HG   LEU  98           HG       LEU  98  80.160   0.713  -3.802
  794   HD11  LEU  98          HD11      LEU  98  82.261   1.218  -2.087
  795   HD12  LEU  98          HD12      LEU  98  80.960   2.170  -1.376
  796   HD13  LEU  98          HD13      LEU  98  81.430   2.432  -3.053
  797   HD21  LEU  98          HD21      LEU  98  81.838  -0.836  -2.694
  798   HD22  LEU  98          HD22      LEU  98  80.212  -1.496  -2.844
  799   HD23  LEU  98          HD23      LEU  98  80.770  -0.871  -1.292
  800    H    LYS  99           H        LYS  99  76.232   1.958  -1.883
  801    HA   LYS  99           HA       LYS  99  75.172   0.686   0.366
  802    HB2  LYS  99           HB2      LYS  99  74.184   2.941  -1.368
  803    HB3  LYS  99           HB3      LYS  99  73.242   2.367   0.008
  804    HG2  LYS  99           HG2      LYS  99  75.318   2.682   1.432
  805    HG3  LYS  99           HG3      LYS  99  76.054   3.493   0.051
  806    HD2  LYS  99           HD2      LYS  99  73.400   4.337   1.244
  807    HD3  LYS  99           HD3      LYS  99  74.941   5.030   1.743
  808    HE2  LYS  99           HE2      LYS  99  75.223   5.346  -0.905
  809    HE3  LYS  99           HE3      LYS  99  73.462   5.357  -0.831
  810    HZ1  LYS  99           HZ1      LYS  99  74.013   6.963   1.190
  811    HZ2  LYS  99           HZ2      LYS  99  73.829   7.527  -0.403
  812    HZ3  LYS  99           HZ3      LYS  99  75.382   7.267   0.236
  813    H    LYS 100           H        LYS 100  73.689   1.046  -2.869
  814    HA   LYS 100           HA       LYS 100  71.447  -0.605  -2.236
  815    HB2  LYS 100           HB2      LYS 100  72.574   0.218  -4.921
  816    HB3  LYS 100           HB3      LYS 100  70.993  -0.518  -4.660
  817    HG2  LYS 100           HG2      LYS 100  70.221   1.361  -3.397
  818    HG3  LYS 100           HG3      LYS 100  71.847   2.035  -3.282
  819    HD2  LYS 100           HD2      LYS 100  71.870   2.314  -5.760
  820    HD3  LYS 100           HD3      LYS 100  70.202   1.742  -5.812
  821    HE2  LYS 100           HE2      LYS 100  71.060   4.097  -4.118
  822    HE3  LYS 100           HE3      LYS 100  70.502   4.277  -5.781
  823    HZ1  LYS 100           HZ1      LYS 100  68.946   4.087  -3.510
  824    HZ2  LYS 100           HZ2      LYS 100  68.745   2.607  -4.320
  825    HZ3  LYS 100           HZ3      LYS 100  68.414   4.067  -5.120
  826    H    ALA 101           H        ALA 101  74.657  -1.253  -3.433
  827    HA   ALA 101           HA       ALA 101  73.985  -3.940  -4.330
  828    HB1  ALA 101           HB1      ALA 101  76.671  -2.573  -4.055
  829    HB2  ALA 101           HB2      ALA 101  75.696  -2.631  -5.523
  830    HB3  ALA 101           HB3      ALA 101  76.374  -4.116  -4.856
  831    H    THR 102           H        THR 102  75.072  -2.389  -1.447
  832    HA   THR 102           HA       THR 102  76.094  -4.880  -0.301
  833    HB   THR 102           HB       THR 102  76.548  -3.408   1.698
  834    HG1  THR 102           HG1      THR 102  74.978  -1.785   0.268
  835   HG21  THR 102          HG21      THR 102  78.453  -3.649   0.403
  836   HG22  THR 102          HG22      THR 102  78.211  -1.909   0.267
  837   HG23  THR 102          HG23      THR 102  77.690  -2.975  -1.037
  838    H    ASN 103           H        ASN 103  73.169  -3.591  -0.837
  839    HA   ASN 103           HA       ASN 103  71.998  -4.575   1.697
  840    HB2  ASN 103           HB2      ASN 103  71.167  -2.468  -0.276
  841    HB3  ASN 103           HB1      ASN 103  69.955  -3.262   0.723
  842   HD21  ASN 103          HD21      ASN 103  73.239  -2.734   1.910
  843   HD22  ASN 103          HD22      ASN 103  72.817  -1.556   3.055
  844    H    GLU 104           H        GLU 104  72.187  -4.944  -1.732
  845    HA   GLU 104           HA       GLU 104  70.936  -6.228  -3.234
  846    HB2  GLU 104           HB2      GLU 104  71.920  -8.041  -1.039
  847    HB3  GLU 104           HB3      GLU 104  71.096  -8.684  -2.459
  848    HG2  GLU 104           HG2      GLU 104  73.387  -6.758  -2.784
  849    HG3  GLU 104           HG3      GLU 104  73.702  -8.469  -2.505
  850    HHA  HEC 201           HA       HEC 105  89.314  -3.832   3.266
  851    HHB  HEC 201           HB       HEC 105  85.514  -0.199  -0.259
  852    HHC  HEC 201           HC       HEC 105  88.870  -1.722  -5.406
  853    HHD  HEC 201           HD       HEC 105  92.273  -5.793  -1.966
  854   HMA1  HEC 201          HMA1      HEC 105  85.697   0.532   2.558
  855   HMA2  HEC 201          HMA2      HEC 105  85.040  -0.860   3.417
  856   HMA3  HEC 201          HMA3      HEC 105  84.558  -0.547   1.754
  857   HAA1  HEC 201          HAA1      HEC 105  86.889  -1.347   4.656
  858   HAA2  HEC 201          HAA2      HEC 105  88.279  -2.410   4.588
  859   HBA1  HEC 201          HBA1      HEC 105  86.965  -4.347   4.579
  860   HBA2  HEC 201          HBA2      HEC 105  85.531  -3.488   4.023
  861   HMB1  HEC 201          HMB1      HEC 105  84.986   1.263  -1.972
  862   HMB2  HEC 201          HMB2      HEC 105  84.086  -0.059  -2.712
  863   HMB3  HEC 201          HMB3      HEC 105  84.848   1.160  -3.725
  864    HAB  HEC 201           HAB      HEC 105  87.366  -0.530  -6.033
  865   HBB1  HEC 201          HBB1      HEC 105  87.980   1.680  -5.692
  866   HBB2  HEC 201          HBB2      HEC 105  86.330   1.887  -6.275
  867   HBB3  HEC 201          HBB3      HEC 105  86.675   1.980  -4.549
  868   HMC1  HEC 201          HMC1      HEC 105  91.237  -4.237  -6.858
  869   HMC2  HEC 201          HMC2      HEC 105  91.466  -2.519  -6.536
  870   HMC3  HEC 201          HMC3      HEC 105  89.844  -3.162  -6.785
  871    HAC  HEC 201           HAC      HEC 105  92.727  -6.147  -3.900
  872   HBC1  HEC 201          HBC1      HEC 105  93.274  -3.952  -5.807
  873   HBC2  HEC 201          HBC2      HEC 105  93.676  -5.562  -6.402
  874   HBC3  HEC 201          HBC3      HEC 105  94.399  -4.969  -4.908
  875   HMD1  HEC 201          HMD1      HEC 105  93.287  -6.737   1.529
  876   HMD2  HEC 201          HMD2      HEC 105  93.514  -6.350  -0.173
  877   HMD3  HEC 201          HMD3      HEC 105  92.379  -7.614   0.298
  878   HAD1  HEC 201          HAD1      HEC 105  91.860  -6.603   3.159
  879   HAD2  HEC 201          HAD2      HEC 105  90.394  -5.804   3.688
  880   HBD1  HEC 201          HBD1      HEC 105  91.816  -3.651   3.771
  881   HBD2  HEC 201          HBD2      HEC 105  93.207  -4.730   3.675
  882    H1   HOH 301           H2       HOH 200  83.620   2.751  -1.335
  883    H2   HOH 301           H1       HOH 200  82.328   3.534  -1.252
  884    H1   HOH 302           H2       HOH 201  85.486   5.370   6.180
  885    H2   HOH 302           H1       HOH 201  86.984   5.246   6.351
  886    H1   HOH 303           H2       HOH 202  83.880  -4.796   5.493
  887    H2   HOH 303           H1       HOH 202  82.503  -5.409   5.657
  888    H1   HOH 304           H2       HOH 203  83.836 -10.008   0.372
  889    H2   HOH 304           H1       HOH 203  83.023  -9.441  -0.771
  Start of MODEL   11
    1    H1   GLY   1           H1       GLY   1  72.960  11.267  -5.960
    2    H2   GLY   1           H2       GLY   1  73.602  11.444  -7.523
    3    H3   GLY   1           H3       GLY   1  74.543  11.841  -6.165
    4    HA2  GLY   1           HA2      GLY   1  75.415   9.806  -6.531
    5    HA3  GLY   1           HA3      GLY   1  74.018   9.327  -5.565
    6    H    ASP   2           H        ASP   2  75.638   8.612  -8.311
    7    HA   ASP   2           HA       ASP   2  73.218   7.787  -9.805
    8    HB2  ASP   2           HB2      ASP   2  76.038   8.378 -10.693
    9    HB3  ASP   2           HB1      ASP   2  74.886   7.519 -11.711
   10    H    VAL   3           H        VAL   3  72.860   5.881  -8.624
   11    HA   VAL   3           HA       VAL   3  74.765   3.920  -8.025
   12    HB   VAL   3           HB       VAL   3  72.628   3.728  -7.002
   13   HG11  VAL   3          HG11      VAL   3  71.592   3.886  -9.834
   14   HG12  VAL   3          HG12      VAL   3  71.195   4.922  -8.464
   15   HG13  VAL   3          HG13      VAL   3  70.592   3.266  -8.520
   16   HG21  VAL   3          HG21      VAL   3  72.476   1.579  -9.116
   17   HG22  VAL   3          HG22      VAL   3  72.096   1.462  -7.400
   18   HG23  VAL   3          HG23      VAL   3  73.773   1.583  -7.925
   19    H    GLU   4           H        GLU   4  73.428   4.900 -11.029
   20    HA   GLU   4           HA       GLU   4  73.797   2.417 -12.432
   21    HB2  GLU   4           HB2      GLU   4  73.453   5.260 -13.409
   22    HB3  GLU   4           HB3      GLU   4  73.512   3.850 -14.467
   23    HG2  GLU   4           HG2      GLU   4  71.534   2.918 -13.474
   24    HG3  GLU   4           HG3      GLU   4  71.550   4.113 -12.179
   25    H    LYS   5           H        LYS   5  75.526   5.542 -12.606
   26    HA   LYS   5           HA       LYS   5  77.736   4.407 -14.034
   27    HB2  LYS   5           HB2      LYS   5  77.008   7.056 -12.913
   28    HB3  LYS   5           HB3      LYS   5  78.737   6.726 -12.988
   29    HG2  LYS   5           HG2      LYS   5  78.020   7.792 -15.068
   30    HG3  LYS   5           HG3      LYS   5  78.500   6.128 -15.390
   31    HD2  LYS   5           HD2      LYS   5  76.415   6.609 -16.566
   32    HD3  LYS   5           HD3      LYS   5  76.105   5.443 -15.282
   33    HE2  LYS   5           HE2      LYS   5  74.502   7.503 -15.571
   34    HE3  LYS   5           HE3      LYS   5  74.985   7.005 -13.952
   35    HZ1  LYS   5           HZ1      LYS   5  76.510   8.735 -13.793
   36    HZ2  LYS   5           HZ2      LYS   5  75.180   9.459 -14.561
   37    HZ3  LYS   5           HZ3      LYS   5  76.542   9.006 -15.468
   38    H    GLY   6           H        GLY   6  76.790   4.551 -10.754
   39    HA2  GLY   6           HA2      GLY   6  79.385   4.354  -9.557
   40    HA3  GLY   6           HA3      GLY   6  77.849   3.948  -8.787
   41    H    LYS   7           H        LYS   7  76.972   2.130 -10.794
   42    HA   LYS   7           HA       LYS   7  78.164  -0.279  -9.873
   43    HB2  LYS   7           HB2      LYS   7  75.794  -0.012 -10.706
   44    HB3  LYS   7           HB3      LYS   7  76.451   0.092 -12.338
   45    HG2  LYS   7           HG2      LYS   7  77.708  -2.159 -11.490
   46    HG3  LYS   7           HG3      LYS   7  76.235  -2.263 -10.531
   47    HD2  LYS   7           HD2      LYS   7  75.601  -3.366 -12.490
   48    HD3  LYS   7           HD3      LYS   7  75.033  -1.727 -12.805
   49    HE2  LYS   7           HE2      LYS   7  77.402  -1.371 -13.853
   50    HE3  LYS   7           HE3      LYS   7  77.451  -3.133 -13.918
   51    HZ1  LYS   7           HZ1      LYS   7  75.186  -2.940 -15.017
   52    HZ2  LYS   7           HZ2      LYS   7  76.536  -2.489 -15.944
   53    HZ3  LYS   7           HZ3      LYS   7  75.549  -1.299 -15.240
   54    H    LYS   8           H        LYS   8  78.403   1.596 -12.884
   55    HA   LYS   8           HA       LYS   8  80.024  -0.186 -14.332
   56    HB2  LYS   8           HB2      LYS   8  78.970   1.695 -15.420
   57    HB3  LYS   8           HB3      LYS   8  79.859   2.833 -14.408
   58    HG2  LYS   8           HG2      LYS   8  81.569   0.905 -15.867
   59    HG3  LYS   8           HG3      LYS   8  80.673   2.012 -16.906
   60    HD2  LYS   8           HD2      LYS   8  82.158   3.073 -14.509
   61    HD3  LYS   8           HD3      LYS   8  83.022   2.740 -16.008
   62    HE2  LYS   8           HE2      LYS   8  80.533   4.459 -15.885
   63    HE3  LYS   8           HE3      LYS   8  82.167   5.114 -15.787
   64    HZ1  LYS   8           HZ1      LYS   8  81.544   5.216 -18.038
   65    HZ2  LYS   8           HZ2      LYS   8  80.933   3.630 -18.033
   66    HZ3  LYS   8           HZ3      LYS   8  82.606   3.899 -17.923
   67    H    ILE   9           H        ILE   9  80.924   2.515 -12.198
   68    HA   ILE   9           HA       ILE   9  83.728   2.206 -12.490
   69    HB   ILE   9           HB       ILE   9  82.118   3.433 -10.241
   70   HG12  ILE   9          HG12      ILE   9  83.555   4.798 -12.532
   71   HG13  ILE   9          HG13      ILE   9  81.846   4.370 -12.601
   72   HG21  ILE   9          HG21      ILE   9  84.327   2.999  -9.428
   73   HG22  ILE   9          HG22      ILE   9  84.302   4.701  -9.893
   74   HG23  ILE   9          HG23      ILE   9  85.059   3.509 -10.949
   75   HD11  ILE   9          HD11      ILE   9  81.471   5.686 -10.512
   76   HD12  ILE   9          HD12      ILE   9  82.056   6.680 -11.845
   77   HD13  ILE   9          HD13      ILE   9  83.160   6.189 -10.562
   78    H    PHE  10           H        PHE  10  81.358   0.529 -10.612
   79    HA   PHE  10           HA       PHE  10  83.234  -0.493  -8.662
   80    HB2  PHE  10           HB2      PHE  10  81.106  -0.364  -7.750
   81    HB3  PHE  10           HB1      PHE  10  80.321  -0.883  -9.242
   82    HD1  PHE  10           HD1      PHE  10  80.267  -3.256  -9.881
   83    HD2  PHE  10           HD2      PHE  10  82.031  -1.979  -6.184
   84    HE1  PHE  10           HE1      PHE  10  80.270  -5.600  -9.079
   85    HE2  PHE  10           HE2      PHE  10  82.037  -4.326  -5.377
   86    HZ   PHE  10           HZ       PHE  10  81.157  -6.136  -6.830
   87    H    VAL  11           H        VAL  11  81.365  -1.963 -11.335
   88    HA   VAL  11           HA       VAL  11  82.355  -4.549 -11.135
   89    HB   VAL  11           HB       VAL  11  81.801  -4.770 -13.548
   90   HG11  VAL  11          HG11      VAL  11  80.096  -4.780 -11.638
   91   HG12  VAL  11          HG12      VAL  11  79.461  -4.455 -13.250
   92   HG13  VAL  11          HG13      VAL  11  79.710  -3.129 -12.117
   93   HG21  VAL  11          HG21      VAL  11  80.908  -2.802 -14.725
   94   HG22  VAL  11          HG22      VAL  11  82.577  -2.514 -14.230
   95   HG23  VAL  11          HG23      VAL  11  81.249  -1.800 -13.316
   96    H    GLN  12           H        GLN  12  83.822  -1.708 -12.567
   97    HA   GLN  12           HA       GLN  12  86.008  -3.346 -13.644
   98    HB2  GLN  12           HB2      GLN  12  86.762  -1.292 -14.730
   99    HB3  GLN  12           HB1      GLN  12  85.069  -1.626 -15.090
  100    HG2  GLN  12           HG2      GLN  12  84.643  -0.096 -12.964
  101    HG3  GLN  12           HG1      GLN  12  86.250   0.512 -13.350
  102   HE21  GLN  12          HE21      GLN  12  83.617  -0.551 -15.557
  103   HE22  GLN  12          HE22      GLN  12  83.529   0.921 -16.385
  104    H    LYS  13           H        LYS  13  85.384  -1.193 -10.953
  105    HA   LYS  13           HA       LYS  13  88.277  -1.001 -10.442
  106    HB2  LYS  13           HB2      LYS  13  86.696   1.025 -10.425
  107    HB3  LYS  13           HB3      LYS  13  86.171   0.429  -8.850
  108    HG2  LYS  13           HG2      LYS  13  88.400   0.589  -7.961
  109    HG3  LYS  13           HG3      LYS  13  89.081   0.894  -9.555
  110    HD2  LYS  13           HD2      LYS  13  86.964   2.765  -8.565
  111    HD3  LYS  13           HD3      LYS  13  88.576   2.896  -7.862
  112    HE2  LYS  13           HE2      LYS  13  88.192   2.785 -10.852
  113    HE3  LYS  13           HE3      LYS  13  88.070   4.308  -9.973
  114    HZ1  LYS  13           HZ1      LYS  13  90.329   3.217  -8.976
  115    HZ2  LYS  13           HZ2      LYS  13  90.271   4.383 -10.209
  116    HZ3  LYS  13           HZ3      LYS  13  90.394   2.733 -10.600
  117    H    CYS  14           H        CYS  14  85.404  -1.494  -8.315
  118    HA   CYS  14           HA       CYS  14  87.128  -2.741  -6.351
  119    HB2  CYS  14           HB2      CYS  14  84.156  -2.673  -6.094
  120    HB3  CYS  14           HB1      CYS  14  85.382  -2.535  -4.839
  121    H    ALA  15           H        ALA  15  84.612  -3.922  -8.553
  122    HA   ALA  15           HA       ALA  15  84.108  -6.397  -7.471
  123    HB1  ALA  15           HB1      ALA  15  84.324  -5.450 -10.306
  124    HB2  ALA  15           HB2      ALA  15  82.893  -5.943  -9.403
  125    HB3  ALA  15           HB3      ALA  15  84.037  -7.158  -9.974
  126    H    GLN  16           H        GLN  16  87.045  -5.273  -8.960
  127    HA   GLN  16           HA       GLN  16  88.333  -7.572  -9.725
  128    HB2  GLN  16           HB2      GLN  16  89.260  -5.000  -8.530
  129    HB3  GLN  16           HB1      GLN  16  90.425  -6.313  -8.683
  130    HG2  GLN  16           HG2      GLN  16  89.911  -6.501 -11.083
  131    HG3  GLN  16           HG1      GLN  16  88.729  -5.202 -10.938
  132   HE21  GLN  16          HE21      GLN  16  89.816  -3.135  -9.755
  133   HE22  GLN  16          HE22      GLN  16  91.333  -2.699 -10.381
  134    H    CYS  17           H        CYS  17  88.500  -6.188  -6.409
  135    HA   CYS  17           HA       CYS  17  88.960  -8.944  -5.425
  136    HB2  CYS  17           HB2      CYS  17  90.208  -6.781  -3.848
  137    HB3  CYS  17           HB1      CYS  17  90.837  -8.366  -4.282
  138    H    HIS  18           H        HSD  18  86.407  -8.148  -5.413
  139    HA   HIS  18           HA       HSD  18  85.839  -7.972  -2.577
  140    HB2  HIS  18           HB2      HSD  18  85.257  -5.686  -4.430
  141    HB3  HIS  18           HB1      HSD  18  84.163  -6.024  -3.091
  142    HD1  HIS  18           HD1      HSD  18  85.112  -5.754  -0.665
  143    HD2  HIS  18           HD2      HSD  18  87.781  -4.666  -3.671
  144    HE1  HIS  18           HE1      HSD  18  86.984  -4.477   0.469
  145    H    THR  19           H        THR  19  83.260  -7.662  -2.404
  146    HA   THR  19           HA       THR  19  81.962  -9.329  -4.462
  147    HB   THR  19           HB       THR  19  81.049  -9.917  -1.738
  148    HG1  THR  19           HG1      THR  19  83.293 -11.276  -1.957
  149   HG21  THR  19          HG21      THR  19  82.269 -11.791  -3.764
  150   HG22  THR  19          HG22      THR  19  80.632 -11.163  -3.953
  151   HG23  THR  19          HG23      THR  19  81.044 -12.143  -2.546
  152    H    VAL  20           H        VAL  20  81.579  -7.223  -1.646
  153    HA   VAL  20           HA       VAL  20  79.840  -5.891  -0.948
  154    HB   VAL  20           HB       VAL  20  79.238  -4.201  -2.547
  155   HG11  VAL  20          HG11      VAL  20  82.040  -5.167  -3.175
  156   HG12  VAL  20          HG12      VAL  20  81.602  -4.308  -1.701
  157   HG13  VAL  20          HG13      VAL  20  81.447  -3.511  -3.266
  158   HG21  VAL  20          HG21      VAL  20  80.481  -5.903  -4.710
  159   HG22  VAL  20          HG22      VAL  20  79.530  -4.433  -4.898
  160   HG23  VAL  20          HG23      VAL  20  78.750  -5.926  -4.386
  161    H    GLU  21           H        GLU  21  79.046  -8.658  -1.878
  162    HA   GLU  21           HA       GLU  21  76.200  -8.027  -2.407
  163    HB2  GLU  21           HB2      GLU  21  75.981  -9.929  -3.781
  164    HB3  GLU  21           HB3      GLU  21  77.504  -9.200  -4.285
  165    HG2  GLU  21           HG2      GLU  21  78.602 -10.778  -2.550
  166    HG3  GLU  21           HG3      GLU  21  77.067 -11.646  -2.581
  167    H    LYS  22           H        LYS  22  74.979  -8.433  -0.706
  168    HA   LYS  22           HA       LYS  22  75.827  -9.775   1.605
  169    HB2  LYS  22           HB2      LYS  22  73.953  -8.142   1.511
  170    HB3  LYS  22           HB3      LYS  22  72.977  -9.352   0.679
  171    HG2  LYS  22           HG2      LYS  22  72.702 -10.639   2.572
  172    HG3  LYS  22           HG3      LYS  22  74.275 -10.196   3.233
  173    HD2  LYS  22           HD2      LYS  22  72.456  -9.205   4.566
  174    HD3  LYS  22           HD3      LYS  22  73.417  -7.950   3.785
  175    HE2  LYS  22           HE2      LYS  22  71.760  -7.589   2.106
  176    HE3  LYS  22           HE3      LYS  22  70.893  -9.060   2.545
  177    HZ1  LYS  22           HZ1      LYS  22  70.065  -6.771   3.392
  178    HZ2  LYS  22           HZ2      LYS  22  71.285  -6.957   4.560
  179    HZ3  LYS  22           HZ3      LYS  22  70.044  -8.110   4.433
  180    H    GLY  23           H        GLY  23  75.509 -11.824   2.395
  181    HA2  GLY  23           HA2      GLY  23  75.072 -14.087   2.387
  182    HA3  GLY  23           HA3      GLY  23  73.918 -13.806   1.086
  183    H    GLY  24           H        GLY  24  77.084 -12.595   0.584
  184    HA2  GLY  24           HA2      GLY  24  77.557 -14.658  -1.461
  185    HA3  GLY  24           HA3      GLY  24  78.339 -13.083  -1.378
  186    H    LYS  25           H        LYS  25  80.448 -13.690  -1.347
  187    HA   LYS  25           HA       LYS  25  81.427 -14.886   1.121
  188    HB2  LYS  25           HB2      LYS  25  82.888 -16.484  -0.189
  189    HB3  LYS  25           HB3      LYS  25  81.174 -16.892  -0.156
  190    HG2  LYS  25           HG2      LYS  25  82.069 -15.135  -2.393
  191    HG3  LYS  25           HG3      LYS  25  82.610 -16.811  -2.449
  192    HD2  LYS  25           HD2      LYS  25  80.248 -17.554  -2.170
  193    HD3  LYS  25           HD3      LYS  25  79.736 -15.867  -2.215
  194    HE2  LYS  25           HE2      LYS  25  79.463 -16.628  -4.445
  195    HE3  LYS  25           HE3      LYS  25  80.983 -15.732  -4.466
  196    HZ1  LYS  25           HZ1      LYS  25  82.219 -17.706  -4.422
  197    HZ2  LYS  25           HZ2      LYS  25  80.987 -17.992  -5.556
  198    HZ3  LYS  25           HZ3      LYS  25  80.877 -18.652  -3.994
  199    H    HIS  26           H        HIS  26  83.450 -14.188   1.662
  200    HA   HIS  26           HA       HIS  26  84.440 -11.816   0.597
  201    HB2  HIS  26           HB2      HIS  26  86.354 -13.739   1.856
  202    HB3  HIS  26           HB1      HIS  26  86.162 -12.009   2.129
  203    HD1  HIS  26           HD1      HIS  26  84.838 -15.340   3.191
  204    HD2  HIS  26           HD2      HIS  26  84.074 -11.317   3.970
  205    HE1  HIS  26           HE1      HIS  26  83.325 -15.278   5.221
  206    HE2  HIS  26           HE2      HIS  26  82.851 -12.832   5.709
  207    H    LYS  27           H        LYS  27  85.327 -11.413  -1.310
  208    HA   LYS  27           HA       LYS  27  86.774 -13.583  -2.706
  209    HB2  LYS  27           HB2      LYS  27  84.626 -12.205  -3.627
  210    HB3  LYS  27           HB3      LYS  27  85.922 -11.171  -4.217
  211    HG2  LYS  27           HG2      LYS  27  85.532 -12.769  -5.947
  212    HG3  LYS  27           HG3      LYS  27  87.017 -13.280  -5.146
  213    HD2  LYS  27           HD2      LYS  27  86.032 -15.147  -4.204
  214    HD3  LYS  27           HD3      LYS  27  84.447 -14.385  -4.084
  215    HE2  LYS  27           HE2      LYS  27  84.619 -16.231  -5.815
  216    HE3  LYS  27           HE3      LYS  27  84.029 -14.687  -6.428
  217    HZ1  LYS  27           HZ1      LYS  27  85.779 -15.761  -7.813
  218    HZ2  LYS  27           HZ2      LYS  27  86.875 -15.514  -6.538
  219    HZ3  LYS  27           HZ3      LYS  27  86.155 -14.184  -7.312
  220    H    THR  28           H        THR  28  88.844 -13.283  -1.964
  221    HA   THR  28           HA       THR  28  90.887 -12.268  -1.630
  222    HB   THR  28           HB       THR  28  90.238 -10.589  -4.043
  223    HG1  THR  28           HG1      THR  28  89.835 -12.347  -5.080
  224   HG21  THR  28          HG21      THR  28  92.488 -10.638  -2.677
  225   HG22  THR  28          HG22      THR  28  92.537 -10.659  -4.440
  226   HG23  THR  28          HG23      THR  28  92.748 -12.157  -3.533
  227    H    GLY  29           H        GLY  29  88.486 -11.008  -0.426
  228    HA2  GLY  29           HA2      GLY  29  89.690  -8.738   0.718
  229    HA3  GLY  29           HA3      GLY  29  88.586  -8.200  -0.544
  230    HA   PRO  30           HA       PRO  30  86.344  -9.311   3.513
  231    HB2  PRO  30           HB2      PRO  30  85.919  -6.794   4.496
  232    HB3  PRO  30           HB1      PRO  30  87.350  -7.764   4.900
  233    HG2  PRO  30           HG2      PRO  30  87.060  -5.551   2.922
  234    HG3  PRO  30           HG1      PRO  30  88.388  -5.895   4.043
  235    HD2  PRO  30           HD2      PRO  30  88.491  -6.545   1.385
  236    HD3  PRO  30           HD1      PRO  30  89.346  -7.472   2.638
  237    H    ASN  31           H        ASN  31  84.098  -9.235   3.688
  238    HA   ASN  31           HA       ASN  31  82.673  -8.302   1.359
  239    HB2  ASN  31           HB2      ASN  31  80.792  -9.432   2.260
  240    HB3  ASN  31           HB1      ASN  31  82.180 -10.430   2.685
  241   HD21  ASN  31          HD21      ASN  31  83.175  -9.755   4.960
  242   HD22  ASN  31          HD22      ASN  31  82.037  -9.459   6.185
  243    H    LEU  32           H        LEU  32  81.940  -6.305   1.112
  244    HA   LEU  32           HA       LEU  32  81.843  -4.457   3.328
  245    HB2  LEU  32           HB2      LEU  32  80.843  -3.945   0.527
  246    HB3  LEU  32           HB3      LEU  32  81.399  -2.769   1.712
  247    HG   LEU  32           HG       LEU  32  83.026  -4.721   0.085
  248   HD11  LEU  32          HD11      LEU  32  82.782  -2.539  -0.895
  249   HD12  LEU  32          HD12      LEU  32  84.401  -2.604  -0.206
  250   HD13  LEU  32          HD13      LEU  32  83.117  -1.742   0.640
  251   HD21  LEU  32          HD21      LEU  32  83.896  -5.110   2.276
  252   HD22  LEU  32          HD22      LEU  32  83.770  -3.406   2.705
  253   HD23  LEU  32          HD23      LEU  32  84.980  -3.932   1.540
  254    H    HIS  33           H        HIS  33  80.000  -6.708   3.476
  255    HA   HIS  33           HA       HIS  33  77.357  -5.995   2.795
  256    HB2  HIS  33           HB2      HIS  33  78.354  -7.683   5.106
  257    HB3  HIS  33           HB1      HIS  33  76.687  -7.621   4.538
  258    HD1  HIS  33           HD1      HIS  33  78.130 -10.302   4.417
  259    HD2  HIS  33           HD2      HIS  33  78.166  -7.575   1.264
  260    HE1  HIS  33           HE1      HIS  33  78.633 -11.635   2.324
  261    HE2  HIS  33           HE2      HIS  33  78.655  -9.988   0.393
  262    H    GLY  34           H        GLY  34  75.823  -4.746   3.807
  263    HA2  GLY  34           HA2      GLY  34  75.204  -2.847   5.026
  264    HA3  GLY  34           HA3      GLY  34  75.463  -3.971   6.358
  265    H    LEU  35           H        LEU  35  78.027  -2.910   4.261
  266    HA   LEU  35           HA       LEU  35  79.920  -2.308   6.109
  267    HB2  LEU  35           HB2      LEU  35  80.396  -2.336   3.740
  268    HB3  LEU  35           HB3      LEU  35  79.363  -0.939   3.471
  269    HG   LEU  35           HG       LEU  35  81.051   0.115   5.310
  270   HD11  LEU  35          HD11      LEU  35  82.282  -2.162   5.256
  271   HD12  LEU  35          HD12      LEU  35  83.258  -0.698   5.120
  272   HD13  LEU  35          HD13      LEU  35  82.876  -1.638   3.681
  273   HD21  LEU  35          HD21      LEU  35  81.796  -0.122   2.386
  274   HD22  LEU  35          HD22      LEU  35  82.166   1.212   3.478
  275   HD23  LEU  35          HD23      LEU  35  80.501   0.923   2.972
  276    H    PHE  36           H        PHE  36  77.784   0.137   4.645
  277    HA   PHE  36           HA       PHE  36  78.570   2.311   6.175
  278    HB2  PHE  36           HB2      PHE  36  75.737   1.819   5.241
  279    HB3  PHE  36           HB1      PHE  36  76.528   3.372   5.504
  280    HD1  PHE  36           HD2      PHE  36  76.562   0.305   3.389
  281    HD2  PHE  36           HD1      PHE  36  77.907   4.367   3.814
  282    HE1  PHE  36           HE2      PHE  36  77.416   0.269   1.064
  283    HE2  PHE  36           HE1      PHE  36  78.749   4.330   1.493
  284    HZ   PHE  36           HZ       PHE  36  78.508   2.283   0.112
  285    H    GLY  37           H        GLY  37  78.908   1.761   8.351
  286    HA2  GLY  37           HA2      GLY  37  77.334   2.440  10.316
  287    HA3  GLY  37           HA3      GLY  37  76.552   0.922   9.907
  288    H    ARG  38           H        ARG  38  79.235  -0.302   9.229
  289    HA   ARG  38           HA       ARG  38  79.850  -1.128  11.962
  290    HB2  ARG  38           HB2      ARG  38  80.259  -2.226   9.252
  291    HB3  ARG  38           HB3      ARG  38  81.567  -2.552  10.387
  292    HG2  ARG  38           HG2      ARG  38  79.767  -3.339  12.027
  293    HG3  ARG  38           HG3      ARG  38  78.647  -3.290  10.666
  294    HD2  ARG  38           HD2      ARG  38  81.263  -4.774  10.471
  295    HD3  ARG  38           HD3      ARG  38  79.845  -5.534  11.180
  296    HE   ARG  38           HE       ARG  38  78.756  -4.814   8.923
  297   HH11  ARG  38          HH21      ARG  38  82.033  -5.881   9.406
  298   HH12  ARG  38          HH22      ARG  38  82.187  -6.531   7.811
  299   HH21  ARG  38          HH11      ARG  38  78.973  -5.689   6.852
  300   HH22  ARG  38          HH12      ARG  38  80.461  -6.431   6.373
  301    H    LYS  39           H        LYS  39  82.023  -1.280  12.769
  302    HA   LYS  39           HA       LYS  39  83.553   1.116  12.272
  303    HB2  LYS  39           HB2      LYS  39  83.621  -1.117  14.246
  304    HB3  LYS  39           HB3      LYS  39  85.101  -0.194  14.004
  305    HG2  LYS  39           HG2      LYS  39  82.504   1.269  14.409
  306    HG3  LYS  39           HG3      LYS  39  83.345   0.596  15.805
  307    HD2  LYS  39           HD2      LYS  39  85.425   1.812  15.036
  308    HD3  LYS  39           HD3      LYS  39  84.431   2.609  13.817
  309    HE2  LYS  39           HE2      LYS  39  84.470   4.116  15.654
  310    HE3  LYS  39           HE3      LYS  39  82.902   3.315  15.756
  311    HZ1  LYS  39           HZ1      LYS  39  83.441   2.576  17.755
  312    HZ2  LYS  39           HZ2      LYS  39  84.941   3.369  17.665
  313    HZ3  LYS  39           HZ3      LYS  39  84.791   1.764  17.127
  314    H    THR  40           H        THR  40  85.941   1.013  11.964
  315    HA   THR  40           HA       THR  40  86.588  -0.385   9.601
  316    HB   THR  40           HB       THR  40  88.952   0.399  10.157
  317    HG1  THR  40           HG1      THR  40  87.527   1.719  12.220
  318   HG21  THR  40          HG21      THR  40  88.147   2.884  10.016
  319   HG22  THR  40          HG22      THR  40  86.539   2.172   9.882
  320   HG23  THR  40          HG23      THR  40  87.774   1.788   8.685
  321    H    GLY  41           H        GLY  41  87.755  -2.184   9.179
  322    HA2  GLY  41           HA2      GLY  41  88.480  -4.335   9.538
  323    HA3  GLY  41           HA3      GLY  41  89.478  -3.596  10.788
  324    H    GLN  42           H        GLN  42  85.974  -4.183  10.463
  325    HA   GLN  42           HA       GLN  42  86.014  -5.381  13.169
  326    HB2  GLN  42           HB2      GLN  42  84.588  -3.393  12.930
  327    HB3  GLN  42           HB1      GLN  42  83.698  -4.187  11.629
  328    HG2  GLN  42           HG2      GLN  42  82.840  -5.857  13.097
  329    HG3  GLN  42           HG1      GLN  42  83.973  -5.421  14.374
  330   HE21  GLN  42          HE21      GLN  42  81.988  -3.191  12.382
  331   HE22  GLN  42          HE22      GLN  42  81.119  -2.555  13.693
  332    H    ALA  43           H        ALA  43  85.459  -6.064   9.839
  333    HA   ALA  43           HA       ALA  43  83.757  -8.345  10.285
  334    HB1  ALA  43           HB1      ALA  43  85.044  -8.466   7.732
  335    HB2  ALA  43           HB2      ALA  43  84.596  -6.792   8.057
  336    HB3  ALA  43           HB3      ALA  43  83.369  -8.056   8.098
  337    HA   PRO  44           HA       PRO  44  87.322 -10.931  11.214
  338    HB2  PRO  44           HB2      PRO  44  85.981 -13.178  11.905
  339    HB3  PRO  44           HB1      PRO  44  86.013 -11.744  12.952
  340    HG2  PRO  44           HG2      PRO  44  83.874 -12.685  11.101
  341    HG3  PRO  44           HG1      PRO  44  83.734 -11.995  12.727
  342    HD2  PRO  44           HD2      PRO  44  83.332 -10.553  10.404
  343    HD3  PRO  44           HD1      PRO  44  83.815  -9.827  11.954
  344    H    GLY  45           H        GLY  45  85.820 -10.749   8.460
  345    HA2  GLY  45           HA2      GLY  45  86.063 -13.407   7.368
  346    HA3  GLY  45           HA3      GLY  45  85.710 -11.935   6.470
  347    H    PHE  46           H        PHE  46  87.690 -10.347   6.487
  348    HA   PHE  46           HA       PHE  46  89.970 -11.898   5.474
  349    HB2  PHE  46           HB2      PHE  46  88.807 -10.022   4.154
  350    HB3  PHE  46           HB1      PHE  46  89.611  -8.912   5.265
  351    HD1  PHE  46           HD1      PHE  46  92.123  -8.924   5.434
  352    HD2  PHE  46           HD2      PHE  46  90.011 -11.125   2.411
  353    HE1  PHE  46           HE1      PHE  46  94.215  -9.126   4.120
  354    HE2  PHE  46           HE2      PHE  46  92.103 -11.328   1.095
  355    HZ   PHE  46           HZ       PHE  46  94.206 -10.328   1.950
  356    H    THR  47           H        THR  47  92.137 -11.332   6.038
  357    HA   THR  47           HA       THR  47  92.501 -10.857   8.834
  358    HB   THR  47           HB       THR  47  94.567 -10.922   6.625
  359    HG1  THR  47           HG1      THR  47  93.390 -12.833   6.703
  360   HG21  THR  47          HG21      THR  47  96.016 -11.671   8.582
  361   HG22  THR  47          HG22      THR  47  94.709 -11.132   9.636
  362   HG23  THR  47          HG23      THR  47  95.534  -9.974   8.593
  363    H    TYR  48           H        TYR  48  91.561  -8.789   9.136
  364    HA   TYR  48           HA       TYR  48  92.338  -6.454   7.758
  365    HB2  TYR  48           HB2      TYR  48  90.980  -7.035  10.355
  366    HB3  TYR  48           HB3      TYR  48  91.527  -5.392  10.042
  367    HD1  TYR  48           HD2      TYR  48  91.001  -4.530   7.576
  368    HD2  TYR  48           HD1      TYR  48  88.831  -7.601   9.641
  369    HE1  TYR  48           HE2      TYR  48  89.038  -4.115   6.122
  370    HE2  TYR  48           HE1      TYR  48  86.870  -7.184   8.190
  371    HH   TYR  48           HH       TYR  48  86.392  -4.519   6.462
  372    H    THR  49           H        THR  49  93.690  -4.757   8.357
  373    HA   THR  49           HA       THR  49  96.126  -5.599   9.709
  374    HB   THR  49           HB       THR  49  96.992  -3.408   8.960
  375    HG1  THR  49           HG1      THR  49  94.490  -3.049   7.708
  376   HG21  THR  49          HG21      THR  49  96.327  -3.824   6.418
  377   HG22  THR  49          HG22      THR  49  95.645  -5.308   7.077
  378   HG23  THR  49          HG23      THR  49  97.362  -4.961   7.280
  379    H    ASP  50           H        ASP  50  97.124  -4.221  11.373
  380    HA   ASP  50           HA       ASP  50  95.487  -3.836  13.598
  381    HB2  ASP  50           HB2      ASP  50  97.897  -4.089  13.805
  382    HB3  ASP  50           HB1      ASP  50  98.157  -2.566  12.956
  383    H    ALA  51           H        ALA  51  96.528  -1.529  11.129
  384    HA   ALA  51           HA       ALA  51  95.577   0.815  12.357
  385    HB1  ALA  51           HB1      ALA  51  95.654   0.246   9.388
  386    HB2  ALA  51           HB2      ALA  51  97.065   0.706  10.340
  387    HB3  ALA  51           HB3      ALA  51  95.709   1.822  10.175
  388    H    ASN  52           H        ASN  52  93.963  -1.531  10.242
  389    HA   ASN  52           HA       ASN  52  91.492  -0.023  10.227
  390    HB2  ASN  52           HB2      ASN  52  92.616  -2.050   8.639
  391    HB3  ASN  52           HB1      ASN  52  91.232  -2.809   9.418
  392   HD21  ASN  52          HD21      ASN  52  90.287  -2.805   7.149
  393   HD22  ASN  52          HD22      ASN  52  89.530  -1.389   6.593
  394    H    LYS  53           H        LYS  53  92.952  -2.511  12.130
  395    HA   LYS  53           HA       LYS  53  90.463  -3.338  13.380
  396    HB2  LYS  53           HB2      LYS  53  91.829  -5.174  13.413
  397    HB3  LYS  53           HB3      LYS  53  93.296  -4.207  13.394
  398    HG2  LYS  53           HG2      LYS  53  93.094  -3.738  15.765
  399    HG3  LYS  53           HG3      LYS  53  91.514  -4.521  15.824
  400    HD2  LYS  53           HD2      LYS  53  93.871  -6.088  14.821
  401    HD3  LYS  53           HD3      LYS  53  93.691  -5.842  16.557
  402    HE2  LYS  53           HE2      LYS  53  91.382  -6.765  16.422
  403    HE3  LYS  53           HE3      LYS  53  91.629  -7.078  14.704
  404    HZ1  LYS  53           HZ1      LYS  53  92.569  -8.545  16.981
  405    HZ2  LYS  53           HZ2      LYS  53  93.810  -8.189  15.876
  406    HZ3  LYS  53           HZ3      LYS  53  92.427  -9.032  15.362
  407    H    ASN  54           H        ASN  54  92.675  -0.835  13.637
  408    HA   ASN  54           HA       ASN  54  92.757  -0.394  16.434
  409    HB2  ASN  54           HB2      ASN  54  93.806   1.588  15.906
  410    HB3  ASN  54           HB1      ASN  54  94.097   0.681  14.428
  411   HD21  ASN  54          HD21      ASN  54  91.422   0.920  13.319
  412   HD22  ASN  54          HD22      ASN  54  91.180   2.550  12.916
  413    H    LYS  55           H        LYS  55  90.326   0.006  14.083
  414    HA   LYS  55           HA       LYS  55  88.181   0.855  14.150
  415    HB2  LYS  55           HB2      LYS  55  88.620   0.565  17.131
  416    HB3  LYS  55           HB3      LYS  55  87.061   0.828  16.353
  417    HG2  LYS  55           HG2      LYS  55  87.067  -1.288  15.327
  418    HG3  LYS  55           HG3      LYS  55  88.810  -1.479  15.515
  419    HD2  LYS  55           HD2      LYS  55  86.973  -1.283  17.907
  420    HD3  LYS  55           HD3      LYS  55  87.296  -2.825  17.117
  421    HE2  LYS  55           HE2      LYS  55  89.309  -2.992  18.131
  422    HE3  LYS  55           HE3      LYS  55  89.779  -1.384  17.582
  423    HZ1  LYS  55           HZ1      LYS  55  88.960  -0.398  19.464
  424    HZ2  LYS  55           HZ2      LYS  55  89.520  -1.871  20.099
  425    HZ3  LYS  55           HZ3      LYS  55  87.864  -1.649  19.794
  426    H    GLY  56           H        GLY  56  89.574   2.839  13.437
  427    HA2  GLY  56           HA2      GLY  56  89.676   5.000  15.371
  428    HA3  GLY  56           HA3      GLY  56  90.174   5.080  13.686
  429    H    ILE  57           H        ILE  57  87.798   4.217  12.446
  430    HA   ILE  57           HA       ILE  57  85.722   6.080  13.371
  431    HB   ILE  57           HB       ILE  57  85.521   7.149  11.206
  432   HG12  ILE  57          HG12      ILE  57  87.498   6.644   9.559
  433   HG13  ILE  57          HG13      ILE  57  87.635   5.129  10.447
  434   HG21  ILE  57          HG21      ILE  57  87.225   7.940  12.931
  435   HG22  ILE  57          HG22      ILE  57  87.504   8.478  11.276
  436   HG23  ILE  57          HG23      ILE  57  88.454   7.150  11.943
  437   HD11  ILE  57          HD11      ILE  57  85.726   4.282   9.534
  438   HD12  ILE  57          HD12      ILE  57  85.985   5.507   8.298
  439   HD13  ILE  57          HD13      ILE  57  84.876   5.822   9.627
  440    H    THR  58           H        THR  58  83.770   5.903  11.779
  441    HA   THR  58           HA       THR  58  83.299   3.022  11.323
  442    HB   THR  58           HB       THR  58  81.305   5.237  11.835
  443    HG1  THR  58           HG1      THR  58  82.740   4.478  13.586
  444   HG21  THR  58          HG21      THR  58  80.471   3.341  10.435
  445   HG22  THR  58          HG22      THR  58  79.675   3.437  12.004
  446   HG23  THR  58          HG23      THR  58  80.932   2.234  11.727
  447    H    TRP  59           H        TRP  59  82.514   2.289   9.398
  448    HA   TRP  59           HA       TRP  59  82.965   3.839   7.069
  449    HB2  TRP  59           HB2      TRP  59  81.180   1.409   7.199
  450    HB3  TRP  59           HB1      TRP  59  82.132   1.996   5.834
  451    HD1  TRP  59           HD1      TRP  59  84.869   2.484   7.324
  452    HE1  TRP  59           HE1      TRP  59  86.279   0.463   8.081
  453    HE3  TRP  59           HE3      TRP  59  81.262  -1.118   7.467
  454    HZ2  TRP  59           HZ2      TRP  59  85.910  -2.315   8.704
  455    HZ3  TRP  59           HZ3      TRP  59  81.813  -3.435   8.137
  456    HH2  TRP  59           HH2      TRP  59  84.133  -4.036   8.756
  457    H    LYS  60           H        LYS  60  81.647   5.088   5.883
  458    HA   LYS  60           HA       LYS  60  78.763   5.023   6.212
  459    HB2  LYS  60           HB2      LYS  60  80.395   7.445   7.018
  460    HB3  LYS  60           HB3      LYS  60  78.651   7.461   6.765
  461    HG2  LYS  60           HG2      LYS  60  78.522   5.563   8.474
  462    HG3  LYS  60           HG3      LYS  60  80.202   5.932   8.862
  463    HD2  LYS  60           HD2      LYS  60  78.085   8.086   8.869
  464    HD3  LYS  60           HD3      LYS  60  78.379   7.080  10.286
  465    HE2  LYS  60           HE2      LYS  60  80.783   7.738  10.212
  466    HE3  LYS  60           HE3      LYS  60  80.416   8.822   8.870
  467    HZ1  LYS  60           HZ1      LYS  60  78.915   8.999  11.401
  468    HZ2  LYS  60           HZ2      LYS  60  79.139  10.187  10.207
  469    HZ3  LYS  60           HZ3      LYS  60  80.420   9.763  11.239
  470    H    GLU  61           H        GLU  61  78.283   7.558   5.018
  471    HA   GLU  61           HA       GLU  61  78.864   6.897   2.282
  472    HB2  GLU  61           HB2      GLU  61  76.740   8.005   3.166
  473    HB3  GLU  61           HB3      GLU  61  77.686   9.490   3.281
  474    HG2  GLU  61           HG2      GLU  61  78.228   9.344   0.886
  475    HG3  GLU  61           HG3      GLU  61  77.312   7.844   0.761
  476    H    GLU  62           H        GLU  62  79.591   9.782   4.272
  477    HA   GLU  62           HA       GLU  62  81.439  10.858   2.391
  478    HB2  GLU  62           HB2      GLU  62  81.156  11.429   5.353
  479    HB3  GLU  62           HB3      GLU  62  82.028  12.425   4.186
  480    HG2  GLU  62           HG2      GLU  62  80.030  12.988   3.018
  481    HG3  GLU  62           HG3      GLU  62  79.107  11.734   3.845
  482    H    THR  63           H        THR  63  81.869   9.064   5.434
  483    HA   THR  63           HA       THR  63  84.621   9.104   5.646
  484    HB   THR  63           HB       THR  63  84.414   6.910   6.781
  485    HG1  THR  63           HG1      THR  63  82.668   6.328   5.179
  486   HG21  THR  63          HG21      THR  63  83.887   8.853   8.085
  487   HG22  THR  63          HG22      THR  63  82.651   7.643   8.433
  488   HG23  THR  63          HG23      THR  63  82.291   8.985   7.346
  489    H    LEU  64           H        LEU  64  82.579   7.107   3.584
  490    HA   LEU  64           HA       LEU  64  84.698   5.478   2.593
  491    HB2  LEU  64           HB2      LEU  64  81.838   5.807   2.089
  492    HB3  LEU  64           HB3      LEU  64  82.749   5.459   0.628
  493    HG   LEU  64           HG       LEU  64  83.089   3.839   3.157
  494   HD11  LEU  64          HD11      LEU  64  81.657   2.247   1.426
  495   HD12  LEU  64          HD12      LEU  64  80.914   3.822   1.168
  496   HD13  LEU  64          HD13      LEU  64  80.963   3.130   2.786
  497   HD21  LEU  64          HD21      LEU  64  84.908   3.433   1.698
  498   HD22  LEU  64          HD22      LEU  64  83.899   3.561   0.258
  499   HD23  LEU  64          HD23      LEU  64  83.774   2.144   1.298
  500    H    MET  65           H        MET  65  83.277   8.554   1.624
  501    HA   MET  65           HA       MET  65  84.388   8.713  -0.959
  502    HB2  MET  65           HB2      MET  65  83.694  10.918   0.987
  503    HB3  MET  65           HB1      MET  65  84.089  11.171  -0.712
  504    HG2  MET  65           HG2      MET  65  82.193   9.897  -1.434
  505    HG3  MET  65           HG1      MET  65  81.883   9.321   0.201
  506    HE1  MET  65           HE1      MET  65  80.325  11.563  -2.307
  507    HE2  MET  65           HE2      MET  65  82.014  12.062  -2.270
  508    HE3  MET  65           HE3      MET  65  80.756  13.200  -1.796
  509    H    GLU  66           H        GLU  66  85.600  10.212   2.058
  510    HA   GLU  66           HA       GLU  66  88.030  11.112   0.949
  511    HB2  GLU  66           HB2      GLU  66  87.492  10.297   3.817
  512    HB3  GLU  66           HB3      GLU  66  88.789  11.351   3.254
  513    HG2  GLU  66           HG2      GLU  66  87.002  12.876   2.307
  514    HG3  GLU  66           HG3      GLU  66  85.812  11.890   3.155
  515    H    TYR  67           H        TYR  67  86.982   8.045   2.204
  516    HA   TYR  67           HA       TYR  67  89.614   6.868   2.329
  517    HB2  TYR  67           HB2      TYR  67  88.020   5.969   3.835
  518    HB3  TYR  67           HB3      TYR  67  86.808   5.811   2.573
  519    HD1  TYR  67           HD2      TYR  67  87.005   4.048   0.839
  520    HD2  TYR  67           HD1      TYR  67  89.745   4.305   4.137
  521    HE1  TYR  67           HE2      TYR  67  87.756   1.727   0.396
  522    HE2  TYR  67           HE1      TYR  67  90.494   1.983   3.695
  523    HH   TYR  67           HH       TYR  67  89.502   0.245   0.830
  524    H    LEU  68           H        LEU  68  87.084   7.218  -0.031
  525    HA   LEU  68           HA       LEU  68  88.055   5.141  -1.781
  526    HB2  LEU  68           HB2      LEU  68  85.831   7.100  -1.774
  527    HB3  LEU  68           HB3      LEU  68  86.422   6.633  -3.361
  528    HG   LEU  68           HG       LEU  68  85.620   4.662  -1.203
  529   HD11  LEU  68          HD11      LEU  68  83.688   4.298  -2.935
  530   HD12  LEU  68          HD12      LEU  68  84.085   5.936  -3.457
  531   HD13  LEU  68          HD13      LEU  68  83.586   5.635  -1.794
  532   HD21  LEU  68          HD21      LEU  68  85.426   3.326  -3.535
  533   HD22  LEU  68          HD22      LEU  68  86.913   3.373  -2.592
  534   HD23  LEU  68          HD23      LEU  68  86.709   4.450  -3.968
  535    H    GLU  69           H        GLU  69  88.773   8.477  -1.252
  536    HA   GLU  69           HA       GLU  69  89.970   8.829  -3.893
  537    HB2  GLU  69           HB2      GLU  69  90.043  11.078  -3.420
  538    HB3  GLU  69           HB3      GLU  69  88.742  10.607  -2.329
  539    HG2  GLU  69           HG2      GLU  69  90.604  10.227  -0.579
  540    HG3  GLU  69           HG3      GLU  69  91.635  11.151  -1.669
  541    H    ASN  70           H        ASN  70  90.868   7.619  -0.868
  542    HA   ASN  70           HA       ASN  70  93.523   7.047  -1.673
  543    HB2  ASN  70           HB2      ASN  70  93.474   9.616  -1.034
  544    HB3  ASN  70           HB1      ASN  70  93.553   8.989   0.608
  545   HD21  ASN  70          HD21      ASN  70  95.256   6.808   0.381
  546   HD22  ASN  70          HD22      ASN  70  96.773   7.302  -0.200
  547    HA   PRO  71           HA       PRO  71  91.234   4.520   1.619
  548    HB2  PRO  71           HB2      PRO  71  92.875   2.566   0.043
  549    HB3  PRO  71           HB1      PRO  71  91.240   2.386   0.704
  550    HG2  PRO  71           HG2      PRO  71  91.648   2.878  -1.883
  551    HG3  PRO  71           HG1      PRO  71  90.269   3.567  -1.012
  552    HD2  PRO  71           HD2      PRO  71  92.725   4.916  -1.999
  553    HD3  PRO  71           HD1      PRO  71  91.115   5.598  -1.676
  554    H    LYS  72           H        LYS  72  94.592   4.778   0.586
  555    HA   LYS  72           HA       LYS  72  95.638   3.416   2.910
  556    HB2  LYS  72           HB2      LYS  72  96.784   3.362   0.719
  557    HB3  LYS  72           HB3      LYS  72  97.066   5.097   0.842
  558    HG2  LYS  72           HG2      LYS  72  99.071   4.270   1.691
  559    HG3  LYS  72           HG3      LYS  72  98.141   4.460   3.174
  560    HD2  LYS  72           HD2      LYS  72  99.008   2.281   3.367
  561    HD3  LYS  72           HD3      LYS  72  97.380   2.005   2.751
  562    HE2  LYS  72           HE2      LYS  72  98.494   0.728   1.209
  563    HE3  LYS  72           HE3      LYS  72  98.718   2.281   0.405
  564    HZ1  LYS  72           HZ1      LYS  72 100.632   1.351   2.447
  565    HZ2  LYS  72           HZ2      LYS  72 100.867   2.477   1.196
  566    HZ3  LYS  72           HZ3      LYS  72 100.760   0.819   0.842
  567    H    LYS  73           H        LYS  73  95.598   6.793   1.763
  568    HA   LYS  73           HA       LYS  73  96.992   7.858   3.952
  569    HB2  LYS  73           HB2      LYS  73  96.420   8.958   1.692
  570    HB3  LYS  73           HB3      LYS  73  94.889   9.396   2.447
  571    HG2  LYS  73           HG2      LYS  73  96.008  10.642   4.178
  572    HG3  LYS  73           HG3      LYS  73  97.584  10.034   3.674
  573    HD2  LYS  73           HD2      LYS  73  97.398  12.251   2.780
  574    HD3  LYS  73           HD3      LYS  73  97.173  11.145   1.426
  575    HE2  LYS  73           HE2      LYS  73  94.822  11.480   1.402
  576    HE3  LYS  73           HE3      LYS  73  94.830  12.221   3.002
  577    HZ1  LYS  73           HZ1      LYS  73  96.525  13.558   1.107
  578    HZ2  LYS  73           HZ2      LYS  73  95.356  14.199   2.159
  579    HZ3  LYS  73           HZ3      LYS  73  94.891  13.562   0.655
  580    H    TYR  74           H        TYR  74  93.587   7.089   3.526
  581    HA   TYR  74           HA       TYR  74  92.632   8.570   5.758
  582    HB2  TYR  74           HB2      TYR  74  91.402   7.288   3.734
  583    HB3  TYR  74           HB3      TYR  74  91.221   6.064   4.989
  584    HD1  TYR  74           HD1      TYR  74  90.960   9.797   4.639
  585    HD2  TYR  74           HD2      TYR  74  89.311   6.208   6.327
  586    HE1  TYR  74           HE1      TYR  74  89.123  11.118   5.653
  587    HE2  TYR  74           HE2      TYR  74  87.475   7.530   7.341
  588    HH   TYR  74           HH       TYR  74  87.423  11.067   7.132
  589    H    ILE  75           H        ILE  75  93.233   5.069   5.388
  590    HA   ILE  75           HA       ILE  75  93.840   4.955   8.284
  591    HB   ILE  75           HB       ILE  75  92.396   2.809   6.709
  592   HG12  ILE  75          HG12      ILE  75  91.209   4.617   8.826
  593   HG13  ILE  75          HG13      ILE  75  91.126   5.014   7.110
  594   HG21  ILE  75          HG21      ILE  75  93.122   3.181   9.625
  595   HG22  ILE  75          HG22      ILE  75  93.587   1.857   8.560
  596   HG23  ILE  75          HG23      ILE  75  91.913   2.019   9.085
  597   HD11  ILE  75          HD11      ILE  75  90.112   2.435   8.339
  598   HD12  ILE  75          HD12      ILE  75  89.974   2.904   6.645
  599   HD13  ILE  75          HD13      ILE  75  89.097   3.803   7.882
  600    HA   PRO  76           HA       PRO  76  97.441   3.657   5.493
  601    HB2  PRO  76           HB2      PRO  76  98.624   4.432   8.143
  602    HB3  PRO  76           HB1      PRO  76  99.258   4.704   6.507
  603    HG2  PRO  76           HG2      PRO  76  98.060   6.654   7.876
  604    HG3  PRO  76           HG1      PRO  76  97.876   6.498   6.121
  605    HD2  PRO  76           HD2      PRO  76  95.888   5.970   8.261
  606    HD3  PRO  76           HD1      PRO  76  95.624   6.357   6.547
  607    H    GLY  77           H        GLY  77  98.598   1.723   5.606
  608    HA2  GLY  77           HA2      GLY  77  99.451  -0.214   6.694
  609    HA3  GLY  77           HA3      GLY  77  98.330   0.066   8.024
  610    H    THR  78           H        THR  78  96.072   0.573   6.197
  611    HA   THR  78           HA       THR  78  94.934  -1.969   6.092
  612    HB   THR  78           HB       THR  78  93.620   0.105   5.974
  613    HG1  THR  78           HG1      THR  78  93.413  -1.976   4.187
  614   HG21  THR  78          HG21      THR  78  95.302   1.238   4.449
  615   HG22  THR  78          HG22      THR  78  93.608   1.477   4.016
  616   HG23  THR  78          HG23      THR  78  94.593   0.318   3.123
  617    H    LYS  79           H        LYS  79  94.849  -3.581   4.581
  618    HA   LYS  79           HA       LYS  79  96.871  -3.503   2.494
  619    HB2  LYS  79           HB2      LYS  79  95.125  -5.595   3.714
  620    HB3  LYS  79           HB3      LYS  79  95.735  -5.881   2.085
  621    HG2  LYS  79           HG2      LYS  79  98.052  -5.227   3.060
  622    HG3  LYS  79           HG3      LYS  79  97.299  -5.487   4.635
  623    HD2  LYS  79           HD2      LYS  79  96.577  -7.762   3.800
  624    HD3  LYS  79           HD3      LYS  79  97.594  -7.486   2.386
  625    HE2  LYS  79           HE2      LYS  79  99.551  -7.157   3.879
  626    HE3  LYS  79           HE3      LYS  79  98.526  -7.505   5.272
  627    HZ1  LYS  79           HZ1      LYS  79  97.983  -9.629   3.862
  628    HZ2  LYS  79           HZ2      LYS  79  99.359  -9.566   4.857
  629    HZ3  LYS  79           HZ3      LYS  79  99.505  -9.309   3.184
  630    H    MET  80           H        MET  80  96.119  -2.002   0.994
  631    HA   MET  80           HA       MET  80  94.448  -3.016  -1.052
  632    HB2  MET  80           HB2      MET  80  92.544  -2.535   0.277
  633    HB3  MET  80           HB1      MET  80  93.212  -0.999   0.824
  634    HG2  MET  80           HG2      MET  80  92.731   0.082  -1.176
  635    HG3  MET  80           HG1      MET  80  92.797  -1.406  -2.120
  636    HE1  MET  80           HE1      MET  80  90.206   1.225  -1.018
  637    HE2  MET  80           HE2      MET  80  89.268   0.413  -2.266
  638    HE3  MET  80           HE3      MET  80  90.977   0.741  -2.534
  639    H    ILE  81           H        ILE  81  96.093  -2.394  -2.406
  640    HA   ILE  81           HA       ILE  81  96.430   0.521  -2.794
  641    HB   ILE  81           HB       ILE  81  98.551  -1.635  -3.006
  642   HG12  ILE  81          HG12      ILE  81  99.653  -0.015  -1.317
  643   HG13  ILE  81          HG13      ILE  81  98.046   0.681  -1.125
  644   HG21  ILE  81          HG21      ILE  81 100.022   0.393  -3.499
  645   HG22  ILE  81          HG22      ILE  81  98.530   1.287  -3.790
  646   HG23  ILE  81          HG23      ILE  81  98.936  -0.102  -4.797
  647   HD11  ILE  81          HD11      ILE  81  97.905  -2.214  -0.963
  648   HD12  ILE  81          HD12      ILE  81  97.414  -1.007   0.221
  649   HD13  ILE  81          HD13      ILE  81  99.078  -1.584   0.194
  650    H    PHE  82           H        PHE  82  95.168   0.828  -4.563
  651    HA   PHE  82           HA       PHE  82  95.920  -0.650  -7.000
  652    HB2  PHE  82           HB2      PHE  82  93.896  -1.736  -6.231
  653    HB3  PHE  82           HB1      PHE  82  93.094  -0.180  -6.021
  654    HD1  PHE  82           HD2      PHE  82  94.625  -2.439  -8.562
  655    HD2  PHE  82           HD1      PHE  82  92.037   0.914  -7.848
  656    HE1  PHE  82           HE2      PHE  82  93.903  -2.492 -10.934
  657    HE2  PHE  82           HE1      PHE  82  91.315   0.861 -10.219
  658    HZ   PHE  82           HZ       PHE  82  92.247  -0.843 -11.762
  659    H    ALA  83           H        ALA  83  93.366   1.728  -6.325
  660    HA   ALA  83           HA       ALA  83  94.819   3.948  -7.390
  661    HB1  ALA  83           HB1      ALA  83  94.424   2.700  -9.489
  662    HB2  ALA  83           HB2      ALA  83  93.560   4.237  -9.466
  663    HB3  ALA  83           HB3      ALA  83  92.690   2.733  -9.168
  664    H    GLY  84           H        GLY  84  94.026   5.560  -6.214
  665    HA2  GLY  84           HA2      GLY  84  91.434   5.437  -4.981
  666    HA3  GLY  84           HA3      GLY  84  92.564   6.786  -4.902
  667    H    ILE  85           H        ILE  85  89.752   7.037  -5.258
  668    HA   ILE  85           HA       ILE  85  89.107   7.486  -8.009
  669    HB   ILE  85           HB       ILE  85  87.806   8.470  -5.464
  670   HG12  ILE  85          HG12      ILE  85  87.992   5.911  -6.145
  671   HG13  ILE  85          HG13      ILE  85  86.474   6.560  -5.535
  672   HG21  ILE  85          HG21      ILE  85  87.032   9.931  -7.150
  673   HG22  ILE  85          HG22      ILE  85  85.803   8.668  -7.090
  674   HG23  ILE  85          HG23      ILE  85  87.015   8.655  -8.368
  675   HD11  ILE  85          HD11      ILE  85  85.497   6.644  -7.671
  676   HD12  ILE  85          HD12      ILE  85  86.400   5.130  -7.696
  677   HD13  ILE  85          HD13      ILE  85  87.057   6.561  -8.490
  678    H    LYS  86           H        LYS  86  88.466   9.674  -8.840
  679    HA   LYS  86           HA       LYS  86  90.428  11.701  -7.952
  680    HB2  LYS  86           HB2      LYS  86  89.186  11.819 -10.665
  681    HB3  LYS  86           HB3      LYS  86  90.796  12.308 -10.144
  682    HG2  LYS  86           HG2      LYS  86  89.881   9.419 -10.317
  683    HG3  LYS  86           HG3      LYS  86  90.769  10.246 -11.592
  684    HD2  LYS  86           HD2      LYS  86  91.888  10.279  -8.804
  685    HD3  LYS  86           HD3      LYS  86  92.066   8.822  -9.776
  686    HE2  LYS  86           HE2      LYS  86  92.781  11.491 -10.963
  687    HE3  LYS  86           HE3      LYS  86  93.920  10.674  -9.893
  688    HZ1  LYS  86           HZ1      LYS  86  93.982  10.208 -12.419
  689    HZ2  LYS  86           HZ2      LYS  86  92.661   9.188 -12.098
  690    HZ3  LYS  86           HZ3      LYS  86  94.153   8.917 -11.332
  691    H    LYS  87           H        LYS  87  87.288  11.628  -9.700
  692    HA   LYS  87           HA       LYS  87  86.661  14.276  -8.692
  693    HB2  LYS  87           HB2      LYS  87  84.996  12.370 -10.346
  694    HB3  LYS  87           HB3      LYS  87  84.630  14.067 -10.043
  695    HG2  LYS  87           HG2      LYS  87  86.830  14.668 -11.090
  696    HG3  LYS  87           HG3      LYS  87  87.036  12.970 -11.522
  697    HD2  LYS  87           HD2      LYS  87  84.802  13.108 -12.713
  698    HD3  LYS  87           HD3      LYS  87  84.858  14.852 -12.458
  699    HE2  LYS  87           HE2      LYS  87  87.061  14.913 -13.634
  700    HE3  LYS  87           HE3      LYS  87  86.891  13.191 -13.974
  701    HZ1  LYS  87           HZ1      LYS  87  85.258  15.435 -14.980
  702    HZ2  LYS  87           HZ2      LYS  87  84.660  13.845 -14.983
  703    HZ3  LYS  87           HZ3      LYS  87  86.061  14.230 -15.862
  704    H    LYS  88           H        LYS  88  84.670  14.780  -7.583
  705    HA   LYS  88           HA       LYS  88  84.253  13.112  -5.299
  706    HB2  LYS  88           HB2      LYS  88  84.062  15.489  -5.025
  707    HB3  LYS  88           HB3      LYS  88  82.848  15.596  -6.299
  708    HG2  LYS  88           HG2      LYS  88  82.126  13.708  -4.145
  709    HG3  LYS  88           HG3      LYS  88  82.293  15.372  -3.593
  710    HD2  LYS  88           HD2      LYS  88  80.772  16.099  -5.438
  711    HD3  LYS  88           HD3      LYS  88  80.538  14.404  -5.870
  712    HE2  LYS  88           HE2      LYS  88  78.725  15.290  -4.391
  713    HE3  LYS  88           HE3      LYS  88  79.591  13.929  -3.677
  714    HZ1  LYS  88           HZ1      LYS  88  80.557  16.644  -3.139
  715    HZ2  LYS  88           HZ2      LYS  88  80.629  15.255  -2.162
  716    HZ3  LYS  88           HZ3      LYS  88  79.169  16.109  -2.325
  717    H    THR  89           H        THR  89  82.396  13.798  -8.245
  718    HA   THR  89           HA       THR  89  80.065  12.376  -7.483
  719    HB   THR  89           HB       THR  89  79.588  12.303  -9.926
  720    HG1  THR  89           HG1      THR  89  81.314  12.330 -11.111
  721   HG21  THR  89          HG21      THR  89  80.574  14.956  -8.839
  722   HG22  THR  89          HG22      THR  89  78.969  14.267  -8.589
  723   HG23  THR  89          HG23      THR  89  79.475  14.762 -10.205
  724    H    GLU  90           H        GLU  90  83.166  11.382  -8.687
  725    HA   GLU  90           HA       GLU  90  82.403   8.811  -9.650
  726    HB2  GLU  90           HB2      GLU  90  85.015  10.020  -8.755
  727    HB3  GLU  90           HB3      GLU  90  84.899   8.314  -9.189
  728    HG2  GLU  90           HG2      GLU  90  84.283   8.805 -11.417
  729    HG3  GLU  90           HG3      GLU  90  83.869  10.474 -11.025
  730    H    ARG  91           H        ARG  91  83.418  10.093  -6.532
  731    HA   ARG  91           HA       ARG  91  83.446   7.532  -5.211
  732    HB2  ARG  91           HB2      ARG  91  83.292  10.297  -3.976
  733    HB3  ARG  91           HB3      ARG  91  83.807   8.809  -3.186
  734    HG2  ARG  91           HG2      ARG  91  85.691   8.640  -4.798
  735    HG3  ARG  91           HG3      ARG  91  85.208  10.191  -5.486
  736    HD2  ARG  91           HD2      ARG  91  85.335  10.652  -2.720
  737    HD3  ARG  91           HD3      ARG  91  86.744   9.656  -3.072
  738    HE   ARG  91           HE       ARG  91  86.772  11.568  -5.036
  739   HH11  ARG  91          HH21      ARG  91  86.626  11.554  -1.578
  740   HH12  ARG  91          HH22      ARG  91  87.452  13.065  -1.399
  741   HH21  ARG  91          HH11      ARG  91  87.857  13.550  -4.809
  742   HH22  ARG  91          HH12      ARG  91  88.151  14.195  -3.228
  743    H    GLU  92           H        GLU  92  81.292  10.375  -5.203
  744    HA   GLU  92           HA       GLU  92  79.341   9.393  -3.463
  745    HB2  GLU  92           HB2      GLU  92  79.556  11.739  -4.508
  746    HB3  GLU  92           HB3      GLU  92  78.677  11.068  -5.882
  747    HG2  GLU  92           HG2      GLU  92  76.902  10.299  -4.258
  748    HG3  GLU  92           HG3      GLU  92  77.739  11.215  -3.007
  749    H    ASP  93           H        ASP  93  79.407   9.245  -7.036
  750    HA   ASP  93           HA       ASP  93  77.095   7.675  -7.343
  751    HB2  ASP  93           HB2      ASP  93  79.566   7.751  -9.094
  752    HB3  ASP  93           HB1      ASP  93  77.984   7.138  -9.569
  753    H    LEU  94           H        LEU  94  80.524   6.712  -7.216
  754    HA   LEU  94           HA       LEU  94  80.188   3.952  -7.430
  755    HB2  LEU  94           HB2      LEU  94  82.395   4.990  -7.535
  756    HB3  LEU  94           HB3      LEU  94  82.247   5.505  -5.857
  757    HG   LEU  94           HG       LEU  94  82.205   3.204  -5.091
  758   HD11  LEU  94          HD11      LEU  94  82.746   1.454  -6.967
  759   HD12  LEU  94          HD12      LEU  94  82.032   2.657  -8.041
  760   HD13  LEU  94          HD13      LEU  94  81.079   1.972  -6.724
  761   HD21  LEU  94          HD21      LEU  94  84.425   3.412  -7.133
  762   HD22  LEU  94          HD22      LEU  94  84.470   2.632  -5.554
  763   HD23  LEU  94          HD23      LEU  94  84.403   4.389  -5.665
  764    H    ILE  95           H        ILE  95  79.912   6.088  -4.660
  765    HA   ILE  95           HA       ILE  95  79.675   3.951  -2.773
  766    HB   ILE  95           HB       ILE  95  79.382   6.928  -2.635
  767   HG12  ILE  95          HG12      ILE  95  81.032   5.330  -0.746
  768   HG13  ILE  95          HG13      ILE  95  81.525   5.252  -2.431
  769   HG21  ILE  95          HG21      ILE  95  79.091   6.369  -0.062
  770   HG22  ILE  95          HG22      ILE  95  78.379   4.879  -0.681
  771   HG23  ILE  95          HG23      ILE  95  77.679   6.437  -1.117
  772   HD11  ILE  95          HD11      ILE  95  82.312   7.209  -0.707
  773   HD12  ILE  95          HD12      ILE  95  80.909   7.973  -1.447
  774   HD13  ILE  95          HD13      ILE  95  82.240   7.405  -2.454
  775    H    ALA  96           H        ALA  96  77.479   5.897  -4.674
  776    HA   ALA  96           HA       ALA  96  75.084   5.328  -3.308
  777    HB1  ALA  96           HB1      ALA  96  75.484   5.680  -6.292
  778    HB2  ALA  96           HB2      ALA  96  75.284   6.999  -5.139
  779    HB3  ALA  96           HB3      ALA  96  73.965   5.861  -5.413
  780    H    TYR  97           H        TYR  97  76.963   3.557  -5.695
  781    HA   TYR  97           HA       TYR  97  75.055   1.439  -6.019
  782    HB2  TYR  97           HB2      TYR  97  76.594   1.795  -7.821
  783    HB3  TYR  97           HB3      TYR  97  77.981   1.697  -6.736
  784    HD1  TYR  97           HD1      TYR  97  75.126  -0.281  -8.109
  785    HD2  TYR  97           HD2      TYR  97  78.982  -0.387  -6.220
  786    HE1  TYR  97           HE1      TYR  97  75.223  -2.734  -8.445
  787    HE2  TYR  97           HE2      TYR  97  79.077  -2.842  -6.557
  788    HH   TYR  97           HH       TYR  97  77.066  -4.491  -8.642
  789    H    LEU  98           H        LEU  98  78.242   1.643  -4.396
  790    HA   LEU  98           HA       LEU  98  78.376  -0.826  -3.230
  791    HB2  LEU  98           HB2      LEU  98  79.243   1.888  -2.294
  792    HB3  LEU  98           HB3      LEU  98  79.457   0.500  -1.235
  793    HG   LEU  98           HG       LEU  98  80.377   0.298  -4.091
  794   HD11  LEU  98          HD11      LEU  98  81.289   2.451  -3.090
  795   HD12  LEU  98          HD12      LEU  98  82.498   1.281  -3.604
  796   HD13  LEU  98          HD13      LEU  98  82.107   1.446  -1.894
  797   HD21  LEU  98          HD21      LEU  98  81.495  -0.763  -1.482
  798   HD22  LEU  98          HD22      LEU  98  81.970  -1.255  -3.107
  799   HD23  LEU  98          HD23      LEU  98  80.362  -1.648  -2.501
  800    H    LYS  99           H        LYS  99  76.175   1.755  -2.481
  801    HA   LYS  99           HA       LYS  99  75.388   0.733   0.099
  802    HB2  LYS  99           HB2      LYS  99  74.317   2.869  -1.734
  803    HB3  LYS  99           HB3      LYS  99  73.440   2.380  -0.284
  804    HG2  LYS  99           HG2      LYS  99  75.357   2.929   1.116
  805    HG3  LYS  99           HG3      LYS  99  76.326   3.301  -0.309
  806    HD2  LYS  99           HD2      LYS  99  75.517   5.390   0.621
  807    HD3  LYS  99           HD3      LYS  99  74.673   5.094  -0.898
  808    HE2  LYS  99           HE2      LYS  99  72.670   4.514   0.179
  809    HE3  LYS  99           HE3      LYS  99  73.483   4.147   1.701
  810    HZ1  LYS  99           HZ1      LYS  99  73.738   6.873   0.714
  811    HZ2  LYS  99           HZ2      LYS  99  73.538   6.304   2.302
  812    HZ3  LYS  99           HZ3      LYS  99  72.198   6.416   1.263
  813    H    LYS 100           H        LYS 100  73.785   0.907  -3.088
  814    HA   LYS 100           HA       LYS 100  71.613  -0.775  -2.250
  815    HB2  LYS 100           HB2      LYS 100  71.446   0.961  -4.050
  816    HB3  LYS 100           HB3      LYS 100  72.448  -0.071  -5.070
  817    HG2  LYS 100           HG2      LYS 100  70.813  -1.794  -5.125
  818    HG3  LYS 100           HG3      LYS 100  69.912  -1.093  -3.782
  819    HD2  LYS 100           HD2      LYS 100  70.289   0.543  -6.270
  820    HD3  LYS 100           HD3      LYS 100  69.087  -0.746  -6.278
  821    HE2  LYS 100           HE2      LYS 100  69.176   1.281  -4.044
  822    HE3  LYS 100           HE3      LYS 100  68.310   1.613  -5.544
  823    HZ1  LYS 100           HZ1      LYS 100  66.643   0.365  -4.842
  824    HZ2  LYS 100           HZ2      LYS 100  67.448   0.108  -3.368
  825    HZ3  LYS 100           HZ3      LYS 100  67.667  -0.975  -4.658
  826    H    ALA 101           H        ALA 101  74.785  -1.357  -3.360
  827    HA   ALA 101           HA       ALA 101  74.221  -3.999  -4.438
  828    HB1  ALA 101           HB1      ALA 101  76.053  -2.358  -5.250
  829    HB2  ALA 101           HB2      ALA 101  76.477  -4.062  -5.086
  830    HB3  ALA 101           HB3      ALA 101  76.963  -2.909  -3.843
  831    H    THR 102           H        THR 102  75.397  -2.510  -1.502
  832    HA   THR 102           HA       THR 102  76.183  -5.069  -0.337
  833    HB   THR 102           HB       THR 102  76.721  -3.663   1.659
  834    HG1  THR 102           HG1      THR 102  75.244  -1.909   0.220
  835   HG21  THR 102          HG21      THR 102  78.464  -2.225   0.357
  836   HG22  THR 102          HG22      THR 102  77.829  -3.047  -1.071
  837   HG23  THR 102          HG23      THR 102  78.555  -3.982   0.235
  838    H    ASN 103           H        ASN 103  73.374  -3.434  -0.860
  839    HA   ASN 103           HA       ASN 103  72.072  -4.197   1.654
  840    HB2  ASN 103           HB2      ASN 103  71.294  -2.513  -0.715
  841    HB3  ASN 103           HB1      ASN 103  70.083  -3.080   0.425
  842   HD21  ASN 103          HD21      ASN 103  73.366  -2.329   1.481
  843   HD22  ASN 103          HD22      ASN 103  72.948  -0.938   2.356
  844    H    GLU 104           H        GLU 104  72.381  -5.165  -1.666
  845    HA   GLU 104           HA       GLU 104  70.045  -6.697  -1.980
  846    HB2  GLU 104           HB2      GLU 104  72.799  -6.874  -3.192
  847    HB3  GLU 104           HB3      GLU 104  71.535  -8.029  -3.612
  848    HG2  GLU 104           HG2      GLU 104  70.140  -6.347  -4.522
  849    HG3  GLU 104           HG3      GLU 104  71.049  -5.053  -3.743
  850    HHA  HEC 201           HA       HEC 105  89.564  -3.600   3.087
  851    HHB  HEC 201           HB       HEC 105  85.691  -0.088  -0.466
  852    HHC  HEC 201           HC       HEC 105  88.901  -1.815  -5.637
  853    HHD  HEC 201           HD       HEC 105  92.327  -5.827  -2.151
  854   HMA1  HEC 201          HMA1      HEC 105  85.939   0.781   2.217
  855   HMA2  HEC 201          HMA2      HEC 105  85.385  -0.521   3.268
  856   HMA3  HEC 201          HMA3      HEC 105  84.771  -0.399   1.621
  857   HAA1  HEC 201          HAA1      HEC 105  87.354  -0.923   4.411
  858   HAA2  HEC 201          HAA2      HEC 105  88.630  -2.119   4.349
  859   HBA1  HEC 201          HBA1      HEC 105  87.216  -3.844   4.813
  860   HBA2  HEC 201          HBA2      HEC 105  85.892  -3.156   3.883
  861   HMB1  HEC 201          HMB1      HEC 105  84.911   1.105  -3.966
  862   HMB2  HEC 201          HMB2      HEC 105  85.236   1.429  -2.267
  863   HMB3  HEC 201          HMB3      HEC 105  84.236   0.053  -2.729
  864    HAB  HEC 201           HAB      HEC 105  87.421  -0.576  -6.257
  865   HBB1  HEC 201          HBB1      HEC 105  86.747   1.953  -4.797
  866   HBB2  HEC 201          HBB2      HEC 105  88.038   1.643  -5.950
  867   HBB3  HEC 201          HBB3      HEC 105  86.381   1.840  -6.516
  868   HMC1  HEC 201          HMC1      HEC 105  91.349  -2.569  -6.773
  869   HMC2  HEC 201          HMC2      HEC 105  89.834  -3.432  -7.014
  870   HMC3  HEC 201          HMC3      HEC 105  91.360  -4.311  -7.043
  871    HAC  HEC 201           HAC      HEC 105  92.745  -6.234  -4.094
  872   HBC1  HEC 201          HBC1      HEC 105  93.414  -5.388  -6.769
  873   HBC2  HEC 201          HBC2      HEC 105  94.451  -5.442  -5.344
  874   HBC3  HEC 201          HBC3      HEC 105  93.498  -3.999  -5.687
  875   HMD1  HEC 201          HMD1      HEC 105  93.523  -6.539   1.322
  876   HMD2  HEC 201          HMD2      HEC 105  93.567  -6.374  -0.430
  877   HMD3  HEC 201          HMD3      HEC 105  92.497  -7.562   0.315
  878   HAD1  HEC 201          HAD1      HEC 105  92.191  -6.327   3.025
  879   HAD2  HEC 201          HAD2      HEC 105  90.636  -5.695   3.525
  880   HBD1  HEC 201          HBD1      HEC 105  91.773  -3.393   3.601
  881   HBD2  HEC 201          HBD2      HEC 105  93.292  -4.275   3.494
  882    H1   HOH 301           H2       HOH 200  80.674   2.180  -0.490
  883    H2   HOH 301           H1       HOH 200  81.691   3.237  -0.861
  884    H1   HOH 302           H2       HOH 201  85.724   5.227   6.243
  885    H2   HOH 302           H1       HOH 201  87.129   5.398   5.707
  886    H1   HOH 303           H2       HOH 202  83.792  -5.420   4.837
  887    H2   HOH 303           H1       HOH 202  84.274  -6.423   5.865
  888    H1   HOH 304           H2       HOH 203  81.707 -10.931  -0.085
  889    H2   HOH 304           H1       HOH 203  82.557  -9.684  -0.205
  Start of MODEL   12
    1    H1   GLY   1           H1       GLY   1  74.677  11.881  -8.430
    2    H2   GLY   1           H2       GLY   1  76.042  10.882  -8.594
    3    H3   GLY   1           H3       GLY   1  75.818  11.793  -7.178
    4    HA2  GLY   1           HA2      GLY   1  75.270   9.467  -6.803
    5    HA3  GLY   1           HA3      GLY   1  73.859  10.508  -6.614
    6    H    ASP   2           H        ASP   2  75.540   8.372  -8.882
    7    HA   ASP   2           HA       ASP   2  72.934   7.763 -10.148
    8    HB2  ASP   2           HB2      ASP   2  75.594   8.168 -11.530
    9    HB3  ASP   2           HB1      ASP   2  74.155   7.507 -12.304
   10    H    VAL   3           H        VAL   3  72.744   5.889  -8.889
   11    HA   VAL   3           HA       VAL   3  74.594   3.946  -8.343
   12    HB   VAL   3           HB       VAL   3  72.362   3.758  -7.471
   13   HG11  VAL   3          HG11      VAL   3  70.920   4.694  -9.051
   14   HG12  VAL   3          HG12      VAL   3  70.554   2.977  -9.219
   15   HG13  VAL   3          HG13      VAL   3  71.614   3.772 -10.384
   16   HG21  VAL   3          HG21      VAL   3  73.700   1.648  -8.033
   17   HG22  VAL   3          HG22      VAL   3  72.649   1.475  -9.437
   18   HG23  VAL   3          HG23      VAL   3  71.966   1.427  -7.812
   19    H    GLU   4           H        GLU   4  73.398   4.885 -11.421
   20    HA   GLU   4           HA       GLU   4  73.885   2.423 -12.801
   21    HB2  GLU   4           HB2      GLU   4  73.592   5.270 -13.774
   22    HB3  GLU   4           HB3      GLU   4  73.766   3.882 -14.849
   23    HG2  GLU   4           HG2      GLU   4  71.721   2.918 -14.104
   24    HG3  GLU   4           HG3      GLU   4  71.629   4.000 -12.715
   25    H    LYS   5           H        LYS   5  75.642   5.535 -12.839
   26    HA   LYS   5           HA       LYS   5  77.927   4.404 -14.139
   27    HB2  LYS   5           HB2      LYS   5  77.237   7.037 -12.895
   28    HB3  LYS   5           HB3      LYS   5  78.943   6.661 -13.112
   29    HG2  LYS   5           HG2      LYS   5  78.314   7.774 -15.111
   30    HG3  LYS   5           HG3      LYS   5  78.340   6.068 -15.541
   31    HD2  LYS   5           HD2      LYS   5  76.294   6.770 -16.441
   32    HD3  LYS   5           HD3      LYS   5  75.806   6.117 -14.880
   33    HE2  LYS   5           HE2      LYS   5  75.657   8.310 -13.911
   34    HE3  LYS   5           HE3      LYS   5  76.448   9.046 -15.305
   35    HZ1  LYS   5           HZ1      LYS   5  73.734   8.641 -14.923
   36    HZ2  LYS   5           HZ2      LYS   5  74.202   7.562 -16.149
   37    HZ3  LYS   5           HZ3      LYS   5  74.505   9.226 -16.317
   38    H    GLY   6           H        GLY   6  76.816   4.586 -10.890
   39    HA2  GLY   6           HA2      GLY   6  79.336   4.339  -9.568
   40    HA3  GLY   6           HA3      GLY   6  77.760   3.938  -8.881
   41    H    LYS   7           H        LYS   7  76.981   2.117 -10.923
   42    HA   LYS   7           HA       LYS   7  78.153  -0.284  -9.937
   43    HB2  LYS   7           HB2      LYS   7  75.800  -0.048 -10.808
   44    HB3  LYS   7           HB3      LYS   7  76.477   0.061 -12.432
   45    HG2  LYS   7           HG2      LYS   7  77.663  -2.152 -11.932
   46    HG3  LYS   7           HG3      LYS   7  76.628  -2.270 -10.511
   47    HD2  LYS   7           HD2      LYS   7  75.340  -3.418 -12.069
   48    HD3  LYS   7           HD3      LYS   7  74.698  -1.787 -12.260
   49    HE2  LYS   7           HE2      LYS   7  76.185  -1.399 -14.173
   50    HE3  LYS   7           HE3      LYS   7  76.899  -2.997 -13.963
   51    HZ1  LYS   7           HZ1      LYS   7  75.161  -2.924 -15.685
   52    HZ2  LYS   7           HZ2      LYS   7  74.022  -2.496 -14.499
   53    HZ3  LYS   7           HZ3      LYS   7  74.796  -4.008 -14.431
   54    H    LYS   8           H        LYS   8  78.478   1.584 -12.946
   55    HA   LYS   8           HA       LYS   8  80.121  -0.223 -14.342
   56    HB2  LYS   8           HB2      LYS   8  79.087   1.671 -15.454
   57    HB3  LYS   8           HB3      LYS   8  80.008   2.799 -14.460
   58    HG2  LYS   8           HG2      LYS   8  81.654   0.792 -15.891
   59    HG3  LYS   8           HG3      LYS   8  80.803   1.924 -16.940
   60    HD2  LYS   8           HD2      LYS   8  82.318   2.953 -14.548
   61    HD3  LYS   8           HD3      LYS   8  83.178   2.563 -16.036
   62    HE2  LYS   8           HE2      LYS   8  81.976   4.175 -17.290
   63    HE3  LYS   8           HE3      LYS   8  80.729   4.331 -16.052
   64    HZ1  LYS   8           HZ1      LYS   8  83.414   4.911 -15.154
   65    HZ2  LYS   8           HZ2      LYS   8  81.965   5.749 -14.866
   66    HZ3  LYS   8           HZ3      LYS   8  82.815   5.991 -16.317
   67    H    ILE   9           H        ILE   9  80.970   2.484 -12.199
   68    HA   ILE   9           HA       ILE   9  83.780   2.163 -12.434
   69    HB   ILE   9           HB       ILE   9  82.158   3.424 -10.215
   70   HG12  ILE   9          HG12      ILE   9  83.548   4.815 -12.510
   71   HG13  ILE   9          HG13      ILE   9  81.878   4.268 -12.645
   72   HG21  ILE   9          HG21      ILE   9  84.280   4.709  -9.851
   73   HG22  ILE   9          HG22      ILE   9  85.075   3.643 -11.008
   74   HG23  ILE   9          HG23      ILE   9  84.438   2.989  -9.500
   75   HD11  ILE   9          HD11      ILE   9  81.268   5.600 -10.668
   76   HD12  ILE   9          HD12      ILE   9  81.996   6.626 -11.905
   77   HD13  ILE   9          HD13      ILE   9  82.941   6.131 -10.500
   78    H    PHE  10           H        PHE  10  81.363   0.532 -10.590
   79    HA   PHE  10           HA       PHE  10  83.187  -0.479  -8.585
   80    HB2  PHE  10           HB2      PHE  10  81.042  -0.325  -7.723
   81    HB3  PHE  10           HB1      PHE  10  80.287  -0.849  -9.226
   82    HD1  PHE  10           HD1      PHE  10  80.236  -3.233  -9.853
   83    HD2  PHE  10           HD2      PHE  10  81.896  -1.931  -6.116
   84    HE1  PHE  10           HE1      PHE  10  80.193  -5.567  -9.026
   85    HE2  PHE  10           HE2      PHE  10  81.857  -4.268  -5.287
   86    HZ   PHE  10           HZ       PHE  10  81.004  -6.087  -6.745
   87    H    VAL  11           H        VAL  11  81.370  -1.966 -11.284
   88    HA   VAL  11           HA       VAL  11  82.342  -4.556 -11.034
   89    HB   VAL  11           HB       VAL  11  81.827  -4.808 -13.450
   90   HG11  VAL  11          HG11      VAL  11  79.485  -4.482 -13.203
   91   HG12  VAL  11          HG12      VAL  11  79.716  -3.144 -12.080
   92   HG13  VAL  11          HG13      VAL  11  80.089  -4.791 -11.575
   93   HG21  VAL  11          HG21      VAL  11  80.932  -2.838 -14.650
   94   HG22  VAL  11          HG22      VAL  11  82.615  -2.591 -14.183
   95   HG23  VAL  11          HG23      VAL  11  81.323  -1.827 -13.260
   96    H    GLN  12           H        GLN  12  83.838  -1.741 -12.484
   97    HA   GLN  12           HA       GLN  12  86.019  -3.387 -13.550
   98    HB2  GLN  12           HB2      GLN  12  86.757  -1.397 -14.673
   99    HB3  GLN  12           HB1      GLN  12  85.016  -1.557 -14.901
  100    HG2  GLN  12           HG2      GLN  12  84.714  -0.017 -12.909
  101    HG3  GLN  12           HG1      GLN  12  86.453   0.275 -12.967
  102   HE21  GLN  12          HE21      GLN  12  85.787  -0.241 -16.113
  103   HE22  GLN  12          HE22      GLN  12  85.408   1.333 -16.614
  104    H    LYS  13           H        LYS  13  85.415  -1.201 -10.869
  105    HA   LYS  13           HA       LYS  13  88.303  -1.105 -10.306
  106    HB2  LYS  13           HB2      LYS  13  86.668   0.942 -10.333
  107    HB3  LYS  13           HB3      LYS  13  86.288   0.410  -8.698
  108    HG2  LYS  13           HG2      LYS  13  88.101   1.651  -8.092
  109    HG3  LYS  13           HG3      LYS  13  89.044   0.291  -8.691
  110    HD2  LYS  13           HD2      LYS  13  88.190   2.669 -10.376
  111    HD3  LYS  13           HD3      LYS  13  89.781   2.484  -9.641
  112    HE2  LYS  13           HE2      LYS  13  90.023   0.307 -10.885
  113    HE3  LYS  13           HE3      LYS  13  88.522   0.687 -11.731
  114    HZ1  LYS  13           HZ1      LYS  13  90.671   2.684 -11.673
  115    HZ2  LYS  13           HZ2      LYS  13  89.480   2.414 -12.852
  116    HZ3  LYS  13           HZ3      LYS  13  90.811   1.366 -12.732
  117    H    CYS  14           H        CYS  14  85.383  -1.448  -8.222
  118    HA   CYS  14           HA       CYS  14  87.006  -2.695  -6.186
  119    HB2  CYS  14           HB2      CYS  14  84.026  -2.596  -6.062
  120    HB3  CYS  14           HB1      CYS  14  85.196  -2.452  -4.757
  121    H    ALA  15           H        ALA  15  84.512  -3.897  -8.412
  122    HA   ALA  15           HA       ALA  15  84.002  -6.361  -7.316
  123    HB1  ALA  15           HB1      ALA  15  82.805  -5.919  -9.264
  124    HB2  ALA  15           HB2      ALA  15  83.947  -7.147  -9.808
  125    HB3  ALA  15           HB3      ALA  15  84.248  -5.446 -10.159
  126    H    GLN  16           H        GLN  16  86.951  -5.246  -8.781
  127    HA   GLN  16           HA       GLN  16  88.243  -7.557  -9.515
  128    HB2  GLN  16           HB2      GLN  16  89.247  -5.041  -8.212
  129    HB3  GLN  16           HB1      GLN  16  90.351  -6.349  -8.636
  130    HG2  GLN  16           HG2      GLN  16  89.913  -6.145 -10.935
  131    HG3  GLN  16           HG1      GLN  16  88.393  -5.293 -10.667
  132   HE21  GLN  16          HE21      GLN  16  91.047  -4.256  -8.683
  133   HE22  GLN  16          HE22      GLN  16  91.394  -2.831  -9.535
  134    H    CYS  17           H        CYS  17  88.484  -6.108  -6.230
  135    HA   CYS  17           HA       CYS  17  88.908  -8.854  -5.197
  136    HB2  CYS  17           HB2      CYS  17  90.070  -6.644  -3.615
  137    HB3  CYS  17           HB1      CYS  17  90.734  -8.228  -3.997
  138    H    HIS  18           H        HSD  18  86.335  -8.024  -5.288
  139    HA   HIS  18           HA       HSD  18  85.672  -7.883  -2.468
  140    HB2  HIS  18           HB2      HSD  18  85.128  -5.589  -4.326
  141    HB3  HIS  18           HB1      HSD  18  84.018  -5.933  -3.002
  142    HD1  HIS  18           HD1      HSD  18  84.972  -5.734  -0.556
  143    HD2  HIS  18           HD2      HSD  18  87.604  -4.508  -3.542
  144    HE1  HIS  18           HE1      HSD  18  86.820  -4.446   0.604
  145    H    THR  19           H        THR  19  83.079  -7.529  -2.412
  146    HA   THR  19           HA       THR  19  81.822  -9.116  -4.543
  147    HB   THR  19           HB       THR  19  80.807 -10.012  -2.007
  148    HG1  THR  19           HG1      THR  19  83.246 -11.036  -1.963
  149   HG21  THR  19          HG21      THR  19  82.414 -11.341  -4.204
  150   HG22  THR  19          HG22      THR  19  80.657 -11.308  -4.053
  151   HG23  THR  19          HG23      THR  19  81.627 -12.208  -2.887
  152    H    VAL  20           H        VAL  20  81.525  -7.086  -1.689
  153    HA   VAL  20           HA       VAL  20  79.773  -5.833  -0.867
  154    HB   VAL  20           HB       VAL  20  79.034  -4.139  -2.423
  155   HG11  VAL  20          HG11      VAL  20  81.223  -3.383  -3.253
  156   HG12  VAL  20          HG12      VAL  20  81.879  -5.001  -3.019
  157   HG13  VAL  20          HG13      VAL  20  81.372  -4.047  -1.629
  158   HG21  VAL  20          HG21      VAL  20  78.548  -5.784  -4.292
  159   HG22  VAL  20          HG22      VAL  20  80.278  -5.804  -4.618
  160   HG23  VAL  20          HG23      VAL  20  79.366  -4.309  -4.796
  161    H    GLU  21           H        GLU  21  78.985  -8.570  -1.593
  162    HA   GLU  21           HA       GLU  21  76.108  -8.036  -1.995
  163    HB2  GLU  21           HB2      GLU  21  75.848  -9.858  -3.481
  164    HB3  GLU  21           HB3      GLU  21  77.267  -8.991  -4.067
  165    HG2  GLU  21           HG2      GLU  21  78.612 -10.625  -2.552
  166    HG3  GLU  21           HG3      GLU  21  77.141 -11.598  -2.563
  167    H    LYS  22           H        LYS  22  75.033  -8.649  -0.258
  168    HA   LYS  22           HA       LYS  22  76.102 -10.123   1.872
  169    HB2  LYS  22           HB2      LYS  22  74.152  -8.613   2.064
  170    HB3  LYS  22           HB3      LYS  22  73.185  -9.771   1.149
  171    HG2  LYS  22           HG2      LYS  22  73.154 -11.326   2.878
  172    HG3  LYS  22           HG3      LYS  22  74.667 -10.740   3.573
  173    HD2  LYS  22           HD2      LYS  22  73.581  -8.757   4.431
  174    HD3  LYS  22           HD3      LYS  22  72.085  -9.157   3.588
  175    HE2  LYS  22           HE2      LYS  22  73.361 -10.719   5.850
  176    HE3  LYS  22           HE3      LYS  22  71.852  -9.808   5.917
  177    HZ1  LYS  22           HZ1      LYS  22  72.426 -12.308   4.454
  178    HZ2  LYS  22           HZ2      LYS  22  71.113 -11.319   4.028
  179    HZ3  LYS  22           HZ3      LYS  22  71.198 -12.002   5.581
  180    H    GLY  23           H        GLY  23  76.126 -12.243   2.401
  181    HA2  GLY  23           HA2      GLY  23  75.778 -14.522   2.256
  182    HA3  GLY  23           HA3      GLY  23  74.493 -14.212   1.091
  183    H    GLY  24           H        GLY  24  77.560 -12.775   0.475
  184    HA2  GLY  24           HA2      GLY  24  77.925 -14.535  -1.847
  185    HA3  GLY  24           HA3      GLY  24  78.717 -12.984  -1.579
  186    H    LYS  25           H        LYS  25  80.819 -13.607  -1.792
  187    HA   LYS  25           HA       LYS  25  81.951 -15.123   0.424
  188    HB2  LYS  25           HB2      LYS  25  83.341 -16.448  -1.333
  189    HB3  LYS  25           HB3      LYS  25  81.702 -16.986  -0.970
  190    HG2  LYS  25           HG2      LYS  25  80.827 -15.993  -2.953
  191    HG3  LYS  25           HG3      LYS  25  82.304 -15.071  -3.230
  192    HD2  LYS  25           HD2      LYS  25  83.544 -17.194  -3.573
  193    HD3  LYS  25           HD3      LYS  25  82.039 -18.089  -3.359
  194    HE2  LYS  25           HE2      LYS  25  81.062 -17.016  -5.308
  195    HE3  LYS  25           HE3      LYS  25  82.469 -15.967  -5.481
  196    HZ1  LYS  25           HZ1      LYS  25  83.348 -18.623  -5.371
  197    HZ2  LYS  25           HZ2      LYS  25  83.454 -17.532  -6.669
  198    HZ3  LYS  25           HZ3      LYS  25  82.094 -18.539  -6.510
  199    H    HIS  26           H        HIS  26  83.578 -13.918   1.140
  200    HA   HIS  26           HA       HIS  26  84.649 -11.693  -0.136
  201    HB2  HIS  26           HB2      HIS  26  86.691 -12.307   1.481
  202    HB3  HIS  26           HB1      HIS  26  85.167 -11.677   2.104
  203    HD1  HIS  26           HD1      HIS  26  86.520 -15.137   1.184
  204    HD2  HIS  26           HD2      HIS  26  84.222 -13.283   4.127
  205    HE1  HIS  26           HE1      HIS  26  85.902 -16.940   2.852
  206    HE2  HIS  26           HE2      HIS  26  84.501 -15.824   4.654
  207    H    LYS  27           H        LYS  27  85.818 -11.536  -1.909
  208    HA   LYS  27           HA       LYS  27  87.585 -13.784  -2.687
  209    HB2  LYS  27           HB2      LYS  27  85.670 -13.206  -4.223
  210    HB3  LYS  27           HB3      LYS  27  86.438 -11.640  -4.485
  211    HG2  LYS  27           HG2      LYS  27  88.535 -12.904  -5.167
  212    HG3  LYS  27           HG3      LYS  27  87.561 -14.374  -5.149
  213    HD2  LYS  27           HD2      LYS  27  86.686 -11.954  -6.730
  214    HD3  LYS  27           HD3      LYS  27  87.823 -13.118  -7.407
  215    HE2  LYS  27           HE2      LYS  27  85.051 -13.760  -6.354
  216    HE3  LYS  27           HE3      LYS  27  85.523 -13.697  -8.051
  217    HZ1  LYS  27           HZ1      LYS  27  85.897 -15.787  -6.144
  218    HZ2  LYS  27           HZ2      LYS  27  87.360 -15.351  -6.893
  219    HZ3  LYS  27           HZ3      LYS  27  86.031 -15.833  -7.835
  220    H    THR  28           H        THR  28  89.686 -13.400  -2.428
  221    HA   THR  28           HA       THR  28  91.632 -12.232  -1.978
  222    HB   THR  28           HB       THR  28  90.682 -10.627  -4.361
  223    HG1  THR  28           HG1      THR  28  91.785 -13.203  -4.102
  224   HG21  THR  28          HG21      THR  28  93.320 -10.935  -4.717
  225   HG22  THR  28          HG22      THR  28  93.288 -11.020  -2.958
  226   HG23  THR  28          HG23      THR  28  92.660  -9.595  -3.784
  227    H    GLY  29           H        GLY  29  89.163 -11.237  -0.675
  228    HA2  GLY  29           HA2      GLY  29  90.142  -9.061   0.715
  229    HA3  GLY  29           HA3      GLY  29  89.213  -8.383  -0.619
  230    HA   PRO  30           HA       PRO  30  86.480  -9.928   3.003
  231    HB2  PRO  30           HB2      PRO  30  86.035  -7.556   4.300
  232    HB3  PRO  30           HB1      PRO  30  87.352  -8.666   4.724
  233    HG2  PRO  30           HG2      PRO  30  87.432  -6.173   3.092
  234    HG3  PRO  30           HG1      PRO  30  88.586  -6.769   4.298
  235    HD2  PRO  30           HD2      PRO  30  89.007  -7.020   1.609
  236    HD3  PRO  30           HD1      PRO  30  89.635  -8.188   2.794
  237    H    ASN  31           H        ASN  31  84.218  -8.970   3.540
  238    HA   ASN  31           HA       ASN  31  83.026  -8.047   1.014
  239    HB2  ASN  31           HB2      ASN  31  80.983  -8.933   1.810
  240    HB3  ASN  31           HB1      ASN  31  82.200 -10.100   2.325
  241   HD21  ASN  31          HD21      ASN  31  82.392 -10.495   4.563
  242   HD22  ASN  31          HD22      ASN  31  81.546  -9.625   5.752
  243    H    LEU  32           H        LEU  32  81.254  -6.424   1.174
  244    HA   LEU  32           HA       LEU  32  81.860  -4.399   3.254
  245    HB2  LEU  32           HB2      LEU  32  80.655  -3.826   0.547
  246    HB3  LEU  32           HB3      LEU  32  81.318  -2.674   1.699
  247    HG   LEU  32           HG       LEU  32  82.836  -4.713   0.050
  248   HD11  LEU  32          HD11      LEU  32  82.089  -2.136  -0.546
  249   HD12  LEU  32          HD12      LEU  32  83.506  -2.939  -1.217
  250   HD13  LEU  32          HD13      LEU  32  83.674  -1.877   0.180
  251   HD21  LEU  32          HD21      LEU  32  84.042  -4.834   2.043
  252   HD22  LEU  32          HD22      LEU  32  83.618  -3.196   2.521
  253   HD23  LEU  32          HD23      LEU  32  84.824  -3.462   1.269
  254    H    HIS  33           H        HIS  33  79.986  -6.587   3.546
  255    HA   HIS  33           HA       HIS  33  77.317  -5.808   3.055
  256    HB2  HIS  33           HB2      HIS  33  78.369  -7.535   5.309
  257    HB3  HIS  33           HB1      HIS  33  76.711  -7.493   4.710
  258    HD1  HIS  33           HD1      HIS  33  78.822  -9.970   4.617
  259    HD2  HIS  33           HD2      HIS  33  77.634  -7.556   1.432
  260    HE1  HIS  33           HE1      HIS  33  79.226 -11.315   2.509
  261    HE2  HIS  33           HE2      HIS  33  78.501  -9.861   0.560
  262    H    GLY  34           H        GLY  34  75.873  -4.578   4.196
  263    HA2  GLY  34           HA2      GLY  34  75.337  -2.708   5.488
  264    HA3  GLY  34           HA3      GLY  34  75.718  -3.839   6.786
  265    H    LEU  35           H        LEU  35  78.044  -2.667   4.460
  266    HA   LEU  35           HA       LEU  35  80.082  -2.068   6.185
  267    HB2  LEU  35           HB2      LEU  35  80.360  -2.135   3.765
  268    HB3  LEU  35           HB3      LEU  35  79.359  -0.698   3.585
  269    HG   LEU  35           HG       LEU  35  81.147   0.371   5.226
  270   HD11  LEU  35          HD11      LEU  35  82.239  -1.988   5.388
  271   HD12  LEU  35          HD12      LEU  35  83.292  -0.589   5.188
  272   HD13  LEU  35          HD13      LEU  35  82.908  -1.607   3.806
  273   HD21  LEU  35          HD21      LEU  35  82.306   1.246   3.323
  274   HD22  LEU  35          HD22      LEU  35  80.655   0.935   2.790
  275   HD23  LEU  35          HD23      LEU  35  81.946  -0.188   2.363
  276    H    PHE  36           H        PHE  36  77.834   0.337   4.824
  277    HA   PHE  36           HA       PHE  36  78.726   2.537   6.270
  278    HB2  PHE  36           HB2      PHE  36  75.857   2.046   5.454
  279    HB3  PHE  36           HB1      PHE  36  76.657   3.602   5.679
  280    HD1  PHE  36           HD2      PHE  36  76.557   0.544   3.566
  281    HD2  PHE  36           HD1      PHE  36  78.031   4.562   3.957
  282    HE1  PHE  36           HE2      PHE  36  77.323   0.497   1.209
  283    HE2  PHE  36           HE1      PHE  36  78.789   4.512   1.605
  284    HZ   PHE  36           HZ       PHE  36  78.434   2.483   0.228
  285    H    GLY  37           H        GLY  37  79.137   2.089   8.452
  286    HA2  GLY  37           HA2      GLY  37  77.699   2.813  10.469
  287    HA3  GLY  37           HA3      GLY  37  76.805   1.347  10.109
  288    H    ARG  38           H        ARG  38  79.403  -0.035   9.349
  289    HA   ARG  38           HA       ARG  38  80.040  -0.876  12.074
  290    HB2  ARG  38           HB2      ARG  38  80.314  -2.028   9.363
  291    HB3  ARG  38           HB3      ARG  38  81.578  -2.468  10.511
  292    HG2  ARG  38           HG2      ARG  38  79.779  -3.126  12.140
  293    HG3  ARG  38           HG3      ARG  38  78.591  -2.843  10.867
  294    HD2  ARG  38           HD2      ARG  38  80.790  -4.524   9.937
  295    HD3  ARG  38           HD3      ARG  38  79.974  -5.230  11.326
  296    HE   ARG  38           HE       ARG  38  77.853  -4.682   9.895
  297   HH11  ARG  38          HH21      ARG  38  80.954  -5.767   8.754
  298   HH12  ARG  38          HH22      ARG  38  80.307  -6.549   7.353
  299   HH21  ARG  38          HH11      ARG  38  77.020  -5.722   8.070
  300   HH22  ARG  38          HH12      ARG  38  78.086  -6.530   6.971
  301    H    LYS  39           H        LYS  39  82.008  -0.791  13.051
  302    HA   LYS  39           HA       LYS  39  83.754   1.338  12.439
  303    HB2  LYS  39           HB2      LYS  39  83.885  -1.013  14.304
  304    HB3  LYS  39           HB3      LYS  39  85.280   0.047  14.111
  305    HG2  LYS  39           HG2      LYS  39  82.602   1.309  14.588
  306    HG3  LYS  39           HG3      LYS  39  83.422   0.552  15.952
  307    HD2  LYS  39           HD2      LYS  39  85.410   1.933  15.563
  308    HD3  LYS  39           HD3      LYS  39  84.651   2.657  14.145
  309    HE2  LYS  39           HE2      LYS  39  82.802   3.482  15.628
  310    HE3  LYS  39           HE3      LYS  39  83.710   2.884  17.017
  311    HZ1  LYS  39           HZ1      LYS  39  85.568   4.304  16.325
  312    HZ2  LYS  39           HZ2      LYS  39  84.171   5.203  16.681
  313    HZ3  LYS  39           HZ3      LYS  39  84.619   4.928  15.066
  314    H    THR  40           H        THR  40  86.217   0.934  12.249
  315    HA   THR  40           HA       THR  40  86.693  -0.366   9.760
  316    HB   THR  40           HB       THR  40  89.124   0.160  10.330
  317    HG1  THR  40           HG1      THR  40  87.904   1.602  12.432
  318   HG21  THR  40          HG21      THR  40  87.020   2.336  10.368
  319   HG22  THR  40          HG22      THR  40  87.805   1.652   8.945
  320   HG23  THR  40          HG23      THR  40  88.737   2.619  10.088
  321    H    GLY  41           H        GLY  41  87.887  -2.203   9.283
  322    HA2  GLY  41           HA2      GLY  41  88.445  -4.419   9.552
  323    HA3  GLY  41           HA3      GLY  41  89.348  -3.835  10.947
  324    H    GLN  42           H        GLN  42  85.860  -4.143  10.250
  325    HA   GLN  42           HA       GLN  42  85.580  -5.599  12.816
  326    HB2  GLN  42           HB2      GLN  42  84.403  -3.339  12.464
  327    HB3  GLN  42           HB1      GLN  42  83.343  -4.207  11.354
  328    HG2  GLN  42           HG2      GLN  42  82.951  -5.880  13.239
  329    HG3  GLN  42           HG1      GLN  42  83.758  -4.731  14.304
  330   HE21  GLN  42          HE21      GLN  42  82.708  -2.318  13.036
  331   HE22  GLN  42          HE22      GLN  42  81.049  -2.255  13.386
  332    H    ALA  43           H        ALA  43  85.194  -5.811   9.400
  333    HA   ALA  43           HA       ALA  43  83.175  -7.778   9.272
  334    HB1  ALA  43           HB1      ALA  43  84.818  -8.258   7.090
  335    HB2  ALA  43           HB2      ALA  43  85.110  -6.558   7.460
  336    HB3  ALA  43           HB3      ALA  43  83.472  -7.121   7.140
  337    HA   PRO  44           HA       PRO  44  85.780 -11.076  10.903
  338    HB2  PRO  44           HB2      PRO  44  83.859 -12.961  11.163
  339    HB3  PRO  44           HB1      PRO  44  83.953 -11.565  12.255
  340    HG2  PRO  44           HG2      PRO  44  82.159 -12.018   9.917
  341    HG3  PRO  44           HG1      PRO  44  81.792 -11.304  11.496
  342    HD2  PRO  44           HD2      PRO  44  82.275  -9.826   9.210
  343    HD3  PRO  44           HD1      PRO  44  82.518  -9.213  10.862
  344    H    GLY  45           H        GLY  45  87.150 -11.971   9.442
  345    HA2  GLY  45           HA2      GLY  45  86.779 -14.243   8.023
  346    HA3  GLY  45           HA3      GLY  45  86.207 -13.009   6.905
  347    H    PHE  46           H        PHE  46  87.713 -11.277   6.324
  348    HA   PHE  46           HA       PHE  46  90.294 -12.315   5.679
  349    HB2  PHE  46           HB2      PHE  46  88.955 -10.640   4.318
  350    HB3  PHE  46           HB1      PHE  46  89.431  -9.425   5.505
  351    HD1  PHE  46           HD1      PHE  46  90.855 -12.037   3.234
  352    HD2  PHE  46           HD2      PHE  46  91.507  -8.337   5.315
  353    HE1  PHE  46           HE1      PHE  46  93.044 -11.782   2.094
  354    HE2  PHE  46           HE2      PHE  46  93.695  -8.081   4.175
  355    HZ   PHE  46           HZ       PHE  46  94.463  -9.803   2.564
  356    H    THR  47           H        THR  47  92.310 -11.730   6.456
  357    HA   THR  47           HA       THR  47  92.433 -11.018   9.228
  358    HB   THR  47           HB       THR  47  94.736 -11.155   7.281
  359    HG1  THR  47           HG1      THR  47  93.092 -13.026   7.606
  360   HG21  THR  47          HG21      THR  47  96.024 -11.708   9.263
  361   HG22  THR  47          HG22      THR  47  94.562 -11.733  10.248
  362   HG23  THR  47          HG23      THR  47  95.138 -10.214   9.564
  363    H    TYR  48           H        TYR  48  91.389  -8.921   9.147
  364    HA   TYR  48           HA       TYR  48  92.290  -6.717   7.678
  365    HB2  TYR  48           HB2      TYR  48  90.803  -7.063  10.251
  366    HB3  TYR  48           HB3      TYR  48  91.375  -5.455   9.821
  367    HD1  TYR  48           HD2      TYR  48  90.688  -4.424   7.650
  368    HD2  TYR  48           HD1      TYR  48  88.962  -8.075   9.105
  369    HE1  TYR  48           HE2      TYR  48  88.793  -4.152   6.081
  370    HE2  TYR  48           HE1      TYR  48  87.065  -7.804   7.532
  371    HH   TYR  48           HH       TYR  48  86.428  -4.903   5.924
  372    H    THR  49           H        THR  49  93.634  -4.956   8.252
  373    HA   THR  49           HA       THR  49  96.015  -5.774   9.695
  374    HB   THR  49           HB       THR  49  96.981  -3.709   8.880
  375    HG1  THR  49           HG1      THR  49  94.315  -3.119   8.121
  376   HG21  THR  49          HG21      THR  49  96.418  -5.731   7.315
  377   HG22  THR  49          HG22      THR  49  96.950  -4.212   6.594
  378   HG23  THR  49          HG23      THR  49  95.236  -4.628   6.611
  379    H    ASP  50           H        ASP  50  96.919  -4.674  11.476
  380    HA   ASP  50           HA       ASP  50  95.304  -4.141  13.625
  381    HB2  ASP  50           HB2      ASP  50  97.693  -4.426  13.888
  382    HB3  ASP  50           HB1      ASP  50  98.007  -2.943  12.988
  383    H    ALA  51           H        ALA  51  96.462  -1.849  11.189
  384    HA   ALA  51           HA       ALA  51  95.550   0.527  12.338
  385    HB1  ALA  51           HB1      ALA  51  95.835  -0.306   9.449
  386    HB2  ALA  51           HB2      ALA  51  96.958   0.647  10.419
  387    HB3  ALA  51           HB3      ALA  51  95.406   1.333   9.940
  388    H    ASN  52           H        ASN  52  93.836  -1.848  10.345
  389    HA   ASN  52           HA       ASN  52  91.395  -0.288  10.331
  390    HB2  ASN  52           HB2      ASN  52  92.274  -2.927   9.232
  391    HB3  ASN  52           HB1      ASN  52  90.548  -2.642   9.437
  392   HD21  ASN  52          HD21      ASN  52  90.204  -2.540   7.105
  393   HD22  ASN  52          HD22      ASN  52  90.725  -1.199   6.202
  394    H    LYS  53           H        LYS  53  92.840  -2.793  12.247
  395    HA   LYS  53           HA       LYS  53  90.364  -3.483  13.604
  396    HB2  LYS  53           HB2      LYS  53  91.607  -5.386  13.697
  397    HB3  LYS  53           HB3      LYS  53  93.119  -4.518  13.471
  398    HG2  LYS  53           HG2      LYS  53  93.149  -3.881  15.834
  399    HG3  LYS  53           HG3      LYS  53  91.576  -4.645  16.079
  400    HD2  LYS  53           HD2      LYS  53  92.626  -6.814  15.286
  401    HD3  LYS  53           HD3      LYS  53  94.188  -5.996  15.365
  402    HE2  LYS  53           HE2      LYS  53  92.271  -6.550  17.637
  403    HE3  LYS  53           HE3      LYS  53  93.935  -7.109  17.464
  404    HZ1  LYS  53           HZ1      LYS  53  94.516  -4.644  17.429
  405    HZ2  LYS  53           HZ2      LYS  53  94.074  -5.323  18.923
  406    HZ3  LYS  53           HZ3      LYS  53  92.959  -4.383  18.050
  407    H    ASN  54           H        ASN  54  92.688  -1.067  13.753
  408    HA   ASN  54           HA       ASN  54  92.876  -0.605  16.542
  409    HB2  ASN  54           HB2      ASN  54  93.985   1.329  15.960
  410    HB3  ASN  54           HB1      ASN  54  94.191   0.399  14.481
  411   HD21  ASN  54          HD21      ASN  54  91.506   0.727  13.447
  412   HD22  ASN  54          HD22      ASN  54  91.306   2.362  13.040
  413    H    LYS  55           H        LYS  55  90.396  -0.130  14.256
  414    HA   LYS  55           HA       LYS  55  88.307   0.847  14.359
  415    HB2  LYS  55           HB2      LYS  55  88.776   0.382  17.311
  416    HB3  LYS  55           HB3      LYS  55  87.220   0.806  16.594
  417    HG2  LYS  55           HG2      LYS  55  87.152  -1.227  15.322
  418    HG3  LYS  55           HG3      LYS  55  88.829  -1.604  15.721
  419    HD2  LYS  55           HD2      LYS  55  88.116  -1.673  18.159
  420    HD3  LYS  55           HD3      LYS  55  86.449  -1.594  17.591
  421    HE2  LYS  55           HE2      LYS  55  86.926  -3.917  17.859
  422    HE3  LYS  55           HE3      LYS  55  87.000  -3.613  16.123
  423    HZ1  LYS  55           HZ1      LYS  55  89.344  -3.560  16.183
  424    HZ2  LYS  55           HZ2      LYS  55  88.885  -4.935  17.068
  425    HZ3  LYS  55           HZ3      LYS  55  89.385  -3.528  17.878
  426    H    GLY  56           H        GLY  56  89.792   2.790  13.713
  427    HA2  GLY  56           HA2      GLY  56  89.882   4.887  15.751
  428    HA3  GLY  56           HA3      GLY  56  90.552   4.983  14.125
  429    H    ILE  57           H        ILE  57  88.228   4.145  12.718
  430    HA   ILE  57           HA       ILE  57  86.202   6.174  13.383
  431    HB   ILE  57           HB       ILE  57  86.152   7.001  11.098
  432   HG12  ILE  57          HG12      ILE  57  88.334   6.208   9.736
  433   HG13  ILE  57          HG13      ILE  57  88.088   4.748  10.690
  434   HG21  ILE  57          HG21      ILE  57  87.763   7.948  12.813
  435   HG22  ILE  57          HG22      ILE  57  88.201   8.250  11.132
  436   HG23  ILE  57          HG23      ILE  57  89.026   6.987  12.046
  437   HD11  ILE  57          HD11      ILE  57  86.918   4.941   8.367
  438   HD12  ILE  57          HD12      ILE  57  85.778   5.994   9.201
  439   HD13  ILE  57          HD13      ILE  57  85.984   4.324   9.725
  440    H    THR  58           H        THR  58  84.392   5.909  11.530
  441    HA   THR  58           HA       THR  58  83.911   3.010  11.214
  442    HB   THR  58           HB       THR  58  82.030   5.150  12.196
  443    HG1  THR  58           HG1      THR  58  81.717   3.370  13.751
  444   HG21  THR  58          HG21      THR  58  81.463   2.577  10.779
  445   HG22  THR  58          HG22      THR  58  80.571   4.095  10.742
  446   HG23  THR  58          HG23      THR  58  80.431   3.023  12.135
  447    H    TRP  59           H        TRP  59  83.025   2.327   9.332
  448    HA   TRP  59           HA       TRP  59  83.306   3.946   7.036
  449    HB2  TRP  59           HB2      TRP  59  81.510   1.532   7.142
  450    HB3  TRP  59           HB1      TRP  59  82.497   2.118   5.803
  451    HD1  TRP  59           HD1      TRP  59  85.268   2.443   7.176
  452    HE1  TRP  59           HE1      TRP  59  86.584   0.367   7.975
  453    HE3  TRP  59           HE3      TRP  59  81.463  -0.932   7.594
  454    HZ2  TRP  59           HZ2      TRP  59  86.075  -2.342   8.724
  455    HZ3  TRP  59           HZ3      TRP  59  81.907  -3.248   8.343
  456    HH2  TRP  59           HH2      TRP  59  84.210  -3.956   8.910
  457    H    LYS  60           H        LYS  60  81.884   5.134   5.880
  458    HA   LYS  60           HA       LYS  60  79.038   5.065   6.404
  459    HB2  LYS  60           HB2      LYS  60  80.718   7.468   7.158
  460    HB3  LYS  60           HB3      LYS  60  78.974   7.542   6.916
  461    HG2  LYS  60           HG2      LYS  60  78.839   5.601   8.616
  462    HG3  LYS  60           HG3      LYS  60  80.505   6.013   9.022
  463    HD2  LYS  60           HD2      LYS  60  78.275   8.060   9.019
  464    HD3  LYS  60           HD3      LYS  60  78.713   7.128  10.451
  465    HE2  LYS  60           HE2      LYS  60  81.078   7.955  10.167
  466    HE3  LYS  60           HE3      LYS  60  80.489   9.025   8.895
  467    HZ1  LYS  60           HZ1      LYS  60  78.805   9.305  11.102
  468    HZ2  LYS  60           HZ2      LYS  60  79.870  10.455  10.445
  469    HZ3  LYS  60           HZ3      LYS  60  80.400   9.407  11.672
  470    H    GLU  61           H        GLU  61  78.367   7.496   5.192
  471    HA   GLU  61           HA       GLU  61  78.900   6.840   2.445
  472    HB2  GLU  61           HB2      GLU  61  76.717   7.712   3.107
  473    HB3  GLU  61           HB3      GLU  61  77.466   9.205   3.674
  474    HG2  GLU  61           HG2      GLU  61  78.143   9.814   1.461
  475    HG3  GLU  61           HG3      GLU  61  77.743   8.219   0.829
  476    H    GLU  62           H        GLU  62  79.489   9.802   4.362
  477    HA   GLU  62           HA       GLU  62  81.203  10.958   2.401
  478    HB2  GLU  62           HB2      GLU  62  81.684  12.639   4.094
  479    HB3  GLU  62           HB3      GLU  62  79.958  12.275   4.103
  480    HG2  GLU  62           HG2      GLU  62  80.454  10.591   5.952
  481    HG3  GLU  62           HG3      GLU  62  82.062  11.308   6.048
  482    H    THR  63           H        THR  63  81.778   9.081   5.349
  483    HA   THR  63           HA       THR  63  84.565   9.396   5.491
  484    HB   THR  63           HB       THR  63  84.564   7.333   6.802
  485    HG1  THR  63           HG1      THR  63  82.893   5.973   6.759
  486   HG21  THR  63          HG21      THR  63  82.250   9.220   7.229
  487   HG22  THR  63          HG22      THR  63  83.820   9.223   8.031
  488   HG23  THR  63          HG23      THR  63  82.652   7.949   8.384
  489    H    LEU  64           H        LEU  64  82.530   7.250   3.597
  490    HA   LEU  64           HA       LEU  64  84.622   5.605   2.609
  491    HB2  LEU  64           HB2      LEU  64  81.762   5.963   2.099
  492    HB3  LEU  64           HB3      LEU  64  82.664   5.569   0.646
  493    HG   LEU  64           HG       LEU  64  82.814   3.999   3.234
  494   HD11  LEU  64          HD11      LEU  64  80.805   3.201   2.537
  495   HD12  LEU  64          HD12      LEU  64  81.742   2.330   1.324
  496   HD13  LEU  64          HD13      LEU  64  80.987   3.869   0.917
  497   HD21  LEU  64          HD21      LEU  64  84.769   3.328   2.271
  498   HD22  LEU  64          HD22      LEU  64  84.328   3.971   0.691
  499   HD23  LEU  64          HD23      LEU  64  83.734   2.389   1.198
  500    H    MET  65           H        MET  65  83.182   8.648   1.529
  501    HA   MET  65           HA       MET  65  84.317   8.787  -1.032
  502    HB2  MET  65           HB2      MET  65  83.776  11.049   0.907
  503    HB3  MET  65           HB1      MET  65  84.066  11.234  -0.822
  504    HG2  MET  65           HG2      MET  65  82.078   9.992  -1.364
  505    HG3  MET  65           HG1      MET  65  81.844   9.532   0.321
  506    HE1  MET  65           HE1      MET  65  80.174  13.013  -1.834
  507    HE2  MET  65           HE2      MET  65  80.296  11.291  -2.188
  508    HE3  MET  65           HE3      MET  65  81.719  12.319  -2.347
  509    H    GLU  66           H        GLU  66  85.576  10.260   1.976
  510    HA   GLU  66           HA       GLU  66  88.023  11.115   0.881
  511    HB2  GLU  66           HB2      GLU  66  87.412  10.311   3.737
  512    HB3  GLU  66           HB3      GLU  66  88.795  11.270   3.209
  513    HG2  GLU  66           HG2      GLU  66  87.063  12.868   2.167
  514    HG3  GLU  66           HG3      GLU  66  85.870  12.017   3.146
  515    H    TYR  67           H        TYR  67  86.930   8.032   2.046
  516    HA   TYR  67           HA       TYR  67  89.549   6.838   2.234
  517    HB2  TYR  67           HB2      TYR  67  87.891   5.884   3.633
  518    HB3  TYR  67           HB3      TYR  67  86.730   5.787   2.316
  519    HD1  TYR  67           HD2      TYR  67  86.989   4.098   0.520
  520    HD2  TYR  67           HD1      TYR  67  89.595   4.196   3.933
  521    HE1  TYR  67           HE2      TYR  67  87.746   1.793   0.008
  522    HE2  TYR  67           HE1      TYR  67  90.351   1.890   3.422
  523    HH   TYR  67           HH       TYR  67  88.925   0.045   0.736
  524    H    LEU  68           H        LEU  68  87.074   7.220  -0.189
  525    HA   LEU  68           HA       LEU  68  88.155   5.253  -1.998
  526    HB2  LEU  68           HB2      LEU  68  86.009   7.355  -2.165
  527    HB3  LEU  68           HB3      LEU  68  86.561   6.532  -3.616
  528    HG   LEU  68           HG       LEU  68  85.475   5.167  -1.136
  529   HD11  LEU  68          HD11      LEU  68  84.241   5.283  -3.890
  530   HD12  LEU  68          HD12      LEU  68  83.859   6.469  -2.645
  531   HD13  LEU  68          HD13      LEU  68  83.497   4.763  -2.380
  532   HD21  LEU  68          HD21      LEU  68  86.823   4.189  -3.597
  533   HD22  LEU  68          HD22      LEU  68  85.371   3.318  -3.115
  534   HD23  LEU  68          HD23      LEU  68  86.725   3.458  -1.996
  535    H    GLU  69           H        GLU  69  88.736   8.592  -1.301
  536    HA   GLU  69           HA       GLU  69  90.030   9.128  -3.848
  537    HB2  GLU  69           HB2      GLU  69  88.976  11.044  -3.054
  538    HB3  GLU  69           HB3      GLU  69  89.383  10.698  -1.375
  539    HG2  GLU  69           HG2      GLU  69  91.630  11.383  -1.663
  540    HG3  GLU  69           HG3      GLU  69  91.502  11.336  -3.420
  541    H    ASN  70           H        ASN  70  90.822   7.772  -0.847
  542    HA   ASN  70           HA       ASN  70  93.506   7.250  -1.556
  543    HB2  ASN  70           HB2      ASN  70  93.379   9.811  -0.800
  544    HB3  ASN  70           HB1      ASN  70  93.498   9.086   0.799
  545   HD21  ASN  70          HD21      ASN  70  95.249   6.982   0.456
  546   HD22  ASN  70          HD22      ASN  70  96.742   7.535  -0.133
  547    HA   PRO  71           HA       PRO  71  91.199   4.574   1.550
  548    HB2  PRO  71           HB2      PRO  71  92.914   2.666   0.007
  549    HB3  PRO  71           HB1      PRO  71  91.237   2.485   0.554
  550    HG2  PRO  71           HG2      PRO  71  91.819   3.030  -1.987
  551    HG3  PRO  71           HG1      PRO  71  90.392   3.717  -1.193
  552    HD2  PRO  71           HD2      PRO  71  92.947   5.050  -1.947
  553    HD3  PRO  71           HD1      PRO  71  91.317   5.741  -1.793
  554    H    LYS  72           H        LYS  72  94.601   4.700   0.569
  555    HA   LYS  72           HA       LYS  72  95.568   3.354   2.911
  556    HB2  LYS  72           HB2      LYS  72  96.753   3.380   0.713
  557    HB3  LYS  72           HB3      LYS  72  97.104   5.087   0.972
  558    HG2  LYS  72           HG2      LYS  72  98.906   4.520   2.205
  559    HG3  LYS  72           HG3      LYS  72  97.842   3.734   3.369
  560    HD2  LYS  72           HD2      LYS  72  98.807   2.374   0.837
  561    HD3  LYS  72           HD3      LYS  72  99.644   2.243   2.383
  562    HE2  LYS  72           HE2      LYS  72  96.797   1.380   1.791
  563    HE3  LYS  72           HE3      LYS  72  98.168   0.332   2.149
  564    HZ1  LYS  72           HZ1      LYS  72  97.040   0.530   4.158
  565    HZ2  LYS  72           HZ2      LYS  72  96.757   2.194   3.957
  566    HZ3  LYS  72           HZ3      LYS  72  98.321   1.631   4.310
  567    H    LYS  73           H        LYS  73  95.582   6.766   1.854
  568    HA   LYS  73           HA       LYS  73  96.918   7.732   4.140
  569    HB2  LYS  73           HB2      LYS  73  96.487   8.897   1.865
  570    HB3  LYS  73           HB3      LYS  73  94.964   9.407   2.591
  571    HG2  LYS  73           HG2      LYS  73  96.375  10.227   4.578
  572    HG3  LYS  73           HG3      LYS  73  97.771  10.023   3.521
  573    HD2  LYS  73           HD2      LYS  73  97.259  12.227   3.041
  574    HD3  LYS  73           HD3      LYS  73  96.249  11.429   1.834
  575    HE2  LYS  73           HE2      LYS  73  94.812  12.996   2.904
  576    HE3  LYS  73           HE3      LYS  73  94.397  11.437   3.616
  577    HZ1  LYS  73           HZ1      LYS  73  96.528  12.900   4.933
  578    HZ2  LYS  73           HZ2      LYS  73  95.241  12.013   5.600
  579    HZ3  LYS  73           HZ3      LYS  73  94.988  13.600   5.047
  580    H    TYR  74           H        TYR  74  93.556   6.963   3.571
  581    HA   TYR  74           HA       TYR  74  92.466   8.504   5.692
  582    HB2  TYR  74           HB2      TYR  74  91.328   7.186   3.679
  583    HB3  TYR  74           HB3      TYR  74  91.186   5.922   4.899
  584    HD1  TYR  74           HD1      TYR  74  90.763   9.657   4.701
  585    HD2  TYR  74           HD2      TYR  74  89.198   5.916   6.121
  586    HE1  TYR  74           HE1      TYR  74  88.832  10.844   5.700
  587    HE2  TYR  74           HE2      TYR  74  87.266   7.106   7.119
  588    HH   TYR  74           HH       TYR  74  86.448  10.256   6.347
  589    H    ILE  75           H        ILE  75  93.162   5.008   5.510
  590    HA   ILE  75           HA       ILE  75  93.600   5.036   8.439
  591    HB   ILE  75           HB       ILE  75  92.325   2.805   6.832
  592   HG12  ILE  75          HG12      ILE  75  91.000   4.498   8.956
  593   HG13  ILE  75          HG13      ILE  75  90.987   4.991   7.264
  594   HG21  ILE  75          HG21      ILE  75  91.800   2.041   9.251
  595   HG22  ILE  75          HG22      ILE  75  93.068   3.164   9.739
  596   HG23  ILE  75          HG23      ILE  75  93.448   1.814   8.670
  597   HD11  ILE  75          HD11      ILE  75  90.059   2.264   8.195
  598   HD12  ILE  75          HD12      ILE  75  89.838   2.987   6.602
  599   HD13  ILE  75          HD13      ILE  75  88.971   3.637   7.992
  600    HA   PRO  76           HA       PRO  76  97.474   3.883   6.007
  601    HB2  PRO  76           HB2      PRO  76  98.376   4.658   8.765
  602    HB3  PRO  76           HB1      PRO  76  99.144   4.982   7.197
  603    HG2  PRO  76           HG2      PRO  76  97.747   6.859   8.475
  604    HG3  PRO  76           HG1      PRO  76  97.727   6.725   6.710
  605    HD2  PRO  76           HD2      PRO  76  95.581   6.079   8.652
  606    HD3  PRO  76           HD1      PRO  76  95.454   6.486   6.929
  607    H    GLY  77           H        GLY  77  97.998   1.786   5.889
  608    HA2  GLY  77           HA2      GLY  77  99.059  -0.109   7.066
  609    HA3  GLY  77           HA3      GLY  77  97.877   0.132   8.349
  610    H    THR  78           H        THR  78  95.739   0.720   6.368
  611    HA   THR  78           HA       THR  78  94.573  -1.804   6.162
  612    HB   THR  78           HB       THR  78  93.301   0.293   5.972
  613    HG1  THR  78           HG1      THR  78  93.218  -1.684   4.004
  614   HG21  THR  78          HG21      THR  78  93.428   1.654   3.995
  615   HG22  THR  78          HG22      THR  78  94.504   0.500   3.207
  616   HG23  THR  78          HG23      THR  78  95.075   1.434   4.590
  617    H    LYS  79           H        LYS  79  94.538  -3.384   4.609
  618    HA   LYS  79           HA       LYS  79  96.680  -3.261   2.622
  619    HB2  LYS  79           HB2      LYS  79  95.885  -5.275   4.229
  620    HB3  LYS  79           HB3      LYS  79  94.914  -5.649   2.810
  621    HG2  LYS  79           HG2      LYS  79  96.876  -6.797   2.313
  622    HG3  LYS  79           HG3      LYS  79  97.183  -5.255   1.515
  623    HD2  LYS  79           HD2      LYS  79  98.457  -4.473   3.461
  624    HD3  LYS  79           HD3      LYS  79  98.104  -5.975   4.316
  625    HE2  LYS  79           HE2      LYS  79  99.199  -7.164   2.306
  626    HE3  LYS  79           HE3      LYS  79  99.831  -5.575   1.874
  627    HZ1  LYS  79           HZ1      LYS  79 100.227  -6.936   4.483
  628    HZ2  LYS  79           HZ2      LYS  79 100.853  -5.417   4.049
  629    HZ3  LYS  79           HZ3      LYS  79 101.386  -6.819   3.250
  630    H    MET  80           H        MET  80  95.879  -1.831   1.074
  631    HA   MET  80           HA       MET  80  94.271  -2.976  -0.968
  632    HB2  MET  80           HB2      MET  80  92.378  -2.494   0.432
  633    HB3  MET  80           HB1      MET  80  92.972  -0.868   0.771
  634    HG2  MET  80           HG2      MET  80  92.578  -0.151  -1.474
  635    HG3  MET  80           HG1      MET  80  92.334  -1.805  -2.034
  636    HE1  MET  80           HE1      MET  80  90.336   1.380  -1.264
  637    HE2  MET  80           HE2      MET  80  89.058   0.537  -2.130
  638    HE3  MET  80           HE3      MET  80  90.711   0.479  -2.737
  639    H    ILE  81           H        ILE  81  95.903  -2.339  -2.333
  640    HA   ILE  81           HA       ILE  81  96.148   0.575  -2.791
  641    HB   ILE  81           HB       ILE  81  98.339  -1.515  -2.811
  642   HG12  ILE  81          HG12      ILE  81  99.373   0.269  -1.273
  643   HG13  ILE  81          HG13      ILE  81  97.767   0.989  -1.204
  644   HG21  ILE  81          HG21      ILE  81  99.760   0.524  -3.467
  645   HG22  ILE  81          HG22      ILE  81  98.241   1.291  -3.928
  646   HG23  ILE  81          HG23      ILE  81  98.764  -0.188  -4.735
  647   HD11  ILE  81          HD11      ILE  81  98.746  -1.116   0.389
  648   HD12  ILE  81          HD12      ILE  81  97.610  -1.873  -0.725
  649   HD13  ILE  81          HD13      ILE  81  97.084  -0.540   0.301
  650    H    PHE  82           H        PHE  82  94.937   0.803  -4.600
  651    HA   PHE  82           HA       PHE  82  95.785  -0.723  -6.977
  652    HB2  PHE  82           HB2      PHE  82  93.636  -1.653  -5.976
  653    HB3  PHE  82           HB1      PHE  82  92.881  -0.119  -6.403
  654    HD1  PHE  82           HD2      PHE  82  92.575   0.533  -8.752
  655    HD2  PHE  82           HD1      PHE  82  94.375  -3.220  -7.691
  656    HE1  PHE  82           HE2      PHE  82  92.291  -0.263 -11.083
  657    HE2  PHE  82           HE1      PHE  82  94.092  -4.015 -10.022
  658    HZ   PHE  82           HZ       PHE  82  93.050  -2.537 -11.719
  659    H    ALA  83           H        ALA  83  93.302   1.737  -6.261
  660    HA   ALA  83           HA       ALA  83  94.717   3.922  -7.362
  661    HB1  ALA  83           HB1      ALA  83  92.608   2.832  -9.228
  662    HB2  ALA  83           HB2      ALA  83  94.329   2.515  -9.445
  663    HB3  ALA  83           HB3      ALA  83  93.720   4.169  -9.515
  664    H    GLY  84           H        GLY  84  93.835   5.569  -6.296
  665    HA2  GLY  84           HA2      GLY  84  91.260   5.417  -5.061
  666    HA3  GLY  84           HA3      GLY  84  92.305   6.834  -5.116
  667    H    ILE  85           H        ILE  85  89.725   7.391  -5.360
  668    HA   ILE  85           HA       ILE  85  88.948   7.407  -8.179
  669    HB   ILE  85           HB       ILE  85  87.590   8.421  -5.676
  670   HG12  ILE  85          HG12      ILE  85  87.833   5.870  -6.350
  671   HG13  ILE  85          HG13      ILE  85  86.289   6.489  -5.773
  672   HG21  ILE  85          HG21      ILE  85  86.823   8.596  -8.587
  673   HG22  ILE  85          HG22      ILE  85  86.805   9.869  -7.368
  674   HG23  ILE  85          HG23      ILE  85  85.600   8.582  -7.317
  675   HD11  ILE  85          HD11      ILE  85  86.294   5.054  -7.935
  676   HD12  ILE  85          HD12      ILE  85  86.930   6.501  -8.716
  677   HD13  ILE  85          HD13      ILE  85  85.354   6.545  -7.926
  678    H    LYS  86           H        LYS  86  88.398   9.395  -9.286
  679    HA   LYS  86           HA       LYS  86  90.294  11.534  -8.630
  680    HB2  LYS  86           HB2      LYS  86  88.753  10.798 -11.113
  681    HB3  LYS  86           HB3      LYS  86  89.583  12.347 -10.958
  682    HG2  LYS  86           HG2      LYS  86  91.699  11.148 -10.467
  683    HG3  LYS  86           HG3      LYS  86  90.862   9.610 -10.687
  684    HD2  LYS  86           HD2      LYS  86  90.491  10.012 -12.996
  685    HD3  LYS  86           HD3      LYS  86  90.869  11.729 -12.840
  686    HE2  LYS  86           HE2      LYS  86  92.903   9.562 -12.272
  687    HE3  LYS  86           HE3      LYS  86  92.702  10.280 -13.870
  688    HZ1  LYS  86           HZ1      LYS  86  92.871  12.225 -11.768
  689    HZ2  LYS  86           HZ2      LYS  86  93.722  12.138 -13.237
  690    HZ3  LYS  86           HZ3      LYS  86  94.264  11.264 -11.885
  691    H    LYS  87           H        LYS  87  87.048  11.644 -10.126
  692    HA   LYS  87           HA       LYS  87  86.553  14.210  -8.883
  693    HB2  LYS  87           HB2      LYS  87  84.482  12.626 -10.376
  694    HB3  LYS  87           HB3      LYS  87  84.696  14.374 -10.286
  695    HG2  LYS  87           HG2      LYS  87  86.982  13.930 -11.448
  696    HG3  LYS  87           HG3      LYS  87  86.288  12.363 -11.868
  697    HD2  LYS  87           HD2      LYS  87  85.059  15.061 -12.519
  698    HD3  LYS  87           HD3      LYS  87  85.904  14.019 -13.663
  699    HE2  LYS  87           HE2      LYS  87  83.796  13.240 -14.096
  700    HE3  LYS  87           HE3      LYS  87  84.084  12.257 -12.662
  701    HZ1  LYS  87           HZ1      LYS  87  82.425  14.638 -12.986
  702    HZ2  LYS  87           HZ2      LYS  87  83.220  14.444 -11.499
  703    HZ3  LYS  87           HZ3      LYS  87  82.152  13.245 -12.057
  704    H    LYS  88           H        LYS  88  84.537  14.667  -7.710
  705    HA   LYS  88           HA       LYS  88  84.233  12.884  -5.496
  706    HB2  LYS  88           HB2      LYS  88  83.967  15.440  -5.491
  707    HB3  LYS  88           HB3      LYS  88  82.360  15.153  -6.162
  708    HG2  LYS  88           HG2      LYS  88  81.780  13.738  -4.241
  709    HG3  LYS  88           HG3      LYS  88  83.402  13.943  -3.581
  710    HD2  LYS  88           HD2      LYS  88  82.281  15.588  -2.394
  711    HD3  LYS  88           HD3      LYS  88  82.800  16.527  -3.793
  712    HE2  LYS  88           HE2      LYS  88  80.621  16.158  -4.869
  713    HE3  LYS  88           HE3      LYS  88  80.100  15.172  -3.504
  714    HZ1  LYS  88           HZ1      LYS  88  79.759  17.852  -3.738
  715    HZ2  LYS  88           HZ2      LYS  88  81.115  17.738  -2.721
  716    HZ3  LYS  88           HZ3      LYS  88  79.661  16.971  -2.292
  717    H    THR  89           H        THR  89  82.112  13.829  -8.209
  718    HA   THR  89           HA       THR  89  79.879  12.311  -7.527
  719    HB   THR  89           HB       THR  89  79.384  12.250  -9.962
  720    HG1  THR  89           HG1      THR  89  81.521  13.852 -10.570
  721   HG21  THR  89          HG21      THR  89  79.327  14.723 -10.250
  722   HG22  THR  89          HG22      THR  89  80.396  14.886  -8.856
  723   HG23  THR  89          HG23      THR  89  78.775  14.221  -8.653
  724    H    GLU  90           H        GLU  90  82.965  11.318  -8.813
  725    HA   GLU  90           HA       GLU  90  82.150   8.730  -9.707
  726    HB2  GLU  90           HB2      GLU  90  84.812   9.948  -8.981
  727    HB3  GLU  90           HB3      GLU  90  84.667   8.239  -9.387
  728    HG2  GLU  90           HG2      GLU  90  83.690   8.810 -11.554
  729    HG3  GLU  90           HG3      GLU  90  83.744  10.524 -11.148
  730    H    ARG  91           H        ARG  91  83.236  10.108  -6.669
  731    HA   ARG  91           HA       ARG  91  83.413   7.576  -5.290
  732    HB2  ARG  91           HB2      ARG  91  83.352  10.443  -4.306
  733    HB3  ARG  91           HB3      ARG  91  83.557   9.045  -3.251
  734    HG2  ARG  91           HG2      ARG  91  85.552   8.381  -4.621
  735    HG3  ARG  91           HG3      ARG  91  85.384   9.891  -5.513
  736    HD2  ARG  91           HD2      ARG  91  85.456  10.084  -2.538
  737    HD3  ARG  91           HD3      ARG  91  86.964   9.688  -3.353
  738    HE   ARG  91           HE       ARG  91  85.850  11.861  -4.710
  739   HH11  ARG  91          HH21      ARG  91  87.046  11.047  -1.567
  740   HH12  ARG  91          HH22      ARG  91  87.577  12.654  -1.201
  741   HH21  ARG  91          HH11      ARG  91  86.544  13.972  -4.238
  742   HH22  ARG  91          HH12      ARG  91  87.292  14.310  -2.713
  743    H    GLU  92           H        GLU  92  81.130  10.311  -5.328
  744    HA   GLU  92           HA       GLU  92  79.276   9.268  -3.492
  745    HB2  GLU  92           HB2      GLU  92  79.286  11.618  -4.322
  746    HB3  GLU  92           HB3      GLU  92  78.701  11.041  -5.882
  747    HG2  GLU  92           HG2      GLU  92  76.700  10.098  -4.789
  748    HG3  GLU  92           HG3      GLU  92  77.282  10.675  -3.227
  749    H    ASP  93           H        ASP  93  79.245   9.154  -7.068
  750    HA   ASP  93           HA       ASP  93  76.971   7.527  -7.331
  751    HB2  ASP  93           HB2      ASP  93  79.410   7.705  -9.119
  752    HB3  ASP  93           HB1      ASP  93  77.867   6.982  -9.572
  753    H    LEU  94           H        LEU  94  80.423   6.643  -7.252
  754    HA   LEU  94           HA       LEU  94  80.143   3.869  -7.453
  755    HB2  LEU  94           HB2      LEU  94  82.328   4.942  -7.615
  756    HB3  LEU  94           HB3      LEU  94  82.197   5.504  -5.952
  757    HG   LEU  94           HG       LEU  94  82.267   3.246  -5.104
  758   HD11  LEU  94          HD11      LEU  94  81.066   1.944  -6.637
  759   HD12  LEU  94          HD12      LEU  94  82.724   1.410  -6.902
  760   HD13  LEU  94          HD13      LEU  94  81.978   2.554  -8.017
  761   HD21  LEU  94          HD21      LEU  94  84.403   3.143  -7.202
  762   HD22  LEU  94          HD22      LEU  94  84.520   2.854  -5.469
  763   HD23  LEU  94          HD23      LEU  94  84.403   4.502  -6.079
  764    H    ILE  95           H        ILE  95  79.976   6.021  -4.683
  765    HA   ILE  95           HA       ILE  95  79.762   3.906  -2.770
  766    HB   ILE  95           HB       ILE  95  79.411   6.892  -2.623
  767   HG12  ILE  95          HG12      ILE  95  81.372   5.091  -1.195
  768   HG13  ILE  95          HG13      ILE  95  81.661   5.646  -2.841
  769   HG21  ILE  95          HG21      ILE  95  78.705   4.758  -0.640
  770   HG22  ILE  95          HG22      ILE  95  77.945   6.325  -0.914
  771   HG23  ILE  95          HG23      ILE  95  79.470   6.228  -0.035
  772   HD11  ILE  95          HD11      ILE  95  80.979   7.602  -0.660
  773   HD12  ILE  95          HD12      ILE  95  81.790   7.899  -2.197
  774   HD13  ILE  95          HD13      ILE  95  82.637   7.060  -0.903
  775    H    ALA  96           H        ALA  96  77.552   5.768  -4.695
  776    HA   ALA  96           HA       ALA  96  75.200   5.276  -3.171
  777    HB1  ALA  96           HB1      ALA  96  75.479   7.025  -4.979
  778    HB2  ALA  96           HB2      ALA  96  74.003   6.067  -5.087
  779    HB3  ALA  96           HB3      ALA  96  75.362   5.717  -6.156
  780    H    TYR  97           H        TYR  97  76.919   3.552  -5.707
  781    HA   TYR  97           HA       TYR  97  74.891   1.542  -6.061
  782    HB2  TYR  97           HB2      TYR  97  76.339   1.826  -7.919
  783    HB3  TYR  97           HB3      TYR  97  77.782   1.765  -6.906
  784    HD1  TYR  97           HD1      TYR  97  74.944  -0.264  -8.211
  785    HD2  TYR  97           HD2      TYR  97  78.799  -0.311  -6.318
  786    HE1  TYR  97           HE1      TYR  97  75.065  -2.720  -8.518
  787    HE2  TYR  97           HE2      TYR  97  78.920  -2.769  -6.628
  788    HH   TYR  97           HH       TYR  97  76.649  -4.485  -8.601
  789    H    LEU  98           H        LEU  98  77.772   1.977  -4.102
  790    HA   LEU  98           HA       LEU  98  78.091  -0.641  -3.145
  791    HB2  LEU  98           HB2      LEU  98  78.747   2.075  -2.042
  792    HB3  LEU  98           HB3      LEU  98  79.014   0.637  -1.065
  793    HG   LEU  98           HG       LEU  98  80.083   0.866  -3.885
  794   HD11  LEU  98          HD11      LEU  98  80.976   2.254  -1.470
  795   HD12  LEU  98          HD12      LEU  98  81.487   2.469  -3.142
  796   HD13  LEU  98          HD13      LEU  98  82.233   1.221  -2.151
  797   HD21  LEU  98          HD21      LEU  98  80.474  -0.951  -1.522
  798   HD22  LEU  98          HD22      LEU  98  81.803  -0.727  -2.658
  799   HD23  LEU  98          HD23      LEU  98  80.260  -1.361  -3.221
  800    H    LYS  99           H        LYS  99  76.197   2.092  -1.883
  801    HA   LYS  99           HA       LYS  99  75.200   0.861   0.423
  802    HB2  LYS  99           HB2      LYS  99  74.175   3.078  -1.333
  803    HB3  LYS  99           HB3      LYS  99  73.238   2.516   0.050
  804    HG2  LYS  99           HG2      LYS  99  75.383   2.847   1.434
  805    HG3  LYS  99           HG3      LYS  99  76.002   3.747   0.050
  806    HD2  LYS  99           HD2      LYS  99  73.303   4.424   1.215
  807    HD3  LYS  99           HD3      LYS  99  74.775   5.047   1.958
  808    HE2  LYS  99           HE2      LYS  99  74.304   5.339  -1.006
  809    HE3  LYS  99           HE3      LYS  99  73.631   6.498   0.139
  810    HZ1  LYS  99           HZ1      LYS  99  75.955   6.919  -0.844
  811    HZ2  LYS  99           HZ2      LYS  99  76.477   5.755   0.279
  812    HZ3  LYS  99           HZ3      LYS  99  75.713   7.174   0.815
  813    H    LYS 100           H        LYS 100  73.614   1.187  -2.763
  814    HA   LYS 100           HA       LYS 100  71.413  -0.483  -2.053
  815    HB2  LYS 100           HB2      LYS 100  72.443   0.312  -4.786
  816    HB3  LYS 100           HB3      LYS 100  70.866  -0.404  -4.450
  817    HG2  LYS 100           HG2      LYS 100  70.412   1.539  -2.899
  818    HG3  LYS 100           HG3      LYS 100  71.898   2.280  -3.496
  819    HD2  LYS 100           HD2      LYS 100  70.977   2.094  -5.827
  820    HD3  LYS 100           HD3      LYS 100  69.453   1.546  -5.129
  821    HE2  LYS 100           HE2      LYS 100  69.470   3.677  -3.733
  822    HE3  LYS 100           HE3      LYS 100  70.800   4.229  -4.752
  823    HZ1  LYS 100           HZ1      LYS 100  69.082   5.034  -5.955
  824    HZ2  LYS 100           HZ2      LYS 100  67.981   3.864  -5.403
  825    HZ3  LYS 100           HZ3      LYS 100  69.102   3.472  -6.617
  826    H    ALA 101           H        ALA 101  74.600  -1.118  -3.276
  827    HA   ALA 101           HA       ALA 101  73.940  -3.796  -4.201
  828    HB1  ALA 101           HB1      ALA 101  76.605  -2.391  -3.923
  829    HB2  ALA 101           HB2      ALA 101  75.638  -2.500  -5.395
  830    HB3  ALA 101           HB3      ALA 101  76.348  -3.955  -4.696
  831    H    THR 102           H        THR 102  75.076  -2.277  -1.305
  832    HA   THR 102           HA       THR 102  75.999  -4.839  -0.193
  833    HB   THR 102           HB       THR 102  76.735  -3.421   1.733
  834    HG1  THR 102           HG1      THR 102  75.308  -1.595   0.268
  835   HG21  THR 102          HG21      THR 102  77.666  -2.830  -1.075
  836   HG22  THR 102          HG22      THR 102  78.400  -3.895   0.121
  837   HG23  THR 102          HG23      THR 102  78.477  -2.147   0.334
  838    H    ASN 103           H        ASN 103  73.159  -3.373  -0.613
  839    HA   ASN 103           HA       ASN 103  72.089  -3.998   2.067
  840    HB2  ASN 103           HB2      ASN 103  71.129  -2.277  -0.207
  841    HB3  ASN 103           HB1      ASN 103  70.033  -2.799   1.067
  842   HD21  ASN 103          HD21      ASN 103  73.426  -2.216   1.796
  843   HD22  ASN 103          HD22      ASN 103  73.173  -0.796   2.687
  844    H    GLU 104           H        GLU 104  72.118  -4.995  -1.240
  845    HA   GLU 104           HA       GLU 104  70.389  -7.269  -0.566
  846    HB2  GLU 104           HB2      GLU 104  68.963  -6.985  -2.468
  847    HB3  GLU 104           HB3      GLU 104  68.976  -5.449  -1.604
  848    HG2  GLU 104           HG2      GLU 104  69.339  -4.717  -3.782
  849    HG3  GLU 104           HG3      GLU 104  70.997  -4.903  -3.216
  850    HHA  HEC 201           HA       HEC 105  89.234  -3.422   3.277
  851    HHB  HEC 201           HB       HEC 105  85.401  -0.027  -0.434
  852    HHC  HEC 201           HC       HEC 105  88.820  -1.729  -5.481
  853    HHD  HEC 201           HD       HEC 105  92.170  -5.679  -1.855
  854   HMA1  HEC 201          HMA1      HEC 105  85.595   0.848   2.414
  855   HMA2  HEC 201          HMA2      HEC 105  84.886  -0.536   3.244
  856   HMA3  HEC 201          HMA3      HEC 105  84.475  -0.214   1.563
  857   HAA1  HEC 201          HAA1      HEC 105  86.671  -0.945   4.521
  858   HAA2  HEC 201          HAA2      HEC 105  88.238  -1.729   4.507
  859   HBA1  HEC 201          HBA1      HEC 105  87.222  -3.911   4.433
  860   HBA2  HEC 201          HBA2      HEC 105  85.620  -3.210   4.222
  861   HMB1  HEC 201          HMB1      HEC 105  83.994  -0.005  -2.975
  862   HMB2  HEC 201          HMB2      HEC 105  84.792   1.239  -3.927
  863   HMB3  HEC 201          HMB3      HEC 105  84.842   1.313  -2.170
  864    HAB  HEC 201           HAB      HEC 105  87.316  -0.556  -6.171
  865   HBB1  HEC 201          HBB1      HEC 105  86.377   1.863  -6.524
  866   HBB2  HEC 201          HBB2      HEC 105  86.615   2.015  -4.785
  867   HBB3  HEC 201          HBB3      HEC 105  87.983   1.652  -5.830
  868   HMC1  HEC 201          HMC1      HEC 105  91.302  -2.452  -6.528
  869   HMC2  HEC 201          HMC2      HEC 105  89.818  -3.355  -6.815
  870   HMC3  HEC 201          HMC3      HEC 105  91.366  -4.195  -6.782
  871    HAC  HEC 201           HAC      HEC 105  92.626  -6.117  -3.784
  872   HBC1  HEC 201          HBC1      HEC 105  94.375  -5.343  -4.983
  873   HBC2  HEC 201          HBC2      HEC 105  93.441  -3.899  -5.371
  874   HBC3  HEC 201          HBC3      HEC 105  93.387  -5.299  -6.442
  875   HMD1  HEC 201          HMD1      HEC 105  93.108  -6.533   1.705
  876   HMD2  HEC 201          HMD2      HEC 105  93.444  -6.121   0.026
  877   HMD3  HEC 201          HMD3      HEC 105  92.264  -7.375   0.408
  878   HAD1  HEC 201          HAD1      HEC 105  91.602  -6.301   3.320
  879   HAD2  HEC 201          HAD2      HEC 105  90.339  -5.213   3.849
  880   HBD1  HEC 201          HBD1      HEC 105  92.614  -3.602   3.244
  881   HBD2  HEC 201          HBD2      HEC 105  93.178  -4.966   4.205
  882    H1   HOH 301           H2       HOH 200  83.202   2.077  -0.670
  883    H2   HOH 301           H1       HOH 200  82.318   3.273  -0.390
  884    H1   HOH 302           H2       HOH 201  85.066   5.290   6.987
  885    H2   HOH 302           H1       HOH 201  85.535   4.990   5.578
  886    H1   HOH 303           H2       HOH 202  82.001  -6.781   5.473
  887    H2   HOH 303           H1       HOH 202  81.495  -5.499   6.101
  888    H1   HOH 304           H2       HOH 203  81.625  -9.475  -0.065
  889    H2   HOH 304           H1       HOH 203  80.754 -10.699   0.131
  Start of MODEL   13
    1    H1   GLY   1           H1       GLY   1  72.895   8.687  -5.243
    2    H2   GLY   1           H2       GLY   1  72.499  10.230  -5.835
    3    H3   GLY   1           H3       GLY   1  73.721  10.051  -4.667
    4    HA2  GLY   1           HA2      GLY   1  74.588  10.441  -6.934
    5    HA3  GLY   1           HA3      GLY   1  75.144   8.936  -6.203
    6    H    ASP   2           H        ASP   2  75.454   8.587  -8.657
    7    HA   ASP   2           HA       ASP   2  72.974   7.673  -9.963
    8    HB2  ASP   2           HB2      ASP   2  75.765   8.154 -11.017
    9    HB3  ASP   2           HB1      ASP   2  74.458   7.461 -11.974
   10    H    VAL   3           H        VAL   3  72.717   5.790  -8.673
   11    HA   VAL   3           HA       VAL   3  74.538   3.802  -8.134
   12    HB   VAL   3           HB       VAL   3  72.292   3.690  -7.259
   13   HG11  VAL   3          HG11      VAL   3  71.094   4.733  -9.105
   14   HG12  VAL   3          HG12      VAL   3  70.385   3.151  -8.785
   15   HG13  VAL   3          HG13      VAL   3  71.467   3.369 -10.160
   16   HG21  VAL   3          HG21      VAL   3  72.543   1.386  -9.205
   17   HG22  VAL   3          HG22      VAL   3  71.839   1.368  -7.589
   18   HG23  VAL   3          HG23      VAL   3  73.579   1.543  -7.788
   19    H    GLU   4           H        GLU   4  73.317   4.794 -11.191
   20    HA   GLU   4           HA       GLU   4  73.768   2.323 -12.587
   21    HB2  GLU   4           HB2      GLU   4  73.517   5.154 -13.630
   22    HB3  GLU   4           HB3      GLU   4  73.488   3.695 -14.620
   23    HG2  GLU   4           HG2      GLU   4  71.526   2.896 -13.267
   24    HG3  GLU   4           HG3      GLU   4  71.505   4.464 -12.464
   25    H    LYS   5           H        LYS   5  75.491   5.457 -12.677
   26    HA   LYS   5           HA       LYS   5  77.751   4.337 -14.034
   27    HB2  LYS   5           HB2      LYS   5  77.285   6.966 -12.618
   28    HB3  LYS   5           HB3      LYS   5  78.818   6.558 -13.387
   29    HG2  LYS   5           HG2      LYS   5  77.736   6.288 -15.540
   30    HG3  LYS   5           HG3      LYS   5  76.145   6.501 -14.813
   31    HD2  LYS   5           HD2      LYS   5  78.315   8.613 -14.707
   32    HD3  LYS   5           HD3      LYS   5  77.077   8.564 -15.961
   33    HE2  LYS   5           HE2      LYS   5  75.428   8.438 -13.889
   34    HE3  LYS   5           HE3      LYS   5  76.788   9.172 -13.038
   35    HZ1  LYS   5           HZ1      LYS   5  75.130  10.729 -14.111
   36    HZ2  LYS   5           HZ2      LYS   5  75.783  10.247 -15.602
   37    HZ3  LYS   5           HZ3      LYS   5  76.768  11.014 -14.449
   38    H    GLY   6           H        GLY   6  76.714   4.464 -10.782
   39    HA2  GLY   6           HA2      GLY   6  79.279   4.307  -9.516
   40    HA3  GLY   6           HA3      GLY   6  77.729   3.884  -8.785
   41    H    LYS   7           H        LYS   7  76.904   2.039 -10.761
   42    HA   LYS   7           HA       LYS   7  78.139  -0.341  -9.817
   43    HB2  LYS   7           HB2      LYS   7  75.779  -0.217 -10.591
   44    HB3  LYS   7           HB3      LYS   7  76.356   0.053 -12.235
   45    HG2  LYS   7           HG2      LYS   7  77.591  -2.123 -12.108
   46    HG3  LYS   7           HG3      LYS   7  76.867  -2.399 -10.526
   47    HD2  LYS   7           HD2      LYS   7  75.335  -3.515 -11.861
   48    HD3  LYS   7           HD3      LYS   7  74.608  -1.908 -11.848
   49    HE2  LYS   7           HE2      LYS   7  76.087  -1.477 -13.952
   50    HE3  LYS   7           HE3      LYS   7  76.214  -3.235 -14.027
   51    HZ1  LYS   7           HZ1      LYS   7  73.782  -3.347 -14.001
   52    HZ2  LYS   7           HZ2      LYS   7  74.364  -2.484 -15.345
   53    HZ3  LYS   7           HZ3      LYS   7  73.701  -1.653 -14.019
   54    H    LYS   8           H        LYS   8  78.362   1.529 -12.832
   55    HA   LYS   8           HA       LYS   8  79.995  -0.243 -14.277
   56    HB2  LYS   8           HB2      LYS   8  78.928   1.640 -15.359
   57    HB3  LYS   8           HB3      LYS   8  79.831   2.776 -14.359
   58    HG2  LYS   8           HG2      LYS   8  81.525   0.839 -15.816
   59    HG3  LYS   8           HG3      LYS   8  80.621   1.933 -16.859
   60    HD2  LYS   8           HD2      LYS   8  82.149   2.990 -14.483
   61    HD3  LYS   8           HD3      LYS   8  82.963   2.692 -16.018
   62    HE2  LYS   8           HE2      LYS   8  81.807   4.374 -17.119
   63    HE3  LYS   8           HE3      LYS   8  80.404   4.253 -16.056
   64    HZ1  LYS   8           HZ1      LYS   8  83.029   5.222 -15.095
   65    HZ2  LYS   8           HZ2      LYS   8  81.509   5.393 -14.357
   66    HZ3  LYS   8           HZ3      LYS   8  81.875   6.267 -15.767
   67    H    ILE   9           H        ILE   9  80.881   2.469 -12.149
   68    HA   ILE   9           HA       ILE   9  83.685   2.164 -12.445
   69    HB   ILE   9           HB       ILE   9  82.092   3.400 -10.190
   70   HG12  ILE   9          HG12      ILE   9  83.486   4.784 -12.492
   71   HG13  ILE   9          HG13      ILE   9  81.793   4.295 -12.580
   72   HG21  ILE   9          HG21      ILE   9  84.244   4.677  -9.847
   73   HG22  ILE   9          HG22      ILE   9  85.015   3.555 -10.967
   74   HG23  ILE   9          HG23      ILE   9  84.345   2.963  -9.449
   75   HD11  ILE   9          HD11      ILE   9  82.140   6.674 -11.811
   76   HD12  ILE   9          HD12      ILE   9  82.920   6.030 -10.367
   77   HD13  ILE   9          HD13      ILE   9  81.221   5.677 -10.683
   78    H    PHE  10           H        PHE  10  81.327   0.494 -10.557
   79    HA   PHE  10           HA       PHE  10  83.213  -0.518  -8.612
   80    HB2  PHE  10           HB2      PHE  10  81.093  -0.389  -7.686
   81    HB3  PHE  10           HB1      PHE  10  80.298  -0.906  -9.172
   82    HD1  PHE  10           HD1      PHE  10  80.230  -3.275  -9.813
   83    HD2  PHE  10           HD2      PHE  10  82.031  -2.008  -6.131
   84    HE1  PHE  10           HE1      PHE  10  80.239  -5.621  -9.017
   85    HE2  PHE  10           HE2      PHE  10  82.044  -4.358  -5.331
   86    HZ   PHE  10           HZ       PHE  10  81.148  -6.164  -6.778
   87    H    VAL  11           H        VAL  11  81.327  -2.001 -11.268
   88    HA   VAL  11           HA       VAL  11  82.330  -4.586 -11.062
   89    HB   VAL  11           HB       VAL  11  81.733  -4.832 -13.459
   90   HG11  VAL  11          HG11      VAL  11  79.400  -4.530 -13.130
   91   HG12  VAL  11          HG12      VAL  11  79.653  -3.182 -12.024
   92   HG13  VAL  11          HG13      VAL  11  80.057  -4.822 -11.521
   93   HG21  VAL  11          HG21      VAL  11  82.485  -2.602 -14.203
   94   HG22  VAL  11          HG22      VAL  11  81.207  -1.856 -13.247
   95   HG23  VAL  11          HG23      VAL  11  80.795  -2.868 -14.629
   96    H    GLN  12           H        GLN  12  83.759  -1.745 -12.511
   97    HA   GLN  12           HA       GLN  12  85.920  -3.357 -13.669
   98    HB2  GLN  12           HB2      GLN  12  86.593  -1.358 -14.807
   99    HB3  GLN  12           HB1      GLN  12  84.844  -1.521 -14.966
  100    HG2  GLN  12           HG2      GLN  12  84.619   0.002 -12.951
  101    HG3  GLN  12           HG1      GLN  12  86.353   0.301 -13.077
  102   HE21  GLN  12          HE21      GLN  12  85.533  -0.199 -16.198
  103   HE22  GLN  12          HE22      GLN  12  85.141   1.382 -16.668
  104    H    LYS  13           H        LYS  13  85.353  -1.228 -10.943
  105    HA   LYS  13           HA       LYS  13  88.252  -1.073 -10.457
  106    HB2  LYS  13           HB2      LYS  13  86.655   0.957 -10.418
  107    HB3  LYS  13           HB3      LYS  13  86.189   0.366  -8.822
  108    HG2  LYS  13           HG2      LYS  13  88.451   0.532  -8.016
  109    HG3  LYS  13           HG3      LYS  13  89.069   0.845  -9.635
  110    HD2  LYS  13           HD2      LYS  13  86.984   2.695  -8.532
  111    HD3  LYS  13           HD3      LYS  13  88.638   2.847  -7.941
  112    HE2  LYS  13           HE2      LYS  13  89.457   3.099 -10.244
  113    HE3  LYS  13           HE3      LYS  13  87.818   2.903 -10.861
  114    HZ1  LYS  13           HZ1      LYS  13  88.627   5.253 -10.602
  115    HZ2  LYS  13           HZ2      LYS  13  88.552   5.017  -8.922
  116    HZ3  LYS  13           HZ3      LYS  13  87.142   4.903  -9.862
  117    H    CYS  14           H        CYS  14  85.410  -1.495  -8.286
  118    HA   CYS  14           HA       CYS  14  87.109  -2.760  -6.329
  119    HB2  CYS  14           HB2      CYS  14  84.137  -2.715  -6.097
  120    HB3  CYS  14           HB1      CYS  14  85.351  -2.549  -4.835
  121    H    ALA  15           H        ALA  15  84.622  -3.959  -8.552
  122    HA   ALA  15           HA       ALA  15  84.120  -6.435  -7.477
  123    HB1  ALA  15           HB1      ALA  15  84.137  -7.179 -10.011
  124    HB2  ALA  15           HB2      ALA  15  84.328  -5.449 -10.289
  125    HB3  ALA  15           HB3      ALA  15  82.920  -6.050  -9.415
  126    H    GLN  16           H        GLN  16  87.067  -5.286  -8.918
  127    HA   GLN  16           HA       GLN  16  88.394  -7.567  -9.669
  128    HB2  GLN  16           HB2      GLN  16  89.383  -5.093  -8.264
  129    HB3  GLN  16           HB1      GLN  16  90.480  -6.374  -8.779
  130    HG2  GLN  16           HG2      GLN  16  89.752  -6.136 -11.087
  131    HG3  GLN  16           HG1      GLN  16  88.525  -4.962 -10.615
  132   HE21  GLN  16          HE21      GLN  16  89.718  -3.482 -12.181
  133   HE22  GLN  16          HE22      GLN  16  91.091  -2.659 -11.618
  134    H    CYS  17           H        CYS  17  88.588  -6.173  -6.362
  135    HA   CYS  17           HA       CYS  17  89.024  -8.929  -5.362
  136    HB2  CYS  17           HB2      CYS  17  90.211  -6.732  -3.779
  137    HB3  CYS  17           HB1      CYS  17  90.866  -8.315  -4.178
  138    H    HIS  18           H        HSD  18  86.452  -8.102  -5.415
  139    HA   HIS  18           HA       HSD  18  85.829  -7.958  -2.582
  140    HB2  HIS  18           HB2      HSD  18  85.256  -5.675  -4.443
  141    HB3  HIS  18           HB1      HSD  18  84.155  -6.020  -3.113
  142    HD1  HIS  18           HD1      HSD  18  85.105  -5.784  -0.676
  143    HD2  HIS  18           HD2      HSD  18  87.746  -4.602  -3.670
  144    HE1  HIS  18           HE1      HSD  18  86.957  -4.491   0.473
  145    H    THR  19           H        THR  19  83.231  -7.613  -2.491
  146    HA   THR  19           HA       THR  19  81.963  -9.248  -4.584
  147    HB   THR  19           HB       THR  19  80.908 -10.100  -2.070
  148    HG1  THR  19           HG1      THR  19  83.205 -11.118  -1.665
  149   HG21  THR  19          HG21      THR  19  81.043 -11.357  -4.245
  150   HG22  THR  19          HG22      THR  19  81.592 -12.284  -2.849
  151   HG23  THR  19          HG23      THR  19  82.769 -11.572  -3.952
  152    H    VAL  20           H        VAL  20  81.618  -7.215  -1.719
  153    HA   VAL  20           HA       VAL  20  79.840  -5.971  -0.932
  154    HB   VAL  20           HB       VAL  20  79.203  -4.220  -2.444
  155   HG11  VAL  20          HG11      VAL  20  82.018  -5.178  -3.034
  156   HG12  VAL  20          HG12      VAL  20  81.531  -4.196  -1.654
  157   HG13  VAL  20          HG13      VAL  20  81.427  -3.537  -3.284
  158   HG21  VAL  20          HG21      VAL  20  78.663  -5.799  -4.354
  159   HG22  VAL  20          HG22      VAL  20  80.392  -5.867  -4.683
  160   HG23  VAL  20          HG23      VAL  20  79.529  -4.339  -4.820
  161    H    GLU  21           H        GLU  21  79.115  -8.709  -2.006
  162    HA   GLU  21           HA       GLU  21  76.259  -8.134  -2.551
  163    HB2  GLU  21           HB2      GLU  21  76.115 -10.087  -3.886
  164    HB3  GLU  21           HB3      GLU  21  77.594  -9.278  -4.400
  165    HG2  GLU  21           HG2      GLU  21  78.739 -10.789  -2.590
  166    HG3  GLU  21           HG3      GLU  21  77.278 -11.765  -2.743
  167    H    LYS  22           H        LYS  22  75.082  -8.461  -0.806
  168    HA   LYS  22           HA       LYS  22  75.766  -9.629   1.563
  169    HB2  LYS  22           HB2      LYS  22  73.576  -8.399   0.812
  170    HB3  LYS  22           HB3      LYS  22  72.977 -10.030   0.518
  171    HG2  LYS  22           HG2      LYS  22  72.357  -9.775   2.738
  172    HG3  LYS  22           HG3      LYS  22  73.965 -10.468   2.952
  173    HD2  LYS  22           HD2      LYS  22  74.907  -8.181   3.156
  174    HD3  LYS  22           HD3      LYS  22  73.283  -7.511   2.992
  175    HE2  LYS  22           HE2      LYS  22  74.022  -9.510   5.140
  176    HE3  LYS  22           HE3      LYS  22  74.119  -7.766   5.383
  177    HZ1  LYS  22           HZ1      LYS  22  71.662  -8.084   4.314
  178    HZ2  LYS  22           HZ2      LYS  22  71.990  -7.945   5.975
  179    HZ3  LYS  22           HZ3      LYS  22  71.807  -9.479   5.268
  180    H    GLY  23           H        GLY  23  75.656 -11.649   2.500
  181    HA2  GLY  23           HA2      GLY  23  75.868 -13.938   2.588
  182    HA3  GLY  23           HA3      GLY  23  74.510 -13.964   1.467
  183    H    GLY  24           H        GLY  24  77.521 -12.403   0.623
  184    HA2  GLY  24           HA2      GLY  24  77.848 -14.240  -1.616
  185    HA3  GLY  24           HA3      GLY  24  78.745 -12.751  -1.339
  186    H    LYS  25           H        LYS  25  80.777 -13.568  -1.585
  187    HA   LYS  25           HA       LYS  25  81.815 -15.111   0.657
  188    HB2  LYS  25           HB2      LYS  25  83.055 -16.615  -1.039
  189    HB3  LYS  25           HB3      LYS  25  81.361 -16.972  -0.706
  190    HG2  LYS  25           HG2      LYS  25  80.701 -15.683  -2.717
  191    HG3  LYS  25           HG3      LYS  25  82.402 -15.369  -3.061
  192    HD2  LYS  25           HD2      LYS  25  82.821 -17.787  -3.256
  193    HD3  LYS  25           HD3      LYS  25  81.127 -18.115  -2.890
  194    HE2  LYS  25           HE2      LYS  25  80.524 -16.688  -4.897
  195    HE3  LYS  25           HE3      LYS  25  82.238 -16.676  -5.311
  196    HZ1  LYS  25           HZ1      LYS  25  80.490 -18.556  -6.101
  197    HZ2  LYS  25           HZ2      LYS  25  81.167 -19.290  -4.726
  198    HZ3  LYS  25           HZ3      LYS  25  82.168 -18.785  -6.002
  199    H    HIS  26           H        HIS  26  83.530 -13.999   1.318
  200    HA   HIS  26           HA       HIS  26  84.759 -11.918  -0.052
  201    HB2  HIS  26           HB2      HIS  26  86.724 -12.446   1.571
  202    HB3  HIS  26           HB1      HIS  26  85.171 -11.958   2.247
  203    HD1  HIS  26           HD1      HIS  26  83.586 -13.972   3.083
  204    HD2  HIS  26           HD2      HIS  26  87.562 -14.989   2.348
  205    HE1  HIS  26           HE1      HIS  26  83.974 -16.207   4.209
  206    HE2  HIS  26           HE2      HIS  26  86.393 -16.841   3.771
  207    H    LYS  27           H        LYS  27  86.070 -11.845  -1.727
  208    HA   LYS  27           HA       LYS  27  87.786 -14.179  -2.333
  209    HB2  LYS  27           HB2      LYS  27  85.873 -14.147  -3.886
  210    HB3  LYS  27           HB3      LYS  27  86.262 -12.484  -4.330
  211    HG2  LYS  27           HG2      LYS  27  88.350 -13.133  -5.303
  212    HG3  LYS  27           HG3      LYS  27  88.242 -14.753  -4.615
  213    HD2  LYS  27           HD2      LYS  27  87.639 -14.818  -6.990
  214    HD3  LYS  27           HD3      LYS  27  86.225 -15.184  -6.001
  215    HE2  LYS  27           HE2      LYS  27  85.270 -13.058  -6.364
  216    HE3  LYS  27           HE3      LYS  27  86.802 -12.361  -6.891
  217    HZ1  LYS  27           HZ1      LYS  27  85.545 -14.570  -8.389
  218    HZ2  LYS  27           HZ2      LYS  27  86.684 -13.430  -8.927
  219    HZ3  LYS  27           HZ3      LYS  27  85.073 -12.963  -8.656
  220    H    THR  28           H        THR  28  89.676 -13.295  -1.585
  221    HA   THR  28           HA       THR  28  91.595 -12.031  -1.668
  222    HB   THR  28           HB       THR  28  90.565 -10.622  -4.115
  223    HG1  THR  28           HG1      THR  28  91.859 -13.073  -4.357
  224   HG21  THR  28          HG21      THR  28  92.781 -10.039  -3.160
  225   HG22  THR  28          HG22      THR  28  92.924 -10.758  -4.763
  226   HG23  THR  28          HG23      THR  28  93.277 -11.723  -3.330
  227    H    GLY  29           H        GLY  29  89.073 -11.145  -0.394
  228    HA2  GLY  29           HA2      GLY  29  89.837  -8.745   0.716
  229    HA3  GLY  29           HA3      GLY  29  88.842  -8.307  -0.669
  230    HA   PRO  30           HA       PRO  30  86.224  -9.713   3.066
  231    HB2  PRO  30           HB2      PRO  30  85.714  -7.359   4.326
  232    HB3  PRO  30           HB1      PRO  30  87.138  -8.350   4.701
  233    HG2  PRO  30           HG2      PRO  30  86.929  -5.908   3.002
  234    HG3  PRO  30           HG1      PRO  30  88.185  -6.369   4.163
  235    HD2  PRO  30           HD2      PRO  30  88.457  -6.687   1.443
  236    HD3  PRO  30           HD1      PRO  30  89.292  -7.704   2.637
  237    H    ASN  31           H        ASN  31  83.923  -9.039   3.503
  238    HA   ASN  31           HA       ASN  31  82.702  -8.016   1.026
  239    HB2  ASN  31           HB2      ASN  31  80.665  -9.059   1.796
  240    HB3  ASN  31           HB1      ASN  31  81.976 -10.227   1.954
  241   HD21  ASN  31          HD21      ASN  31  82.446 -11.019   4.051
  242   HD22  ASN  31          HD22      ASN  31  81.656 -10.481   5.454
  243    H    LEU  32           H        LEU  32  81.942  -6.026   0.947
  244    HA   LEU  32           HA       LEU  32  81.914  -4.348   3.288
  245    HB2  LEU  32           HB2      LEU  32  80.833  -3.604   0.575
  246    HB3  LEU  32           HB3      LEU  32  81.503  -2.547   1.815
  247    HG   LEU  32           HG       LEU  32  82.981  -4.522   0.061
  248   HD11  LEU  32          HD11      LEU  32  82.886  -2.464  -1.052
  249   HD12  LEU  32          HD12      LEU  32  84.402  -2.328  -0.168
  250   HD13  LEU  32          HD13      LEU  32  82.953  -1.534   0.443
  251   HD21  LEU  32          HD21      LEU  32  83.968  -4.896   2.181
  252   HD22  LEU  32          HD22      LEU  32  83.822  -3.202   2.641
  253   HD23  LEU  32          HD23      LEU  32  85.004  -3.684   1.430
  254    H    HIS  33           H        HIS  33  80.036  -6.560   3.359
  255    HA   HIS  33           HA       HIS  33  77.389  -5.757   2.792
  256    HB2  HIS  33           HB2      HIS  33  78.414  -7.610   4.958
  257    HB3  HIS  33           HB1      HIS  33  76.733  -7.481   4.443
  258    HD1  HIS  33           HD1      HIS  33  78.146 -10.169   4.108
  259    HD2  HIS  33           HD2      HIS  33  78.099  -7.247   1.136
  260    HE1  HIS  33           HE1      HIS  33  78.571 -11.368   1.920
  261    HE2  HIS  33           HE2      HIS  33  78.541  -9.602   0.097
  262    H    GLY  34           H        GLY  34  75.867  -4.632   3.985
  263    HA2  GLY  34           HA2      GLY  34  75.295  -2.805   5.333
  264    HA3  GLY  34           HA3      GLY  34  75.645  -3.994   6.585
  265    H    LEU  35           H        LEU  35  78.066  -2.747   4.409
  266    HA   LEU  35           HA       LEU  35  80.011  -2.186   6.262
  267    HB2  LEU  35           HB2      LEU  35  80.459  -2.240   3.883
  268    HB3  LEU  35           HB3      LEU  35  79.433  -0.835   3.617
  269    HG   LEU  35           HG       LEU  35  81.153   0.200   5.444
  270   HD11  LEU  35          HD11      LEU  35  82.939  -1.548   3.769
  271   HD12  LEU  35          HD12      LEU  35  82.369  -2.084   5.348
  272   HD13  LEU  35          HD13      LEU  35  83.349  -0.624   5.211
  273   HD21  LEU  35          HD21      LEU  35  80.577   1.070   3.164
  274   HD22  LEU  35          HD22      LEU  35  81.785  -0.025   2.491
  275   HD23  LEU  35          HD23      LEU  35  82.278   1.271   3.582
  276    H    PHE  36           H        PHE  36  77.868   0.255   4.787
  277    HA   PHE  36           HA       PHE  36  78.675   2.444   6.269
  278    HB2  PHE  36           HB2      PHE  36  75.822   1.931   5.412
  279    HB3  PHE  36           HB1      PHE  36  76.615   3.491   5.630
  280    HD1  PHE  36           HD2      PHE  36  76.586   0.399   3.557
  281    HD2  PHE  36           HD1      PHE  36  77.978   4.450   3.908
  282    HE1  PHE  36           HE2      PHE  36  77.391   0.327   1.216
  283    HE2  PHE  36           HE1      PHE  36  78.770   4.379   1.571
  284    HZ   PHE  36           HZ       PHE  36  78.483   2.319   0.220
  285    H    GLY  37           H        GLY  37  79.055   1.996   8.453
  286    HA2  GLY  37           HA2      GLY  37  77.562   2.702  10.443
  287    HA3  GLY  37           HA3      GLY  37  76.717   1.209  10.075
  288    H    ARG  38           H        ARG  38  79.320  -0.146   9.366
  289    HA   ARG  38           HA       ARG  38  79.970  -0.919  12.107
  290    HB2  ARG  38           HB2      ARG  38  80.277  -2.113   9.419
  291    HB3  ARG  38           HB3      ARG  38  81.561  -2.490  10.566
  292    HG2  ARG  38           HG2      ARG  38  79.691  -3.092  12.223
  293    HG3  ARG  38           HG3      ARG  38  78.601  -3.042  10.839
  294    HD2  ARG  38           HD2      ARG  38  81.085  -4.626  10.463
  295    HD3  ARG  38           HD3      ARG  38  79.929  -5.281  11.613
  296    HE   ARG  38           HE       ARG  38  78.245  -5.102   9.753
  297   HH11  ARG  38          HH21      ARG  38  81.657  -5.294   9.069
  298   HH12  ARG  38          HH22      ARG  38  81.427  -5.991   7.502
  299   HH21  ARG  38          HH11      ARG  38  77.971  -6.021   7.713
  300   HH22  ARG  38          HH12      ARG  38  79.352  -6.405   6.739
  301    H    LYS  39           H        LYS  39  82.020  -0.912  13.020
  302    HA   LYS  39           HA       LYS  39  83.670   1.318  12.384
  303    HB2  LYS  39           HB2      LYS  39  83.846  -0.959  14.329
  304    HB3  LYS  39           HB3      LYS  39  85.230   0.107  14.095
  305    HG2  LYS  39           HG2      LYS  39  82.534   1.347  14.537
  306    HG3  LYS  39           HG3      LYS  39  83.381   0.663  15.924
  307    HD2  LYS  39           HD2      LYS  39  85.367   2.050  15.383
  308    HD3  LYS  39           HD3      LYS  39  84.488   2.758  14.029
  309    HE2  LYS  39           HE2      LYS  39  84.024   4.349  15.638
  310    HE3  LYS  39           HE3      LYS  39  82.682   3.246  15.944
  311    HZ1  LYS  39           HZ1      LYS  39  84.848   3.931  17.635
  312    HZ2  LYS  39           HZ2      LYS  39  84.829   2.254  17.367
  313    HZ3  LYS  39           HZ3      LYS  39  83.456   3.032  17.994
  314    H    THR  40           H        THR  40  86.094   1.076  12.109
  315    HA   THR  40           HA       THR  40  86.634  -0.296   9.697
  316    HB   THR  40           HB       THR  40  89.044   0.323  10.240
  317    HG1  THR  40           HG1      THR  40  87.792   1.749  12.333
  318   HG21  THR  40          HG21      THR  40  88.560   2.775   9.996
  319   HG22  THR  40          HG22      THR  40  86.854   2.411  10.253
  320   HG23  THR  40          HG23      THR  40  87.692   1.759   8.845
  321    H    GLY  41           H        GLY  41  87.865  -2.095   9.244
  322    HA2  GLY  41           HA2      GLY  41  88.430  -4.306   9.561
  323    HA3  GLY  41           HA3      GLY  41  89.416  -3.656  10.868
  324    H    GLN  42           H        GLN  42  85.908  -4.014  10.411
  325    HA   GLN  42           HA       GLN  42  85.811  -5.480  12.985
  326    HB2  GLN  42           HB2      GLN  42  84.730  -3.133  12.807
  327    HB3  GLN  42           HB1      GLN  42  83.491  -3.939  11.844
  328    HG2  GLN  42           HG2      GLN  42  83.048  -5.506  13.675
  329    HG3  GLN  42           HG1      GLN  42  84.331  -4.775  14.636
  330   HE21  GLN  42          HE21      GLN  42  81.181  -4.006  13.097
  331   HE22  GLN  42          HE22      GLN  42  80.782  -2.766  14.185
  332    H    ALA  43           H        ALA  43  85.416  -5.765   9.670
  333    HA   ALA  43           HA       ALA  43  83.166  -7.567   9.684
  334    HB1  ALA  43           HB1      ALA  43  84.227  -8.029   7.287
  335    HB2  ALA  43           HB2      ALA  43  85.078  -6.527   7.648
  336    HB3  ALA  43           HB3      ALA  43  83.316  -6.558   7.625
  337    HA   PRO  44           HA       PRO  44  85.826 -11.012  10.826
  338    HB2  PRO  44           HB2      PRO  44  83.900 -12.891  11.109
  339    HB3  PRO  44           HB1      PRO  44  84.111 -11.579  12.286
  340    HG2  PRO  44           HG2      PRO  44  82.117 -11.842  10.086
  341    HG3  PRO  44           HG1      PRO  44  81.901 -11.235  11.737
  342    HD2  PRO  44           HD2      PRO  44  82.215  -9.605   9.524
  343    HD3  PRO  44           HD1      PRO  44  82.610  -9.115  11.187
  344    H    GLY  45           H        GLY  45  87.060 -11.812   9.195
  345    HA2  GLY  45           HA2      GLY  45  86.475 -13.981   7.650
  346    HA3  GLY  45           HA3      GLY  45  85.940 -12.623   6.664
  347    H    PHE  46           H        PHE  46  87.513 -11.001   6.066
  348    HA   PHE  46           HA       PHE  46  90.010 -12.143   5.282
  349    HB2  PHE  46           HB2      PHE  46  88.683 -10.344   4.053
  350    HB3  PHE  46           HB1      PHE  46  89.315  -9.207   5.244
  351    HD1  PHE  46           HD1      PHE  46  91.737  -8.746   5.391
  352    HD2  PHE  46           HD2      PHE  46  90.117 -11.331   2.368
  353    HE1  PHE  46           HE1      PHE  46  93.861  -8.591   4.122
  354    HE2  PHE  46           HE2      PHE  46  92.240 -11.178   1.098
  355    HZ   PHE  46           HZ       PHE  46  94.113  -9.807   1.974
  356    H    THR  47           H        THR  47  92.104 -11.580   5.934
  357    HA   THR  47           HA       THR  47  92.417 -11.081   8.732
  358    HB   THR  47           HB       THR  47  94.504 -11.136   6.543
  359    HG1  THR  47           HG1      THR  47  94.054 -13.223   8.329
  360   HG21  THR  47          HG21      THR  47  95.427 -10.106   8.498
  361   HG22  THR  47          HG22      THR  47  95.973 -11.783   8.512
  362   HG23  THR  47          HG23      THR  47  94.646 -11.279   9.559
  363    H    TYR  48           H        TYR  48  91.386  -9.015   8.947
  364    HA   TYR  48           HA       TYR  48  92.176  -6.683   7.586
  365    HB2  TYR  48           HB2      TYR  48  90.763  -7.264  10.154
  366    HB3  TYR  48           HB3      TYR  48  91.304  -5.615   9.852
  367    HD1  TYR  48           HD1      TYR  48  90.537  -4.401   7.821
  368    HD2  TYR  48           HD2      TYR  48  88.919  -8.214   8.941
  369    HE1  TYR  48           HE1      TYR  48  88.607  -4.012   6.331
  370    HE2  TYR  48           HE2      TYR  48  86.980  -7.828   7.442
  371    HH   TYR  48           HH       TYR  48  86.271  -4.778   6.124
  372    H    THR  49           H        THR  49  93.489  -4.944   8.242
  373    HA   THR  49           HA       THR  49  95.922  -5.783   9.598
  374    HB   THR  49           HB       THR  49  96.776  -3.578   8.890
  375    HG1  THR  49           HG1      THR  49  95.405  -2.076   8.444
  376   HG21  THR  49          HG21      THR  49  97.116  -5.185   7.224
  377   HG22  THR  49          HG22      THR  49  96.223  -3.936   6.355
  378   HG23  THR  49          HG23      THR  49  95.388  -5.381   6.923
  379    H    ASP  50           H        ASP  50  96.914  -4.426  11.271
  380    HA   ASP  50           HA       ASP  50  95.262  -4.068  13.500
  381    HB2  ASP  50           HB2      ASP  50  97.797  -2.495  13.206
  382    HB3  ASP  50           HB1      ASP  50  97.162  -3.335  14.620
  383    H    ALA  51           H        ALA  51  96.506  -1.691  11.176
  384    HA   ALA  51           HA       ALA  51  95.560   0.640  12.375
  385    HB1  ALA  51           HB1      ALA  51  95.888  -0.081   9.459
  386    HB2  ALA  51           HB2      ALA  51  97.023   0.796  10.484
  387    HB3  ALA  51           HB3      ALA  51  95.494   1.545  10.019
  388    H    ASN  52           H        ASN  52  93.897  -1.679  10.290
  389    HA   ASN  52           HA       ASN  52  91.456  -0.120  10.226
  390    HB2  ASN  52           HB2      ASN  52  92.513  -2.534   8.941
  391    HB3  ASN  52           HB1      ASN  52  90.816  -2.685   9.382
  392   HD21  ASN  52          HD21      ASN  52  90.195  -2.582   7.089
  393   HD22  ASN  52          HD22      ASN  52  90.234  -1.105   6.251
  394    H    LYS  53           H        LYS  53  92.828  -2.685  12.129
  395    HA   LYS  53           HA       LYS  53  90.310  -3.377  13.400
  396    HB2  LYS  53           HB2      LYS  53  91.554  -5.287  13.448
  397    HB3  LYS  53           HB3      LYS  53  93.076  -4.414  13.354
  398    HG2  LYS  53           HG2      LYS  53  92.958  -3.876  15.738
  399    HG3  LYS  53           HG3      LYS  53  91.374  -4.646  15.852
  400    HD2  LYS  53           HD2      LYS  53  92.565  -6.759  14.937
  401    HD3  LYS  53           HD3      LYS  53  94.060  -5.932  15.377
  402    HE2  LYS  53           HE2      LYS  53  93.069  -5.613  17.695
  403    HE3  LYS  53           HE3      LYS  53  91.778  -6.711  17.207
  404    HZ1  LYS  53           HZ1      LYS  53  93.437  -8.394  16.722
  405    HZ2  LYS  53           HZ2      LYS  53  93.555  -7.887  18.340
  406    HZ3  LYS  53           HZ3      LYS  53  94.680  -7.340  17.191
  407    H    ASN  54           H        ASN  54  92.634  -0.979  13.666
  408    HA   ASN  54           HA       ASN  54  92.761  -0.587  16.469
  409    HB2  ASN  54           HB2      ASN  54  93.891   1.355  15.961
  410    HB3  ASN  54           HB1      ASN  54  94.128   0.459  14.467
  411   HD21  ASN  54          HD21      ASN  54  91.463   0.832  13.381
  412   HD22  ASN  54          HD22      ASN  54  91.289   2.477  13.005
  413    H    LYS  55           H        LYS  55  90.332  -0.045  14.146
  414    HA   LYS  55           HA       LYS  55  88.231   0.906  14.238
  415    HB2  LYS  55           HB2      LYS  55  88.661   0.472  17.201
  416    HB3  LYS  55           HB3      LYS  55  87.115   0.870  16.452
  417    HG2  LYS  55           HG2      LYS  55  87.624  -1.218  14.935
  418    HG3  LYS  55           HG3      LYS  55  88.722  -1.663  16.241
  419    HD2  LYS  55           HD2      LYS  55  85.752  -1.109  16.505
  420    HD3  LYS  55           HD3      LYS  55  86.538  -2.683  16.637
  421    HE2  LYS  55           HE2      LYS  55  86.837  -0.317  18.500
  422    HE3  LYS  55           HE3      LYS  55  86.176  -1.906  18.880
  423    HZ1  LYS  55           HZ1      LYS  55  88.283  -2.168  19.644
  424    HZ2  LYS  55           HZ2      LYS  55  88.959  -1.084  18.525
  425    HZ3  LYS  55           HZ3      LYS  55  88.532  -2.654  18.038
  426    H    GLY  56           H        GLY  56  89.708   2.857  13.596
  427    HA2  GLY  56           HA2      GLY  56  89.813   4.955  15.619
  428    HA3  GLY  56           HA3      GLY  56  90.421   5.062  13.971
  429    H    ILE  57           H        ILE  57  88.092   4.257  12.597
  430    HA   ILE  57           HA       ILE  57  86.058   6.243  13.375
  431    HB   ILE  57           HB       ILE  57  85.934   7.126  11.119
  432   HG12  ILE  57          HG12      ILE  57  88.035   6.371   9.636
  433   HG13  ILE  57          HG13      ILE  57  87.874   4.896  10.584
  434   HG21  ILE  57          HG21      ILE  57  87.534   8.160  12.690
  435   HG22  ILE  57          HG22      ILE  57  88.118   8.261  11.028
  436   HG23  ILE  57          HG23      ILE  57  88.793   7.060  12.129
  437   HD11  ILE  57          HD11      ILE  57  86.556   5.169   8.313
  438   HD12  ILE  57          HD12      ILE  57  85.418   6.070   9.308
  439   HD13  ILE  57          HD13      ILE  57  85.784   4.388   9.686
  440    H    THR  58           H        THR  58  84.181   6.012  11.611
  441    HA   THR  58           HA       THR  58  83.656   3.114  11.317
  442    HB   THR  58           HB       THR  58  81.747   5.341  12.046
  443    HG1  THR  58           HG1      THR  58  81.955   4.563  13.979
  444   HG21  THR  58          HG21      THR  58  80.101   3.399  12.187
  445   HG22  THR  58          HG22      THR  58  81.278   2.457  11.276
  446   HG23  THR  58          HG23      THR  58  80.557   3.895  10.558
  447    H    TRP  59           H        TRP  59  82.798   2.384   9.427
  448    HA   TRP  59           HA       TRP  59  83.169   3.926   7.085
  449    HB2  TRP  59           HB2      TRP  59  81.343   1.534   7.270
  450    HB3  TRP  59           HB1      TRP  59  82.281   2.092   5.885
  451    HD1  TRP  59           HD1      TRP  59  85.078   2.487   7.233
  452    HE1  TRP  59           HE1      TRP  59  86.444   0.434   8.003
  453    HE3  TRP  59           HE3      TRP  59  81.348  -0.973   7.662
  454    HZ2  TRP  59           HZ2      TRP  59  86.003  -2.290   8.742
  455    HZ3  TRP  59           HZ3      TRP  59  81.851  -3.286   8.391
  456    HH2  TRP  59           HH2      TRP  59  84.173  -3.945   8.932
  457    H    LYS  60           H        LYS  60  81.811   5.158   5.908
  458    HA   LYS  60           HA       LYS  60  78.948   5.151   6.358
  459    HB2  LYS  60           HB2      LYS  60  80.660   7.529   7.121
  460    HB3  LYS  60           HB3      LYS  60  78.918   7.620   6.871
  461    HG2  LYS  60           HG2      LYS  60  78.733   5.715   8.587
  462    HG3  LYS  60           HG3      LYS  60  80.415   6.065   8.984
  463    HD2  LYS  60           HD2      LYS  60  78.287   8.214   8.971
  464    HD3  LYS  60           HD3      LYS  60  78.645   7.254  10.405
  465    HE2  LYS  60           HE2      LYS  60  81.047   7.950  10.202
  466    HE3  LYS  60           HE3      LYS  60  80.578   9.025   8.885
  467    HZ1  LYS  60           HZ1      LYS  60  80.202  10.508  10.484
  468    HZ2  LYS  60           HZ2      LYS  60  80.230   9.338  11.716
  469    HZ3  LYS  60           HZ3      LYS  60  78.801   9.619  10.840
  470    H    GLU  61           H        GLU  61  78.380   7.612   5.139
  471    HA   GLU  61           HA       GLU  61  78.950   6.951   2.397
  472    HB2  GLU  61           HB2      GLU  61  76.780   7.943   3.239
  473    HB3  GLU  61           HB3      GLU  61  77.644   9.468   3.443
  474    HG2  GLU  61           HG2      GLU  61  78.197   9.532   1.079
  475    HG3  GLU  61           HG3      GLU  61  77.501   7.931   0.835
  476    H    GLU  62           H        GLU  62  79.571   9.880   4.355
  477    HA   GLU  62           HA       GLU  62  81.355  10.997   2.434
  478    HB2  GLU  62           HB2      GLU  62  82.004  12.451   4.513
  479    HB3  GLU  62           HB3      GLU  62  80.399  12.616   3.806
  480    HG2  GLU  62           HG2      GLU  62  80.747  10.543   5.931
  481    HG3  GLU  62           HG3      GLU  62  80.754  12.229   6.439
  482    H    THR  63           H        THR  63  81.812   9.043   5.342
  483    HA   THR  63           HA       THR  63  84.604   9.334   5.573
  484    HB   THR  63           HB       THR  63  84.537   7.239   6.844
  485    HG1  THR  63           HG1      THR  63  82.422   6.821   5.249
  486   HG21  THR  63          HG21      THR  63  83.826   9.106   8.106
  487   HG22  THR  63          HG22      THR  63  82.591   7.878   8.387
  488   HG23  THR  63          HG23      THR  63  82.283   9.195   7.255
  489    H    LEU  64           H        LEU  64  82.587   7.232   3.604
  490    HA   LEU  64           HA       LEU  64  84.704   5.591   2.645
  491    HB2  LEU  64           HB2      LEU  64  81.851   5.918   2.125
  492    HB3  LEU  64           HB3      LEU  64  82.756   5.569   0.659
  493    HG   LEU  64           HG       LEU  64  83.131   3.956   3.190
  494   HD11  LEU  64          HD11      LEU  64  81.664   2.336   1.549
  495   HD12  LEU  64          HD12      LEU  64  80.932   3.902   1.212
  496   HD13  LEU  64          HD13      LEU  64  80.977   3.289   2.863
  497   HD21  LEU  64          HD21      LEU  64  83.804   2.250   1.366
  498   HD22  LEU  64          HD22      LEU  64  84.918   3.583   1.662
  499   HD23  LEU  64          HD23      LEU  64  83.841   3.627   0.266
  500    H    MET  65           H        MET  65  83.276   8.636   1.584
  501    HA   MET  65           HA       MET  65  84.406   8.796  -0.977
  502    HB2  MET  65           HB2      MET  65  83.815  11.007   1.000
  503    HB3  MET  65           HB1      MET  65  84.192  11.259  -0.704
  504    HG2  MET  65           HG2      MET  65  82.241  10.050  -1.399
  505    HG3  MET  65           HG1      MET  65  81.931   9.491   0.243
  506    HE1  MET  65           HE1      MET  65  80.290  13.049  -1.785
  507    HE2  MET  65           HE2      MET  65  80.203  11.315  -2.088
  508    HE3  MET  65           HE3      MET  65  81.717  12.175  -2.359
  509    H    GLU  66           H        GLU  66  85.671  10.223   2.047
  510    HA   GLU  66           HA       GLU  66  88.122  11.077   0.961
  511    HB2  GLU  66           HB2      GLU  66  87.450  10.266   3.801
  512    HB3  GLU  66           HB3      GLU  66  88.900  11.148   3.314
  513    HG2  GLU  66           HG2      GLU  66  86.081  12.113   2.764
  514    HG3  GLU  66           HG3      GLU  66  87.033  12.619   4.159
  515    H    TYR  67           H        TYR  67  87.017   7.993   2.134
  516    HA   TYR  67           HA       TYR  67  89.637   6.789   2.266
  517    HB2  TYR  67           HB2      TYR  67  87.935   5.907   3.709
  518    HB3  TYR  67           HB3      TYR  67  86.834   5.675   2.357
  519    HD1  TYR  67           HD1      TYR  67  89.867   4.416   4.032
  520    HD2  TYR  67           HD2      TYR  67  87.090   3.821   0.810
  521    HE1  TYR  67           HE1      TYR  67  90.762   2.129   3.684
  522    HE2  TYR  67           HE2      TYR  67  87.987   1.535   0.460
  523    HH   TYR  67           HH       TYR  67  89.512   0.046   1.071
  524    H    LEU  68           H        LEU  68  87.125   7.183  -0.119
  525    HA   LEU  68           HA       LEU  68  88.140   5.165  -1.908
  526    HB2  LEU  68           HB2      LEU  68  85.993   7.262  -2.050
  527    HB3  LEU  68           HB3      LEU  68  86.532   6.471  -3.525
  528    HG   LEU  68           HG       LEU  68  85.473   5.061  -1.055
  529   HD11  LEU  68          HD11      LEU  68  84.177   4.987  -3.759
  530   HD12  LEU  68          HD12      LEU  68  83.908   6.388  -2.725
  531   HD13  LEU  68          HD13      LEU  68  83.459   4.776  -2.163
  532   HD21  LEU  68          HD21      LEU  68  85.385   3.249  -3.083
  533   HD22  LEU  68          HD22      LEU  68  86.705   3.356  -1.921
  534   HD23  LEU  68          HD23      LEU  68  86.853   4.124  -3.501
  535    H    GLU  69           H        GLU  69  88.797   8.511  -1.299
  536    HA   GLU  69           HA       GLU  69  90.088   8.887  -3.897
  537    HB2  GLU  69           HB2      GLU  69  90.119  11.154  -3.428
  538    HB3  GLU  69           HB3      GLU  69  88.702  10.644  -2.520
  539    HG2  GLU  69           HG2      GLU  69  89.779  11.839  -0.868
  540    HG3  GLU  69           HG3      GLU  69  90.507  10.261  -0.593
  541    H    ASN  70           H        ASN  70  90.872   7.704  -0.856
  542    HA   ASN  70           HA       ASN  70  93.594   7.268  -1.513
  543    HB2  ASN  70           HB2      ASN  70  93.393   9.810  -0.830
  544    HB3  ASN  70           HB1      ASN  70  93.384   9.157   0.803
  545   HD21  ASN  70          HD21      ASN  70  95.184   6.985   0.509
  546   HD22  ASN  70          HD22      ASN  70  96.719   7.589   0.109
  547    HA   PRO  71           HA       PRO  71  91.277   4.545   1.563
  548    HB2  PRO  71           HB2      PRO  71  93.055   2.673   0.047
  549    HB3  PRO  71           HB1      PRO  71  91.378   2.453   0.576
  550    HG2  PRO  71           HG2      PRO  71  91.976   3.013  -1.959
  551    HG3  PRO  71           HG1      PRO  71  90.522   3.660  -1.181
  552    HD2  PRO  71           HD2      PRO  71  93.042   5.064  -1.916
  553    HD3  PRO  71           HD1      PRO  71  91.394   5.710  -1.761
  554    H    LYS  72           H        LYS  72  94.709   4.668   0.647
  555    HA   LYS  72           HA       LYS  72  95.599   3.387   3.064
  556    HB2  LYS  72           HB2      LYS  72  96.857   3.219   0.954
  557    HB3  LYS  72           HB3      LYS  72  97.152   4.953   0.995
  558    HG2  LYS  72           HG2      LYS  72  99.120   4.064   1.927
  559    HG3  LYS  72           HG3      LYS  72  98.181   4.512   3.345
  560    HD2  LYS  72           HD2      LYS  72  99.141   2.267   3.626
  561    HD3  LYS  72           HD3      LYS  72  97.385   2.175   3.555
  562    HE2  LYS  72           HE2      LYS  72  97.393   1.068   1.546
  563    HE3  LYS  72           HE3      LYS  72  98.805   1.943   0.950
  564    HZ1  LYS  72           HZ1      LYS  72 100.053   0.619   2.735
  565    HZ2  LYS  72           HZ2      LYS  72  99.597  -0.183   1.308
  566    HZ3  LYS  72           HZ3      LYS  72  98.699  -0.403   2.732
  567    H    LYS  73           H        LYS  73  95.729   6.736   1.845
  568    HA   LYS  73           HA       LYS  73  97.056   7.820   4.061
  569    HB2  LYS  73           HB2      LYS  73  96.756   8.977   1.877
  570    HB3  LYS  73           HB3      LYS  73  95.060   9.232   2.286
  571    HG2  LYS  73           HG2      LYS  73  95.598  10.638   4.122
  572    HG3  LYS  73           HG3      LYS  73  97.286  10.133   4.116
  573    HD2  LYS  73           HD2      LYS  73  97.135  12.343   3.114
  574    HD3  LYS  73           HD3      LYS  73  97.536  11.178   1.852
  575    HE2  LYS  73           HE2      LYS  73  95.308  11.170   1.009
  576    HE3  LYS  73           HE3      LYS  73  94.683  11.985   2.441
  577    HZ1  LYS  73           HZ1      LYS  73  95.776  13.976   1.838
  578    HZ2  LYS  73           HZ2      LYS  73  94.986  13.424   0.439
  579    HZ3  LYS  73           HZ3      LYS  73  96.663  13.215   0.610
  580    H    TYR  74           H        TYR  74  93.664   7.069   3.552
  581    HA   TYR  74           HA       TYR  74  92.636   8.624   5.693
  582    HB2  TYR  74           HB2      TYR  74  91.453   7.303   3.695
  583    HB3  TYR  74           HB3      TYR  74  91.295   6.064   4.939
  584    HD1  TYR  74           HD1      TYR  74  90.943   9.801   4.659
  585    HD2  TYR  74           HD2      TYR  74  89.333   6.127   6.202
  586    HE1  TYR  74           HE1      TYR  74  89.049  11.049   5.658
  587    HE2  TYR  74           HE2      TYR  74  87.440   7.378   7.201
  588    HH   TYR  74           HH       TYR  74  87.426  10.609   7.690
  589    H    ILE  75           H        ILE  75  93.274   5.115   5.497
  590    HA   ILE  75           HA       ILE  75  93.778   5.135   8.415
  591    HB   ILE  75           HB       ILE  75  92.412   2.922   6.861
  592   HG12  ILE  75          HG12      ILE  75  91.153   4.708   8.950
  593   HG13  ILE  75          HG13      ILE  75  91.131   5.146   7.243
  594   HG21  ILE  75          HG21      ILE  75  91.893   2.193   9.270
  595   HG22  ILE  75          HG22      ILE  75  93.136   3.340   9.769
  596   HG23  ILE  75          HG23      ILE  75  93.558   1.980   8.729
  597   HD11  ILE  75          HD11      ILE  75  90.137   2.485   8.293
  598   HD12  ILE  75          HD12      ILE  75  89.944   3.129   6.662
  599   HD13  ILE  75          HD13      ILE  75  89.089   3.876   8.011
  600    HA   PRO  76           HA       PRO  76  97.532   3.826   5.873
  601    HB2  PRO  76           HB2      PRO  76  98.565   4.642   8.572
  602    HB3  PRO  76           HB1      PRO  76  99.276   4.910   6.967
  603    HG2  PRO  76           HG2      PRO  76  97.984   6.853   8.259
  604    HG3  PRO  76           HG1      PRO  76  97.889   6.680   6.498
  605    HD2  PRO  76           HD2      PRO  76  95.809   6.132   8.544
  606    HD3  PRO  76           HD1      PRO  76  95.621   6.515   6.819
  607    H    GLY  77           H        GLY  77  98.093   1.734   5.815
  608    HA2  GLY  77           HA2      GLY  77  99.122  -0.146   7.046
  609    HA3  GLY  77           HA3      GLY  77  97.921   0.130   8.304
  610    H    THR  78           H        THR  78  95.794   0.683   6.339
  611    HA   THR  78           HA       THR  78  94.638  -1.845   6.128
  612    HB   THR  78           HB       THR  78  93.423   0.327   5.940
  613    HG1  THR  78           HG1      THR  78  92.500  -0.650   3.689
  614   HG21  THR  78          HG21      THR  78  95.169   1.267   4.331
  615   HG22  THR  78          HG22      THR  78  93.484   1.582   3.919
  616   HG23  THR  78          HG23      THR  78  94.376   0.316   3.076
  617    H    LYS  79           H        LYS  79  94.659  -3.444   4.613
  618    HA   LYS  79           HA       LYS  79  96.778  -3.322   2.618
  619    HB2  LYS  79           HB2      LYS  79  96.233  -5.344   4.105
  620    HB3  LYS  79           HB3      LYS  79  94.861  -5.610   3.033
  621    HG2  LYS  79           HG2      LYS  79  96.451  -6.887   1.938
  622    HG3  LYS  79           HG3      LYS  79  96.727  -5.335   1.146
  623    HD2  LYS  79           HD2      LYS  79  98.536  -4.836   2.753
  624    HD3  LYS  79           HD3      LYS  79  98.264  -6.391   3.540
  625    HE2  LYS  79           HE2      LYS  79  98.643  -7.420   1.195
  626    HE3  LYS  79           HE3      LYS  79  99.335  -5.853   0.773
  627    HZ1  LYS  79           HZ1      LYS  79 101.036  -7.372   1.547
  628    HZ2  LYS  79           HZ2      LYS  79 100.211  -7.595   3.014
  629    HZ3  LYS  79           HZ3      LYS  79 100.870  -6.077   2.630
  630    H    MET  80           H        MET  80  96.035  -1.859   1.079
  631    HA   MET  80           HA       MET  80  94.499  -2.911  -1.037
  632    HB2  MET  80           HB2      MET  80  92.546  -2.539   0.348
  633    HB3  MET  80           HB1      MET  80  93.063  -0.890   0.704
  634    HG2  MET  80           HG2      MET  80  92.739  -0.200  -1.570
  635    HG3  MET  80           HG1      MET  80  92.545  -1.864  -2.115
  636    HE1  MET  80           HE1      MET  80  90.355  -0.262  -3.263
  637    HE2  MET  80           HE2      MET  80  90.870   1.018  -2.169
  638    HE3  MET  80           HE3      MET  80  89.186   0.507  -2.182
  639    H    ILE  81           H        ILE  81  96.023  -2.147  -2.414
  640    HA   ILE  81           HA       ILE  81  96.225   0.786  -2.680
  641    HB   ILE  81           HB       ILE  81  98.538  -1.167  -2.825
  642   HG12  ILE  81          HG12      ILE  81  99.277   0.570  -0.938
  643   HG13  ILE  81          HG13      ILE  81  97.536   0.763  -0.751
  644   HG21  ILE  81          HG21      ILE  81  98.941   0.533  -4.436
  645   HG22  ILE  81          HG22      ILE  81  99.823   1.053  -3.001
  646   HG23  ILE  81          HG23      ILE  81  98.270   1.789  -3.397
  647   HD11  ILE  81          HD11      ILE  81  97.780  -1.017   0.668
  648   HD12  ILE  81          HD12      ILE  81  99.264  -1.564  -0.109
  649   HD13  ILE  81          HD13      ILE  81  97.700  -1.951  -0.825
  650    H    PHE  82           H        PHE  82  94.701   0.558  -4.398
  651    HA   PHE  82           HA       PHE  82  95.791  -0.724  -6.837
  652    HB2  PHE  82           HB2      PHE  82  93.693  -1.742  -6.133
  653    HB3  PHE  82           HB1      PHE  82  92.918  -0.160  -6.065
  654    HD1  PHE  82           HD2      PHE  82  94.807  -2.378  -8.424
  655    HD2  PHE  82           HD1      PHE  82  91.799   0.654  -7.960
  656    HE1  PHE  82           HE2      PHE  82  94.267  -2.543 -10.839
  657    HE2  PHE  82           HE1      PHE  82  91.260   0.487 -10.373
  658    HZ   PHE  82           HZ       PHE  82  92.493  -1.111 -11.813
  659    H    ALA  83           H        ALA  83  93.290   1.743  -6.267
  660    HA   ALA  83           HA       ALA  83  94.805   3.922  -7.277
  661    HB1  ALA  83           HB1      ALA  83  92.741   2.880  -9.220
  662    HB2  ALA  83           HB2      ALA  83  94.459   2.512  -9.368
  663    HB3  ALA  83           HB3      ALA  83  93.903   4.183  -9.467
  664    H    GLY  84           H        GLY  84  93.937   5.469  -6.062
  665    HA2  GLY  84           HA2      GLY  84  91.333   5.402  -4.961
  666    HA3  GLY  84           HA3      GLY  84  92.395   6.806  -4.998
  667    H    ILE  85           H        ILE  85  89.783   7.310  -5.279
  668    HA   ILE  85           HA       ILE  85  89.022   7.364  -8.085
  669    HB   ILE  85           HB       ILE  85  87.724   8.425  -5.571
  670   HG12  ILE  85          HG12      ILE  85  87.865   5.875  -6.226
  671   HG13  ILE  85          HG13      ILE  85  86.337   6.549  -5.674
  672   HG21  ILE  85          HG21      ILE  85  85.717   8.686  -7.159
  673   HG22  ILE  85          HG22      ILE  85  86.896   8.621  -8.467
  674   HG23  ILE  85          HG23      ILE  85  86.983   9.908  -7.265
  675   HD11  ILE  85          HD11      ILE  85  86.961   6.579  -8.610
  676   HD12  ILE  85          HD12      ILE  85  85.395   6.536  -7.799
  677   HD13  ILE  85          HD13      ILE  85  86.398   5.087  -7.857
  678    H    LYS  86           H        LYS  86  88.456   9.389  -9.172
  679    HA   LYS  86           HA       LYS  86  90.433  11.474  -8.566
  680    HB2  LYS  86           HB2      LYS  86  88.763  10.911 -11.022
  681    HB3  LYS  86           HB3      LYS  86  89.854  12.287 -10.862
  682    HG2  LYS  86           HG2      LYS  86  91.739  10.736 -10.451
  683    HG3  LYS  86           HG3      LYS  86  90.644   9.366 -10.649
  684    HD2  LYS  86           HD2      LYS  86  90.089  10.284 -12.952
  685    HD3  LYS  86           HD3      LYS  86  91.429  11.413 -12.737
  686    HE2  LYS  86           HE2      LYS  86  91.530   8.398 -12.886
  687    HE3  LYS  86           HE3      LYS  86  92.385   9.572 -13.888
  688    HZ1  LYS  86           HZ1      LYS  86  93.842   8.583 -12.229
  689    HZ2  LYS  86           HZ2      LYS  86  92.828   9.137 -10.983
  690    HZ3  LYS  86           HZ3      LYS  86  93.662  10.248 -11.959
  691    H    LYS  87           H        LYS  87  87.147  11.610  -9.968
  692    HA   LYS  87           HA       LYS  87  86.722  14.191  -8.696
  693    HB2  LYS  87           HB2      LYS  87  84.987  12.539 -10.542
  694    HB3  LYS  87           HB3      LYS  87  84.581  14.155  -9.964
  695    HG2  LYS  87           HG2      LYS  87  86.804  14.933 -10.916
  696    HG3  LYS  87           HG3      LYS  87  86.929  13.356 -11.697
  697    HD2  LYS  87           HD2      LYS  87  84.800  13.749 -12.865
  698    HD3  LYS  87           HD3      LYS  87  84.643  15.315 -12.067
  699    HE2  LYS  87           HE2      LYS  87  86.800  16.017 -13.109
  700    HE3  LYS  87           HE3      LYS  87  86.844  14.486 -13.981
  701    HZ1  LYS  87           HZ1      LYS  87  85.699  16.721 -14.910
  702    HZ2  LYS  87           HZ2      LYS  87  84.360  15.946 -14.207
  703    HZ3  LYS  87           HZ3      LYS  87  85.270  15.156 -15.403
  704    H    LYS  88           H        LYS  88  84.692  14.661  -7.556
  705    HA   LYS  88           HA       LYS  88  84.311  12.867  -5.372
  706    HB2  LYS  88           HB2      LYS  88  84.069  15.388  -5.294
  707    HB3  LYS  88           HB3      LYS  88  82.527  15.185  -6.127
  708    HG2  LYS  88           HG2      LYS  88  81.822  13.611  -4.292
  709    HG3  LYS  88           HG3      LYS  88  83.302  14.033  -3.433
  710    HD2  LYS  88           HD2      LYS  88  81.849  15.575  -2.494
  711    HD3  LYS  88           HD3      LYS  88  82.441  16.516  -3.862
  712    HE2  LYS  88           HE2      LYS  88  80.485  15.786  -5.198
  713    HE3  LYS  88           HE3      LYS  88  79.887  14.882  -3.807
  714    HZ1  LYS  88           HZ1      LYS  88  78.845  16.763  -3.280
  715    HZ2  LYS  88           HZ2      LYS  88  79.782  17.702  -4.342
  716    HZ3  LYS  88           HZ3      LYS  88  80.361  17.342  -2.786
  717    H    THR  89           H        THR  89  82.194  13.874  -8.071
  718    HA   THR  89           HA       THR  89  79.963  12.354  -7.457
  719    HB   THR  89           HB       THR  89  79.523  12.292  -9.908
  720    HG1  THR  89           HG1      THR  89  81.048  12.889 -11.285
  721   HG21  THR  89          HG21      THR  89  79.274  14.684 -10.139
  722   HG22  THR  89          HG22      THR  89  80.550  14.978  -8.957
  723   HG23  THR  89          HG23      THR  89  79.016  14.278  -8.441
  724    H    GLU  90           H        GLU  90  83.050  11.332  -8.741
  725    HA   GLU  90           HA       GLU  90  82.228   8.758  -9.637
  726    HB2  GLU  90           HB2      GLU  90  84.879   9.961  -8.867
  727    HB3  GLU  90           HB3      GLU  90  84.742   8.242  -9.226
  728    HG2  GLU  90           HG2      GLU  90  83.757   8.792 -11.426
  729    HG3  GLU  90           HG3      GLU  90  83.935  10.509 -11.068
  730    H    ARG  91           H        ARG  91  83.288  10.097  -6.567
  731    HA   ARG  91           HA       ARG  91  83.380   7.552  -5.205
  732    HB2  ARG  91           HB2      ARG  91  83.226  10.342  -4.033
  733    HB3  ARG  91           HB3      ARG  91  83.721   8.873  -3.193
  734    HG2  ARG  91           HG2      ARG  91  85.595   8.634  -4.834
  735    HG3  ARG  91           HG3      ARG  91  85.147  10.199  -5.513
  736    HD2  ARG  91           HD2      ARG  91  85.315  10.536  -2.690
  737    HD3  ARG  91           HD3      ARG  91  86.755   9.656  -3.192
  738    HE   ARG  91           HE       ARG  91  86.546  11.690  -5.017
  739   HH11  ARG  91          HH21      ARG  91  86.621  11.442  -1.565
  740   HH12  ARG  91          HH22      ARG  91  87.365  12.989  -1.333
  741   HH21  ARG  91          HH11      ARG  91  87.521  13.719  -4.719
  742   HH22  ARG  91          HH12      ARG  91  87.875  14.277  -3.118
  743    H    GLU  92           H        GLU  92  81.134  10.316  -5.316
  744    HA   GLU  92           HA       GLU  92  79.252   9.308  -3.477
  745    HB2  GLU  92           HB2      GLU  92  79.328  11.658  -4.379
  746    HB3  GLU  92           HB3      GLU  92  78.654  11.041  -5.888
  747    HG2  GLU  92           HG2      GLU  92  76.718  10.128  -4.606
  748    HG3  GLU  92           HG3      GLU  92  77.372  10.870  -3.147
  749    H    ASP  93           H        ASP  93  79.263   9.167  -7.051
  750    HA   ASP  93           HA       ASP  93  76.984   7.541  -7.318
  751    HB2  ASP  93           HB2      ASP  93  79.419   7.638  -9.117
  752    HB3  ASP  93           HB1      ASP  93  77.819   7.042  -9.560
  753    H    LEU  94           H        LEU  94  80.439   6.663  -7.254
  754    HA   LEU  94           HA       LEU  94  80.169   3.890  -7.437
  755    HB2  LEU  94           HB2      LEU  94  82.353   4.962  -7.589
  756    HB3  LEU  94           HB3      LEU  94  82.215   5.523  -5.926
  757    HG   LEU  94           HG       LEU  94  82.264   3.255  -5.081
  758   HD11  LEU  94          HD11      LEU  94  82.762   1.438  -6.894
  759   HD12  LEU  94          HD12      LEU  94  82.018   2.587  -8.004
  760   HD13  LEU  94          HD13      LEU  94  81.097   1.954  -6.640
  761   HD21  LEU  94          HD21      LEU  94  84.413   4.526  -6.032
  762   HD22  LEU  94          HD22      LEU  94  84.437   3.151  -7.137
  763   HD23  LEU  94          HD23      LEU  94  84.521   2.886  -5.397
  764    H    ILE  95           H        ILE  95  79.949   6.050  -4.673
  765    HA   ILE  95           HA       ILE  95  79.752   3.924  -2.773
  766    HB   ILE  95           HB       ILE  95  79.417   6.901  -2.607
  767   HG12  ILE  95          HG12      ILE  95  81.307   4.981  -1.222
  768   HG13  ILE  95          HG13      ILE  95  81.658   5.736  -2.772
  769   HG21  ILE  95          HG21      ILE  95  78.620   4.780  -0.644
  770   HG22  ILE  95          HG22      ILE  95  77.876   6.347  -0.956
  771   HG23  ILE  95          HG23      ILE  95  79.371   6.251  -0.026
  772   HD11  ILE  95          HD11      ILE  95  82.692   7.065  -1.043
  773   HD12  ILE  95          HD12      ILE  95  81.184   7.134  -0.135
  774   HD13  ILE  95          HD13      ILE  95  81.321   7.968  -1.682
  775    H    ALA  96           H        ALA  96  77.514   5.791  -4.669
  776    HA   ALA  96           HA       ALA  96  75.167   5.223  -3.177
  777    HB1  ALA  96           HB1      ALA  96  73.970   6.013  -5.063
  778    HB2  ALA  96           HB2      ALA  96  75.273   5.582  -6.172
  779    HB3  ALA  96           HB3      ALA  96  75.472   6.937  -5.060
  780    H    TYR  97           H        TYR  97  76.980   3.516  -5.654
  781    HA   TYR  97           HA       TYR  97  75.029   1.433  -6.007
  782    HB2  TYR  97           HB2      TYR  97  76.524   1.844  -7.842
  783    HB3  TYR  97           HB3      TYR  97  77.938   1.671  -6.802
  784    HD1  TYR  97           HD1      TYR  97  75.027  -0.175  -8.223
  785    HD2  TYR  97           HD2      TYR  97  78.877  -0.467  -6.343
  786    HE1  TYR  97           HE1      TYR  97  75.049  -2.616  -8.651
  787    HE2  TYR  97           HE2      TYR  97  78.900  -2.909  -6.772
  788    HH   TYR  97           HH       TYR  97  77.029  -4.413  -8.928
  789    H    LEU  98           H        LEU  98  78.096   1.793  -4.239
  790    HA   LEU  98           HA       LEU  98  78.308  -0.793  -3.220
  791    HB2  LEU  98           HB2      LEU  98  79.211   1.898  -2.241
  792    HB3  LEU  98           HB3      LEU  98  79.458   0.474  -1.237
  793    HG   LEU  98           HG       LEU  98  80.301   0.423  -4.130
  794   HD11  LEU  98          HD11      LEU  98  81.284   2.470  -2.978
  795   HD12  LEU  98          HD12      LEU  98  82.452   1.320  -3.610
  796   HD13  LEU  98          HD13      LEU  98  82.098   1.356  -1.884
  797   HD21  LEU  98          HD21      LEU  98  81.908  -1.215  -3.258
  798   HD22  LEU  98          HD22      LEU  98  80.278  -1.651  -2.746
  799   HD23  LEU  98          HD23      LEU  98  81.379  -0.876  -1.611
  800    H    LYS  99           H        LYS  99  76.126   1.771  -2.422
  801    HA   LYS  99           HA       LYS  99  75.392   0.747   0.174
  802    HB2  LYS  99           HB2      LYS  99  74.296   2.887  -1.636
  803    HB3  LYS  99           HB3      LYS  99  73.426   2.386  -0.187
  804    HG2  LYS  99           HG2      LYS  99  75.354   2.926   1.209
  805    HG3  LYS  99           HG3      LYS  99  76.311   3.315  -0.220
  806    HD2  LYS  99           HD2      LYS  99  75.489   5.386   0.760
  807    HD3  LYS  99           HD3      LYS  99  74.673   5.117  -0.780
  808    HE2  LYS  99           HE2      LYS  99  72.653   4.518   0.245
  809    HE3  LYS  99           HE3      LYS  99  73.436   4.106   1.772
  810    HZ1  LYS  99           HZ1      LYS  99  74.053   6.569   1.835
  811    HZ2  LYS  99           HZ2      LYS  99  72.445   6.144   2.183
  812    HZ3  LYS  99           HZ3      LYS  99  72.850   6.776   0.658
  813    H    LYS 100           H        LYS 100  73.741   0.907  -2.993
  814    HA   LYS 100           HA       LYS 100  71.586  -0.782  -2.127
  815    HB2  LYS 100           HB2      LYS 100  71.560   0.974  -4.010
  816    HB3  LYS 100           HB3      LYS 100  72.337  -0.261  -4.999
  817    HG2  LYS 100           HG2      LYS 100  70.383  -1.795  -4.133
  818    HG3  LYS 100           HG3      LYS 100  69.584  -0.264  -3.783
  819    HD2  LYS 100           HD2      LYS 100  68.868  -0.648  -5.966
  820    HD3  LYS 100           HD3      LYS 100  70.300   0.338  -6.251
  821    HE2  LYS 100           HE2      LYS 100  70.685  -1.435  -7.714
  822    HE3  LYS 100           HE3      LYS 100  71.533  -2.002  -6.277
  823    HZ1  LYS 100           HZ1      LYS 100  68.727  -2.681  -6.969
  824    HZ2  LYS 100           HZ2      LYS 100  69.615  -3.283  -5.651
  825    HZ3  LYS 100           HZ3      LYS 100  70.063  -3.692  -7.238
  826    H    ALA 101           H        ALA 101  74.758  -1.337  -3.277
  827    HA   ALA 101           HA       ALA 101  74.212  -4.010  -4.295
  828    HB1  ALA 101           HB1      ALA 101  76.581  -4.100  -4.775
  829    HB2  ALA 101           HB2      ALA 101  76.876  -2.661  -3.799
  830    HB3  ALA 101           HB3      ALA 101  75.963  -2.536  -5.303
  831    H    THR 102           H        THR 102  75.380  -2.467  -1.381
  832    HA   THR 102           HA       THR 102  76.170  -5.036  -0.213
  833    HB   THR 102           HB       THR 102  76.855  -3.642   1.730
  834    HG1  THR 102           HG1      THR 102  75.269  -1.894   0.497
  835   HG21  THR 102          HG21      THR 102  77.824  -2.992  -1.046
  836   HG22  THR 102          HG22      THR 102  78.590  -3.999   0.183
  837   HG23  THR 102          HG23      THR 102  78.566  -2.245   0.369
  838    H    ASN 103           H        ASN 103  73.426  -3.204  -0.599
  839    HA   ASN 103           HA       ASN 103  72.183  -4.133   1.911
  840    HB2  ASN 103           HB2      ASN 103  71.487  -1.991  -0.090
  841    HB3  ASN 103           HB1      ASN 103  70.309  -2.577   1.077
  842   HD21  ASN 103          HD21      ASN 103  73.736  -2.439   1.894
  843   HD22  ASN 103          HD22      ASN 103  73.599  -1.158   2.996
  844    H    GLU 104           H        GLU 104  72.269  -4.569  -1.510
  845    HA   GLU 104           HA       GLU 104  70.851  -5.706  -2.978
  846    HB2  GLU 104           HB2      GLU 104  71.603  -7.580  -0.746
  847    HB3  GLU 104           HB3      GLU 104  70.648  -8.144  -2.118
  848    HG2  GLU 104           HG2      GLU 104  73.202  -6.600  -2.551
  849    HG3  GLU 104           HG3      GLU 104  73.240  -8.337  -2.261
  850    HHA  HEC 201           HA       HEC 105  89.430  -3.539   3.121
  851    HHB  HEC 201           HB       HEC 105  85.574  -0.091  -0.509
  852    HHC  HEC 201           HC       HEC 105  88.890  -1.792  -5.621
  853    HHD  HEC 201           HD       HEC 105  92.307  -5.750  -2.060
  854   HMA1  HEC 201          HMA1      HEC 105  85.784   0.779   2.257
  855   HMA2  HEC 201          HMA2      HEC 105  85.153  -0.575   3.193
  856   HMA3  HEC 201          HMA3      HEC 105  84.646  -0.349   1.522
  857   HAA1  HEC 201          HAA1      HEC 105  87.057  -0.940   4.407
  858   HAA2  HEC 201          HAA2      HEC 105  88.466  -1.981   4.369
  859   HBA1  HEC 201          HBA1      HEC 105  87.224  -3.909   4.643
  860   HBA2  HEC 201          HBA2      HEC 105  85.782  -3.218   3.911
  861   HMB1  HEC 201          HMB1      HEC 105  85.010   1.269  -2.230
  862   HMB2  HEC 201          HMB2      HEC 105  84.127  -0.055  -2.985
  863   HMB3  HEC 201          HMB3      HEC 105  84.898   1.171  -3.984
  864    HAB  HEC 201           HAB      HEC 105  87.381  -0.597  -6.276
  865   HBB1  HEC 201          HBB1      HEC 105  87.961   1.626  -6.069
  866   HBB2  HEC 201          HBB2      HEC 105  86.267   1.824  -6.508
  867   HBB3  HEC 201          HBB3      HEC 105  86.761   1.937  -4.820
  868   HMC1  HEC 201          HMC1      HEC 105  89.854  -3.296  -6.957
  869   HMC2  HEC 201          HMC2      HEC 105  91.262  -4.350  -6.999
  870   HMC3  HEC 201          HMC3      HEC 105  91.465  -2.620  -6.736
  871    HAC  HEC 201           HAC      HEC 105  92.752  -6.171  -3.987
  872   HBC1  HEC 201          HBC1      HEC 105  93.293  -4.040  -5.980
  873   HBC2  HEC 201          HBC2      HEC 105  93.748  -5.671  -6.469
  874   HBC3  HEC 201          HBC3      HEC 105  94.418  -4.973  -4.995
  875   HMD1  HEC 201          HMD1      HEC 105  92.437  -7.482   0.397
  876   HMD2  HEC 201          HMD2      HEC 105  93.431  -6.463   1.435
  877   HMD3  HEC 201          HMD3      HEC 105  93.521  -6.285  -0.312
  878   HAD1  HEC 201          HAD1      HEC 105  92.076  -6.243   3.111
  879   HAD2  HEC 201          HAD2      HEC 105  90.508  -5.617   3.583
  880   HBD1  HEC 201          HBD1      HEC 105  91.657  -3.305   3.636
  881   HBD2  HEC 201          HBD2      HEC 105  93.167  -4.208   3.611
  882    H1   HOH 301           H2       HOH 200  79.841   3.237  -0.910
  883    H2   HOH 301           H1       HOH 200  80.503   2.064  -0.224
  884    H1   HOH 302           H2       HOH 201  86.219   4.805   5.975
  885    H2   HOH 302           H1       HOH 201  85.827   6.093   5.282
  886    H1   HOH 303           H2       HOH 202  82.939  -4.783   5.961
  887    H2   HOH 303           H1       HOH 202  84.134  -5.660   5.654
  888    H1   HOH 304           H2       HOH 203  84.524 -10.138   0.921
  889    H2   HOH 304           H1       HOH 203  83.976  -9.143  -0.078
  Start of MODEL   14
    1    H1   GLY   1           H1       GLY   1  75.184   9.315  -5.288
    2    H2   GLY   1           H2       GLY   1  76.062   9.744  -6.677
    3    H3   GLY   1           H3       GLY   1  75.169   8.298  -6.646
    4    HA2  GLY   1           HA2      GLY   1  73.238  10.047  -6.095
    5    HA3  GLY   1           HA3      GLY   1  74.287  11.018  -7.130
    6    H    ASP   2           H        ASP   2  75.167   8.235  -8.247
    7    HA   ASP   2           HA       ASP   2  72.811   7.705  -9.945
    8    HB2  ASP   2           HB2      ASP   2  75.622   8.275 -10.897
    9    HB3  ASP   2           HB1      ASP   2  74.367   7.555 -11.905
   10    H    VAL   3           H        VAL   3  72.574   5.808  -8.664
   11    HA   VAL   3           HA       VAL   3  74.438   3.861  -8.112
   12    HB   VAL   3           HB       VAL   3  72.198   3.686  -7.249
   13   HG11  VAL   3          HG11      VAL   3  70.923   4.729  -8.996
   14   HG12  VAL   3          HG12      VAL   3  70.323   3.077  -8.852
   15   HG13  VAL   3          HG13      VAL   3  71.414   3.508 -10.169
   16   HG21  VAL   3          HG21      VAL   3  72.516   1.424  -9.242
   17   HG22  VAL   3          HG22      VAL   3  71.746   1.361  -7.658
   18   HG23  VAL   3          HG23      VAL   3  73.492   1.562  -7.780
   19    H    GLU   4           H        GLU   4  73.208   4.842 -11.170
   20    HA   GLU   4           HA       GLU   4  73.737   2.397 -12.584
   21    HB2  GLU   4           HB2      GLU   4  73.216   5.237 -13.460
   22    HB3  GLU   4           HB3      GLU   4  73.569   3.947 -14.611
   23    HG2  GLU   4           HG2      GLU   4  71.396   3.671 -12.532
   24    HG3  GLU   4           HG3      GLU   4  71.088   4.402 -14.106
   25    H    LYS   5           H        LYS   5  75.363   5.582 -12.654
   26    HA   LYS   5           HA       LYS   5  77.647   4.552 -14.036
   27    HB2  LYS   5           HB2      LYS   5  76.896   7.148 -12.750
   28    HB3  LYS   5           HB3      LYS   5  78.606   6.845 -13.042
   29    HG2  LYS   5           HG2      LYS   5  77.818   7.952 -15.000
   30    HG3  LYS   5           HG3      LYS   5  77.946   6.254 -15.447
   31    HD2  LYS   5           HD2      LYS   5  75.824   6.766 -16.260
   32    HD3  LYS   5           HD3      LYS   5  75.425   6.165 -14.653
   33    HE2  LYS   5           HE2      LYS   5  75.386   8.482 -13.794
   34    HE3  LYS   5           HE3      LYS   5  75.787   9.081 -15.403
   35    HZ1  LYS   5           HZ1      LYS   5  73.310   8.880 -14.571
   36    HZ2  LYS   5           HZ2      LYS   5  73.489   7.295 -15.158
   37    HZ3  LYS   5           HZ3      LYS   5  73.729   8.620 -16.194
   38    H    GLY   6           H        GLY   6  76.637   4.623 -10.766
   39    HA2  GLY   6           HA2      GLY   6  79.227   4.460  -9.547
   40    HA3  GLY   6           HA3      GLY   6  77.688   4.045  -8.787
   41    H    LYS   7           H        LYS   7  76.861   2.231 -10.841
   42    HA   LYS   7           HA       LYS   7  78.058  -0.172  -9.891
   43    HB2  LYS   7           HB2      LYS   7  75.725  -0.105 -10.623
   44    HB3  LYS   7           HB3      LYS   7  76.231   0.329 -12.254
   45    HG2  LYS   7           HG2      LYS   7  77.552  -2.094 -11.202
   46    HG3  LYS   7           HG3      LYS   7  75.806  -2.253 -11.377
   47    HD2  LYS   7           HD2      LYS   7  76.004  -1.421 -13.727
   48    HD3  LYS   7           HD3      LYS   7  77.757  -1.403 -13.539
   49    HE2  LYS   7           HE2      LYS   7  77.560  -3.520 -14.407
   50    HE3  LYS   7           HE3      LYS   7  77.255  -3.930 -12.719
   51    HZ1  LYS   7           HZ1      LYS   7  75.048  -3.112 -14.497
   52    HZ2  LYS   7           HZ2      LYS   7  74.983  -4.024 -13.065
   53    HZ3  LYS   7           HZ3      LYS   7  75.599  -4.716 -14.490
   54    H    LYS   8           H        LYS   8  78.310   1.706 -12.902
   55    HA   LYS   8           HA       LYS   8  79.933  -0.075 -14.345
   56    HB2  LYS   8           HB2      LYS   8  78.876   1.853 -15.396
   57    HB3  LYS   8           HB3      LYS   8  79.850   2.950 -14.418
   58    HG2  LYS   8           HG2      LYS   8  81.409   0.934 -15.931
   59    HG3  LYS   8           HG3      LYS   8  80.546   2.097 -16.934
   60    HD2  LYS   8           HD2      LYS   8  82.156   3.066 -14.581
   61    HD3  LYS   8           HD3      LYS   8  82.964   2.675 -16.098
   62    HE2  LYS   8           HE2      LYS   8  81.459   4.230 -17.297
   63    HE3  LYS   8           HE3      LYS   8  80.672   4.636 -15.773
   64    HZ1  LYS   8           HZ1      LYS   8  82.572   5.671 -14.974
   65    HZ2  LYS   8           HZ2      LYS   8  82.536   6.146 -16.605
   66    HZ3  LYS   8           HZ3      LYS   8  83.591   4.915 -16.099
   67    H    ILE   9           H        ILE   9  80.855   2.666 -12.266
   68    HA   ILE   9           HA       ILE   9  83.646   2.305 -12.517
   69    HB   ILE   9           HB       ILE   9  82.035   3.580 -10.297
   70   HG12  ILE   9          HG12      ILE   9  83.574   4.949 -12.508
   71   HG13  ILE   9          HG13      ILE   9  81.892   4.467 -12.724
   72   HG21  ILE   9          HG21      ILE   9  84.227   4.787  -9.884
   73   HG22  ILE   9          HG22      ILE   9  84.992   3.610 -10.950
   74   HG23  ILE   9          HG23      ILE   9  84.232   3.078  -9.451
   75   HD11  ILE   9          HD11      ILE   9  82.742   6.083 -10.324
   76   HD12  ILE   9          HD12      ILE   9  81.131   5.910 -11.019
   77   HD13  ILE   9          HD13      ILE   9  82.355   6.866 -11.856
   78    H    PHE  10           H        PHE  10  81.244   0.700 -10.591
   79    HA   PHE  10           HA       PHE  10  83.102  -0.323  -8.640
   80    HB2  PHE  10           HB2      PHE  10  80.971  -0.226  -7.747
   81    HB3  PHE  10           HB1      PHE  10  80.204  -0.724  -9.254
   82    HD1  PHE  10           HD1      PHE  10  80.129  -3.081  -9.918
   83    HD2  PHE  10           HD2      PHE  10  81.905  -1.868  -6.206
   84    HE1  PHE  10           HE1      PHE  10  80.118  -5.437  -9.151
   85    HE2  PHE  10           HE2      PHE  10  81.895  -4.226  -5.432
   86    HZ   PHE  10           HZ       PHE  10  81.002  -6.011  -6.909
   87    H    VAL  11           H        VAL  11  81.296  -1.822 -11.337
   88    HA   VAL  11           HA       VAL  11  82.309  -4.395 -11.099
   89    HB   VAL  11           HB       VAL  11  81.806  -4.641 -13.522
   90   HG11  VAL  11          HG11      VAL  11  79.465  -4.400 -13.261
   91   HG12  VAL  11          HG12      VAL  11  79.644  -3.031 -12.166
   92   HG13  VAL  11          HG13      VAL  11  80.070  -4.656 -11.625
   93   HG21  VAL  11          HG21      VAL  11  81.106  -1.702 -13.348
   94   HG22  VAL  11          HG22      VAL  11  80.962  -2.735 -14.768
   95   HG23  VAL  11          HG23      VAL  11  82.555  -2.320 -14.136
   96    H    GLN  12           H        GLN  12  83.780  -1.543 -12.473
   97    HA   GLN  12           HA       GLN  12  85.988  -3.143 -13.554
   98    HB2  GLN  12           HB2      GLN  12  86.699  -1.132 -14.661
   99    HB3  GLN  12           HB1      GLN  12  84.967  -1.341 -14.912
  100    HG2  GLN  12           HG2      GLN  12  84.579   0.199 -12.949
  101    HG3  GLN  12           HG1      GLN  12  86.315   0.520 -12.947
  102   HE21  GLN  12          HE21      GLN  12  85.672  -0.020 -16.122
  103   HE22  GLN  12          HE22      GLN  12  85.325   1.560 -16.626
  104    H    LYS  13           H        LYS  13  85.333  -1.056 -10.811
  105    HA   LYS  13           HA       LYS  13  88.224  -0.868 -10.259
  106    HB2  LYS  13           HB2      LYS  13  85.870   0.584  -9.056
  107    HB3  LYS  13           HB3      LYS  13  87.517   0.733  -8.462
  108    HG2  LYS  13           HG2      LYS  13  88.027   1.216 -11.043
  109    HG3  LYS  13           HG3      LYS  13  86.340   1.714 -11.032
  110    HD2  LYS  13           HD2      LYS  13  87.391   3.709 -10.459
  111    HD3  LYS  13           HD3      LYS  13  87.043   3.042  -8.864
  112    HE2  LYS  13           HE2      LYS  13  89.314   2.126  -8.723
  113    HE3  LYS  13           HE3      LYS  13  89.668   2.709 -10.349
  114    HZ1  LYS  13           HZ1      LYS  13  90.229   4.651  -9.486
  115    HZ2  LYS  13           HZ2      LYS  13  89.858   4.099  -7.923
  116    HZ3  LYS  13           HZ3      LYS  13  88.662   4.848  -8.867
  117    H    CYS  14           H        CYS  14  85.330  -1.420  -8.205
  118    HA   CYS  14           HA       CYS  14  87.012  -2.737  -6.248
  119    HB2  CYS  14           HB2      CYS  14  84.047  -2.582  -5.992
  120    HB3  CYS  14           HB1      CYS  14  85.284  -2.432  -4.750
  121    H    ALA  15           H        ALA  15  84.496  -3.819  -8.502
  122    HA   ALA  15           HA       ALA  15  83.888  -6.281  -7.439
  123    HB1  ALA  15           HB1      ALA  15  84.203  -5.346 -10.270
  124    HB2  ALA  15           HB2      ALA  15  82.733  -5.776  -9.395
  125    HB3  ALA  15           HB3      ALA  15  83.838  -7.039  -9.937
  126    H    GLN  16           H        GLN  16  86.894  -5.250  -8.852
  127    HA   GLN  16           HA       GLN  16  88.116  -7.584  -9.613
  128    HB2  GLN  16           HB2      GLN  16  89.139  -5.077  -8.338
  129    HB3  GLN  16           HB1      GLN  16  90.244  -6.429  -8.581
  130    HG2  GLN  16           HG2      GLN  16  89.594  -6.482 -10.988
  131    HG3  GLN  16           HG1      GLN  16  88.583  -5.063 -10.719
  132   HE21  GLN  16          HE21      GLN  16  90.056  -3.314  -9.295
  133   HE22  GLN  16          HE22      GLN  16  91.547  -2.983 -10.035
  134    H    CYS  17           H        CYS  17  88.612  -6.215  -6.325
  135    HA   CYS  17           HA       CYS  17  88.943  -9.001  -5.363
  136    HB2  CYS  17           HB2      CYS  17  90.080  -6.806  -3.733
  137    HB3  CYS  17           HB1      CYS  17  90.753  -8.383  -4.130
  138    H    HIS  18           H        HSD  18  86.339  -8.025  -5.430
  139    HA   HIS  18           HA       HSD  18  85.721  -8.084  -2.587
  140    HB2  HIS  18           HB2      HSD  18  85.112  -5.689  -4.308
  141    HB3  HIS  18           HB1      HSD  18  84.136  -6.078  -2.893
  142    HD1  HIS  18           HD1      HSD  18  86.594  -7.162  -1.155
  143    HD2  HIS  18           HD2      HSD  18  86.423  -3.493  -3.124
  144    HE1  HIS  18           HE1      HSD  18  88.243  -5.637   0.022
  145    H    THR  19           H        THR  19  83.180  -7.811  -2.381
  146    HA   THR  19           HA       THR  19  81.875  -9.290  -4.581
  147    HB   THR  19           HB       THR  19  80.820 -10.089  -2.012
  148    HG1  THR  19           HG1      THR  19  83.333 -11.133  -2.197
  149   HG21  THR  19          HG21      THR  19  81.223 -12.299  -2.889
  150   HG22  THR  19          HG22      THR  19  82.397 -11.679  -4.049
  151   HG23  THR  19          HG23      THR  19  80.687 -11.285  -4.228
  152    H    VAL  20           H        VAL  20  81.549  -7.256  -1.723
  153    HA   VAL  20           HA       VAL  20  79.832  -5.925  -0.966
  154    HB   VAL  20           HB       VAL  20  79.180  -4.228  -2.551
  155   HG11  VAL  20          HG11      VAL  20  81.362  -3.479  -3.214
  156   HG12  VAL  20          HG12      VAL  20  81.982  -5.127  -3.256
  157   HG13  VAL  20          HG13      VAL  20  81.573  -4.379  -1.713
  158   HG21  VAL  20          HG21      VAL  20  78.701  -5.944  -4.401
  159   HG22  VAL  20          HG22      VAL  20  80.430  -5.898  -4.733
  160   HG23  VAL  20          HG23      VAL  20  79.461  -4.437  -4.902
  161    H    GLU  21           H        GLU  21  78.959  -8.637  -1.616
  162    HA   GLU  21           HA       GLU  21  76.117  -8.024  -2.177
  163    HB2  GLU  21           HB2      GLU  21  75.866 -10.001  -3.472
  164    HB3  GLU  21           HB3      GLU  21  77.312  -9.205  -4.089
  165    HG2  GLU  21           HG2      GLU  21  78.591 -10.684  -2.380
  166    HG3  GLU  21           HG3      GLU  21  77.111 -11.641  -2.329
  167    H    LYS  22           H        LYS  22  74.827  -8.567  -0.562
  168    HA   LYS  22           HA       LYS  22  75.563  -9.556   1.877
  169    HB2  LYS  22           HB2      LYS  22  73.285  -8.607   1.075
  170    HB3  LYS  22           HB3      LYS  22  72.885 -10.284   0.710
  171    HG2  LYS  22           HG2      LYS  22  72.137 -10.165   2.903
  172    HG3  LYS  22           HG3      LYS  22  73.796 -10.691   3.177
  173    HD2  LYS  22           HD2      LYS  22  74.495  -8.368   3.556
  174    HD3  LYS  22           HD3      LYS  22  72.857  -7.807   3.219
  175    HE2  LYS  22           HE2      LYS  22  72.101  -9.351   5.122
  176    HE3  LYS  22           HE3      LYS  22  73.807  -9.479   5.550
  177    HZ1  LYS  22           HZ1      LYS  22  72.198  -7.573   6.472
  178    HZ2  LYS  22           HZ2      LYS  22  72.817  -6.790   5.097
  179    HZ3  LYS  22           HZ3      LYS  22  73.872  -7.374   6.293
  180    H    GLY  23           H        GLY  23  75.594 -11.548   2.901
  181    HA2  GLY  23           HA2      GLY  23  76.270 -13.761   3.009
  182    HA3  GLY  23           HA3      GLY  23  74.782 -14.014   2.103
  183    H    GLY  24           H        GLY  24  77.647 -12.297   0.949
  184    HA2  GLY  24           HA2      GLY  24  77.737 -13.977  -1.413
  185    HA3  GLY  24           HA3      GLY  24  78.755 -12.580  -1.078
  186    H    LYS  25           H        LYS  25  80.756 -13.379  -1.395
  187    HA   LYS  25           HA       LYS  25  81.754 -15.300   0.551
  188    HB2  LYS  25           HB2      LYS  25  82.649 -16.850  -1.030
  189    HB3  LYS  25           HB3      LYS  25  80.954 -16.628  -1.455
  190    HG2  LYS  25           HG2      LYS  25  81.876 -14.734  -3.030
  191    HG3  LYS  25           HG3      LYS  25  83.405 -15.594  -2.857
  192    HD2  LYS  25           HD2      LYS  25  82.517 -16.666  -4.721
  193    HD3  LYS  25           HD3      LYS  25  81.940 -17.717  -3.429
  194    HE2  LYS  25           HE2      LYS  25  79.769 -16.634  -3.440
  195    HE3  LYS  25           HE3      LYS  25  80.335 -15.415  -4.582
  196    HZ1  LYS  25           HZ1      LYS  25  80.922 -17.757  -5.813
  197    HZ2  LYS  25           HZ2      LYS  25  79.567 -16.786  -6.137
  198    HZ3  LYS  25           HZ3      LYS  25  79.439 -18.098  -5.065
  199    H    HIS  26           H        HIS  26  83.441 -14.275   1.383
  200    HA   HIS  26           HA       HIS  26  84.771 -12.088   0.296
  201    HB2  HIS  26           HB2      HIS  26  86.203 -14.024   2.091
  202    HB3  HIS  26           HB1      HIS  26  86.258 -12.262   2.088
  203    HD1  HIS  26           HD1      HIS  26  82.997 -12.124   1.884
  204    HD2  HIS  26           HD2      HIS  26  85.273 -14.025   4.813
  205    HE1  HIS  26           HE1      HIS  26  81.515 -12.314   3.929
  206    HE2  HIS  26           HE2      HIS  26  82.889 -13.471   5.725
  207    H    LYS  27           H        LYS  27  86.148 -11.876  -1.332
  208    HA   LYS  27           HA       LYS  27  87.860 -14.161  -2.091
  209    HB2  LYS  27           HB2      LYS  27  87.464 -13.282  -4.515
  210    HB3  LYS  27           HB3      LYS  27  86.238 -14.310  -3.772
  211    HG2  LYS  27           HG2      LYS  27  84.812 -12.484  -3.312
  212    HG3  LYS  27           HG3      LYS  27  86.107 -11.306  -3.525
  213    HD2  LYS  27           HD2      LYS  27  84.551 -11.343  -5.466
  214    HD3  LYS  27           HD3      LYS  27  86.195 -11.791  -5.924
  215    HE2  LYS  27           HE2      LYS  27  85.650 -14.078  -6.110
  216    HE3  LYS  27           HE3      LYS  27  84.175 -13.895  -5.158
  217    HZ1  LYS  27           HZ1      LYS  27  84.436 -12.393  -7.665
  218    HZ2  LYS  27           HZ2      LYS  27  83.042 -12.999  -6.907
  219    HZ3  LYS  27           HZ3      LYS  27  84.079 -14.050  -7.746
  220    H    THR  28           H        THR  28  89.930 -13.574  -2.077
  221    HA   THR  28           HA       THR  28  91.781 -12.201  -1.884
  222    HB   THR  28           HB       THR  28  90.609 -10.668  -4.192
  223    HG1  THR  28           HG1      THR  28  91.429 -12.451  -5.469
  224   HG21  THR  28          HG21      THR  28  92.853 -10.442  -4.874
  225   HG22  THR  28          HG22      THR  28  93.382 -11.807  -3.891
  226   HG23  THR  28          HG23      THR  28  92.944 -10.283  -3.120
  227    H    GLY  29           H        GLY  29  89.345 -11.374  -0.417
  228    HA2  GLY  29           HA2      GLY  29  90.162  -9.099   0.843
  229    HA3  GLY  29           HA3      GLY  29  89.215  -8.498  -0.515
  230    HA   PRO  30           HA       PRO  30  86.496 -10.077   3.092
  231    HB2  PRO  30           HB2      PRO  30  86.038  -7.764   4.469
  232    HB3  PRO  30           HB1      PRO  30  87.388  -8.855   4.838
  233    HG2  PRO  30           HG2      PRO  30  87.385  -6.313   3.279
  234    HG3  PRO  30           HG1      PRO  30  88.567  -6.915   4.455
  235    HD2  PRO  30           HD2      PRO  30  88.949  -7.085   1.746
  236    HD3  PRO  30           HD1      PRO  30  89.641  -8.248   2.898
  237    H    ASN  31           H        ASN  31  84.214  -9.323   3.546
  238    HA   ASN  31           HA       ASN  31  83.031  -8.303   1.078
  239    HB2  ASN  31           HB2      ASN  31  80.995  -9.200   1.864
  240    HB3  ASN  31           HB1      ASN  31  82.210 -10.352   2.412
  241   HD21  ASN  31          HD21      ASN  31  82.556 -10.568   4.692
  242   HD22  ASN  31          HD22      ASN  31  81.617  -9.744   5.842
  243    H    LEU  32           H        LEU  32  81.288  -6.669   1.212
  244    HA   LEU  32           HA       LEU  32  81.843  -4.649   3.309
  245    HB2  LEU  32           HB2      LEU  32  80.793  -4.096   0.527
  246    HB3  LEU  32           HB3      LEU  32  81.317  -2.917   1.722
  247    HG   LEU  32           HG       LEU  32  83.016  -4.856   0.144
  248   HD11  LEU  32          HD11      LEU  32  84.053  -2.887  -0.694
  249   HD12  LEU  32          HD12      LEU  32  83.371  -1.886   0.589
  250   HD13  LEU  32          HD13      LEU  32  82.330  -2.516  -0.684
  251   HD21  LEU  32          HD21      LEU  32  84.085  -5.068   2.208
  252   HD22  LEU  32          HD22      LEU  32  83.590  -3.469   2.748
  253   HD23  LEU  32          HD23      LEU  32  84.885  -3.639   1.569
  254    H    HIS  33           H        HIS  33  79.950  -6.769   3.617
  255    HA   HIS  33           HA       HIS  33  77.309  -5.998   2.965
  256    HB2  HIS  33           HB2      HIS  33  78.222  -7.643   5.336
  257    HB3  HIS  33           HB1      HIS  33  76.611  -7.633   4.619
  258    HD1  HIS  33           HD1      HIS  33  78.449 -10.204   4.747
  259    HD2  HIS  33           HD2      HIS  33  78.052  -7.701   1.437
  260    HE1  HIS  33           HE1      HIS  33  79.093 -11.584   2.724
  261    HE2  HIS  33           HE2      HIS  33  78.855 -10.073   0.698
  262    H    GLY  34           H        GLY  34  75.805  -4.754   4.018
  263    HA2  GLY  34           HA2      GLY  34  75.235  -2.821   5.207
  264    HA3  GLY  34           HA3      GLY  34  75.534  -3.913   6.556
  265    H    LEU  35           H        LEU  35  78.013  -2.863   4.339
  266    HA   LEU  35           HA       LEU  35  79.969  -2.235   6.120
  267    HB2  LEU  35           HB2      LEU  35  80.345  -2.297   3.720
  268    HB3  LEU  35           HB3      LEU  35  79.336  -0.874   3.493
  269    HG   LEU  35           HG       LEU  35  81.102   0.144   5.269
  270   HD11  LEU  35          HD11      LEU  35  82.247  -2.233   5.096
  271   HD12  LEU  35          HD12      LEU  35  83.233  -0.773   5.160
  272   HD13  LEU  35          HD13      LEU  35  82.927  -1.559   3.615
  273   HD21  LEU  35          HD21      LEU  35  81.780  -0.135   2.331
  274   HD22  LEU  35          HD22      LEU  35  82.197   1.201   3.405
  275   HD23  LEU  35          HD23      LEU  35  80.518   0.941   2.933
  276    H    PHE  36           H        PHE  36  77.779   0.176   4.680
  277    HA   PHE  36           HA       PHE  36  78.610   2.370   6.170
  278    HB2  PHE  36           HB2      PHE  36  75.771   1.886   5.250
  279    HB3  PHE  36           HB1      PHE  36  76.572   3.439   5.499
  280    HD1  PHE  36           HD2      PHE  36  76.561   0.363   3.400
  281    HD2  PHE  36           HD1      PHE  36  77.979   4.401   3.811
  282    HE1  PHE  36           HE2      PHE  36  77.416   0.302   1.076
  283    HE2  PHE  36           HE1      PHE  36  78.822   4.338   1.489
  284    HZ   PHE  36           HZ       PHE  36  78.545   2.291   0.117
  285    H    GLY  37           H        GLY  37  78.956   1.840   8.350
  286    HA2  GLY  37           HA2      GLY  37  77.420   2.563  10.320
  287    HA3  GLY  37           HA3      GLY  37  76.590   1.067   9.927
  288    H    ARG  38           H        ARG  38  79.231  -0.246   9.245
  289    HA   ARG  38           HA       ARG  38  79.843  -1.043  11.992
  290    HB2  ARG  38           HB2      ARG  38  80.139  -2.235   9.313
  291    HB3  ARG  38           HB3      ARG  38  81.469  -2.577  10.417
  292    HG2  ARG  38           HG2      ARG  38  79.696  -3.248  12.133
  293    HG3  ARG  38           HG3      ARG  38  78.532  -3.190  10.809
  294    HD2  ARG  38           HD2      ARG  38  81.079  -4.778  10.541
  295    HD3  ARG  38           HD3      ARG  38  79.681  -5.465  11.360
  296    HE   ARG  38           HE       ARG  38  78.566  -4.646   9.068
  297   HH11  ARG  38          HH21      ARG  38  81.538  -6.325   9.707
  298   HH12  ARG  38          HH22      ARG  38  81.536  -7.171   8.197
  299   HH21  ARG  38          HH11      ARG  38  78.563  -5.774   7.103
  300   HH22  ARG  38          HH12      ARG  38  79.853  -6.867   6.731
  301    H    LYS  39           H        LYS  39  81.900  -1.069  12.907
  302    HA   LYS  39           HA       LYS  39  83.555   1.171  12.293
  303    HB2  LYS  39           HB2      LYS  39  83.564  -1.028  14.301
  304    HB3  LYS  39           HB3      LYS  39  85.080  -0.171  14.026
  305    HG2  LYS  39           HG2      LYS  39  82.556   1.413  14.426
  306    HG3  LYS  39           HG3      LYS  39  83.367   0.720  15.829
  307    HD2  LYS  39           HD2      LYS  39  85.487   1.830  15.105
  308    HD3  LYS  39           HD3      LYS  39  84.598   2.602  13.792
  309    HE2  LYS  39           HE2      LYS  39  83.020   3.513  15.588
  310    HE3  LYS  39           HE3      LYS  39  84.224   2.991  16.766
  311    HZ1  LYS  39           HZ1      LYS  39  84.508   5.315  16.084
  312    HZ2  LYS  39           HZ2      LYS  39  84.765   4.810  14.483
  313    HZ3  LYS  39           HZ3      LYS  39  85.861   4.367  15.703
  314    H    THR  40           H        THR  40  85.976   0.927  12.052
  315    HA   THR  40           HA       THR  40  86.549  -0.477   9.664
  316    HB   THR  40           HB       THR  40  88.942   0.192  10.210
  317    HG1  THR  40           HG1      THR  40  87.642   1.606  12.286
  318   HG21  THR  40          HG21      THR  40  87.836   1.669   8.777
  319   HG22  THR  40          HG22      THR  40  88.250   2.720  10.133
  320   HG23  THR  40          HG23      THR  40  86.615   2.078   9.983
  321    H    GLY  41           H        GLY  41  87.704  -2.303   9.244
  322    HA2  GLY  41           HA2      GLY  41  88.365  -4.475   9.583
  323    HA3  GLY  41           HA3      GLY  41  89.297  -3.805  10.921
  324    H    GLN  42           H        GLN  42  85.805  -4.266  10.355
  325    HA   GLN  42           HA       GLN  42  85.639  -5.549  13.017
  326    HB2  GLN  42           HB2      GLN  42  84.242  -3.567  12.799
  327    HB3  GLN  42           HB1      GLN  42  83.495  -4.225  11.342
  328    HG2  GLN  42           HG2      GLN  42  82.429  -5.974  12.546
  329    HG3  GLN  42           HG1      GLN  42  83.435  -5.713  13.970
  330   HE21  GLN  42          HE21      GLN  42  82.438  -2.763  12.525
  331   HE22  GLN  42          HE22      GLN  42  81.158  -2.417  13.585
  332    H    ALA  43           H        ALA  43  85.330  -6.112   9.642
  333    HA   ALA  43           HA       ALA  43  83.572  -8.375   9.841
  334    HB1  ALA  43           HB1      ALA  43  83.398  -7.743   7.686
  335    HB2  ALA  43           HB2      ALA  43  84.905  -8.623   7.431
  336    HB3  ALA  43           HB3      ALA  43  84.938  -6.886   7.734
  337    HA   PRO  44           HA       PRO  44  87.024 -11.018  11.063
  338    HB2  PRO  44           HB2      PRO  44  85.579 -13.168  11.813
  339    HB3  PRO  44           HB1      PRO  44  85.606 -11.682  12.785
  340    HG2  PRO  44           HG2      PRO  44  83.529 -12.657  10.879
  341    HG3  PRO  44           HG1      PRO  44  83.332 -11.884  12.462
  342    HD2  PRO  44           HD2      PRO  44  83.094 -10.552  10.047
  343    HD3  PRO  44           HD1      PRO  44  83.503  -9.763  11.588
  344    H    GLY  45           H        GLY  45  85.712 -10.877   8.237
  345    HA2  GLY  45           HA2      GLY  45  85.826 -13.603   7.283
  346    HA3  GLY  45           HA3      GLY  45  85.606 -12.159   6.301
  347    H    PHE  46           H        PHE  46  87.871 -10.707   7.014
  348    HA   PHE  46           HA       PHE  46  90.080 -12.439   6.061
  349    HB2  PHE  46           HB2      PHE  46  89.211 -10.855   4.329
  350    HB3  PHE  46           HB1      PHE  46  89.661  -9.519   5.389
  351    HD1  PHE  46           HD2      PHE  46  91.085 -12.593   3.790
  352    HD2  PHE  46           HD1      PHE  46  91.837  -8.644   5.304
  353    HE1  PHE  46           HE2      PHE  46  93.417 -12.718   2.958
  354    HE2  PHE  46           HE1      PHE  46  94.169  -8.769   4.471
  355    HZ   PHE  46           HZ       PHE  46  94.960 -10.806   3.298
  356    H    THR  47           H        THR  47  92.210 -11.831   6.732
  357    HA   THR  47           HA       THR  47  92.335 -11.003   9.465
  358    HB   THR  47           HB       THR  47  94.672 -11.223   7.567
  359    HG1  THR  47           HG1      THR  47  93.282 -13.254   8.976
  360   HG21  THR  47          HG21      THR  47  94.363 -11.767  10.533
  361   HG22  THR  47          HG22      THR  47  95.079 -10.313   9.838
  362   HG23  THR  47          HG23      THR  47  95.861 -11.877   9.607
  363    H    TYR  48           H        TYR  48  91.346  -8.910   9.319
  364    HA   TYR  48           HA       TYR  48  92.245  -6.770   7.768
  365    HB2  TYR  48           HB2      TYR  48  90.743  -7.048  10.329
  366    HB3  TYR  48           HB3      TYR  48  91.359  -5.451   9.913
  367    HD1  TYR  48           HD2      TYR  48  90.708  -4.371   7.778
  368    HD2  TYR  48           HD1      TYR  48  88.932  -8.048   9.102
  369    HE1  TYR  48           HE2      TYR  48  88.853  -4.049   6.174
  370    HE2  TYR  48           HE1      TYR  48  87.073  -7.728   7.493
  371    HH   TYR  48           HH       TYR  48  86.420  -4.824   6.006
  372    H    THR  49           H        THR  49  93.536  -4.952   8.298
  373    HA   THR  49           HA       THR  49  95.978  -5.679   9.685
  374    HB   THR  49           HB       THR  49  96.800  -3.509   8.877
  375    HG1  THR  49           HG1      THR  49  95.468  -2.034   8.162
  376   HG21  THR  49          HG21      THR  49  97.087  -5.167   7.246
  377   HG22  THR  49          HG22      THR  49  96.190  -3.928   6.369
  378   HG23  THR  49          HG23      THR  49  95.352  -5.350   6.987
  379    H    ASP  50           H        ASP  50  96.930  -4.406  11.370
  380    HA   ASP  50           HA       ASP  50  95.358  -3.946  13.590
  381    HB2  ASP  50           HB2      ASP  50  97.273  -2.433  14.342
  382    HB3  ASP  50           HB1      ASP  50  97.704  -4.086  13.903
  383    H    ALA  51           H        ALA  51  96.460  -1.573  11.188
  384    HA   ALA  51           HA       ALA  51  95.397   0.735  12.309
  385    HB1  ALA  51           HB1      ALA  51  95.585   1.720  10.163
  386    HB2  ALA  51           HB2      ALA  51  95.368   0.172   9.347
  387    HB3  ALA  51           HB3      ALA  51  96.859   0.503  10.229
  388    H    ASN  52           H        ASN  52  93.806  -1.737  10.341
  389    HA   ASN  52           HA       ASN  52  91.306  -0.277  10.244
  390    HB2  ASN  52           HB2      ASN  52  92.328  -2.887   9.217
  391    HB3  ASN  52           HB1      ASN  52  90.587  -2.715   9.422
  392   HD21  ASN  52          HD21      ASN  52  90.099  -2.602   7.151
  393   HD22  ASN  52          HD22      ASN  52  90.580  -1.288   6.188
  394    H    LYS  53           H        LYS  53  92.795  -2.694  12.256
  395    HA   LYS  53           HA       LYS  53  90.315  -3.417  13.582
  396    HB2  LYS  53           HB2      LYS  53  91.684  -5.266  13.601
  397    HB3  LYS  53           HB3      LYS  53  93.157  -4.305  13.643
  398    HG2  LYS  53           HG2      LYS  53  92.885  -3.850  15.993
  399    HG3  LYS  53           HG3      LYS  53  91.270  -4.562  15.994
  400    HD2  LYS  53           HD2      LYS  53  92.328  -6.746  15.292
  401    HD3  LYS  53           HD3      LYS  53  93.902  -5.996  15.560
  402    HE2  LYS  53           HE2      LYS  53  93.154  -5.463  17.913
  403    HE3  LYS  53           HE3      LYS  53  91.718  -6.442  17.612
  404    HZ1  LYS  53           HZ1      LYS  53  92.930  -8.187  18.196
  405    HZ2  LYS  53           HZ2      LYS  53  94.363  -7.275  18.236
  406    HZ3  LYS  53           HZ3      LYS  53  93.840  -7.978  16.780
  407    H    ASN  54           H        ASN  54  92.613  -0.960  13.734
  408    HA   ASN  54           HA       ASN  54  92.724  -0.449  16.516
  409    HB2  ASN  54           HB2      ASN  54  93.849   1.468  15.935
  410    HB3  ASN  54           HB1      ASN  54  94.075   0.535  14.461
  411   HD21  ASN  54          HD21      ASN  54  91.387   0.874  13.405
  412   HD22  ASN  54          HD22      ASN  54  91.205   2.509  12.989
  413    H    LYS  55           H        LYS  55  90.291  -0.038  14.171
  414    HA   LYS  55           HA       LYS  55  88.178   0.891  14.229
  415    HB2  LYS  55           HB2      LYS  55  88.687   0.485  17.179
  416    HB3  LYS  55           HB3      LYS  55  87.140   1.031  16.534
  417    HG2  LYS  55           HG2      LYS  55  87.122  -1.014  15.060
  418    HG3  LYS  55           HG3      LYS  55  88.552  -1.580  15.924
  419    HD2  LYS  55           HD2      LYS  55  85.879  -0.926  17.201
  420    HD3  LYS  55           HD3      LYS  55  86.481  -2.551  16.874
  421    HE2  LYS  55           HE2      LYS  55  87.124  -2.280  19.096
  422    HE3  LYS  55           HE3      LYS  55  88.575  -1.729  18.260
  423    HZ1  LYS  55           HZ1      LYS  55  86.837   0.440  18.461
  424    HZ2  LYS  55           HZ2      LYS  55  88.333   0.224  19.237
  425    HZ3  LYS  55           HZ3      LYS  55  86.899  -0.287  19.992
  426    H    GLY  56           H        GLY  56  89.638   2.812  13.484
  427    HA2  GLY  56           HA2      GLY  56  89.787   5.003  15.392
  428    HA3  GLY  56           HA3      GLY  56  90.331   5.034  13.719
  429    H    ILE  57           H        ILE  57  87.936   4.160  12.485
  430    HA   ILE  57           HA       ILE  57  85.893   6.110  13.283
  431    HB   ILE  57           HB       ILE  57  85.770   7.120  11.093
  432   HG12  ILE  57          HG12      ILE  57  87.738   6.488   9.479
  433   HG13  ILE  57          HG13      ILE  57  87.808   4.998  10.416
  434   HG21  ILE  57          HG21      ILE  57  87.823   8.361  11.113
  435   HG22  ILE  57          HG22      ILE  57  88.691   7.030  11.878
  436   HG23  ILE  57          HG23      ILE  57  87.477   7.929  12.788
  437   HD11  ILE  57          HD11      ILE  57  86.164   5.426   8.244
  438   HD12  ILE  57          HD12      ILE  57  85.074   5.731   9.592
  439   HD13  ILE  57          HD13      ILE  57  85.913   4.187   9.468
  440    H    THR  58           H        THR  58  83.937   5.883  11.759
  441    HA   THR  58           HA       THR  58  83.485   3.000  11.302
  442    HB   THR  58           HB       THR  58  81.552   5.222  11.982
  443    HG1  THR  58           HG1      THR  58  82.102   4.575  13.891
  444   HG21  THR  58          HG21      THR  58  80.409   3.757  10.471
  445   HG22  THR  58          HG22      THR  58  79.905   3.288  12.094
  446   HG23  THR  58          HG23      THR  58  81.104   2.328  11.232
  447    H    TRP  59           H        TRP  59  82.671   2.270   9.386
  448    HA   TRP  59           HA       TRP  59  83.095   3.819   7.057
  449    HB2  TRP  59           HB2      TRP  59  81.261   1.427   7.194
  450    HB3  TRP  59           HB1      TRP  59  82.224   1.993   5.830
  451    HD1  TRP  59           HD1      TRP  59  84.992   2.388   7.251
  452    HE1  TRP  59           HE1      TRP  59  86.345   0.329   8.020
  453    HE3  TRP  59           HE3      TRP  59  81.263  -1.082   7.542
  454    HZ2  TRP  59           HZ2      TRP  59  85.892  -2.416   8.702
  455    HZ3  TRP  59           HZ3      TRP  59  81.748  -3.404   8.245
  456    HH2  TRP  59           HH2      TRP  59  84.058  -4.073   8.826
  457    H    LYS  60           H        LYS  60  81.771   5.063   5.864
  458    HA   LYS  60           HA       LYS  60  78.897   5.073   6.264
  459    HB2  LYS  60           HB2      LYS  60  80.616   7.452   7.015
  460    HB3  LYS  60           HB3      LYS  60  78.872   7.533   6.775
  461    HG2  LYS  60           HG2      LYS  60  78.700   5.647   8.507
  462    HG3  LYS  60           HG3      LYS  60  80.386   5.992   8.887
  463    HD2  LYS  60           HD2      LYS  60  78.289   8.168   8.868
  464    HD3  LYS  60           HD3      LYS  60  78.609   7.197  10.305
  465    HE2  LYS  60           HE2      LYS  60  81.012   7.849  10.169
  466    HE3  LYS  60           HE3      LYS  60  80.622   8.899   8.807
  467    HZ1  LYS  60           HZ1      LYS  60  79.882  10.453  10.181
  468    HZ2  LYS  60           HZ2      LYS  60  80.475   9.534  11.481
  469    HZ3  LYS  60           HZ3      LYS  60  78.860   9.362  10.982
  470    H    GLU  61           H        GLU  61  78.421   7.577   5.040
  471    HA   GLU  61           HA       GLU  61  78.969   6.884   2.302
  472    HB2  GLU  61           HB2      GLU  61  76.853   8.004   3.191
  473    HB3  GLU  61           HB3      GLU  61  77.803   9.487   3.292
  474    HG2  GLU  61           HG2      GLU  61  78.303   9.376   0.907
  475    HG3  GLU  61           HG3      GLU  61  77.464   7.831   0.776
  476    H    GLU  62           H        GLU  62  79.714   9.783   4.262
  477    HA   GLU  62           HA       GLU  62  81.549  10.846   2.367
  478    HB2  GLU  62           HB2      GLU  62  81.423  11.438   5.331
  479    HB3  GLU  62           HB3      GLU  62  82.091  12.469   4.065
  480    HG2  GLU  62           HG2      GLU  62  79.804  12.518   3.007
  481    HG3  GLU  62           HG3      GLU  62  79.190  11.679   4.431
  482    H    THR  63           H        THR  63  82.006   9.046   5.405
  483    HA   THR  63           HA       THR  63  84.762   9.080   5.587
  484    HB   THR  63           HB       THR  63  84.569   6.892   6.722
  485    HG1  THR  63           HG1      THR  63  82.476   6.687   5.121
  486   HG21  THR  63          HG21      THR  63  82.473   8.982   7.301
  487   HG22  THR  63          HG22      THR  63  84.048   8.786   8.067
  488   HG23  THR  63          HG23      THR  63  82.768   7.612   8.368
  489    H    LEU  64           H        LEU  64  82.686   7.088   3.551
  490    HA   LEU  64           HA       LEU  64  84.786   5.451   2.532
  491    HB2  LEU  64           HB2      LEU  64  81.924   5.798   2.066
  492    HB3  LEU  64           HB3      LEU  64  82.810   5.465   0.586
  493    HG   LEU  64           HG       LEU  64  83.171   3.811   3.092
  494   HD11  LEU  64          HD11      LEU  64  81.036   3.126   2.723
  495   HD12  LEU  64          HD12      LEU  64  81.725   2.238   1.363
  496   HD13  LEU  64          HD13      LEU  64  80.989   3.817   1.105
  497   HD21  LEU  64          HD21      LEU  64  84.980   3.421   1.616
  498   HD22  LEU  64          HD22      LEU  64  83.963   3.569   0.185
  499   HD23  LEU  64          HD23      LEU  64  83.843   2.139   1.207
  500    H    MET  65           H        MET  65  83.374   8.538   1.581
  501    HA   MET  65           HA       MET  65  84.456   8.703  -1.012
  502    HB2  MET  65           HB2      MET  65  83.818  10.902   0.960
  503    HB3  MET  65           HB1      MET  65  84.197  11.163  -0.743
  504    HG2  MET  65           HG2      MET  65  82.277   9.916  -1.451
  505    HG3  MET  65           HG1      MET  65  81.976   9.336   0.185
  506    HE1  MET  65           HE1      MET  65  80.443  11.407  -2.293
  507    HE2  MET  65           HE2      MET  65  82.027  12.178  -2.284
  508    HE3  MET  65           HE3      MET  65  80.602  13.102  -1.814
  509    H    GLU  66           H        GLU  66  85.734  10.156   2.001
  510    HA   GLU  66           HA       GLU  66  88.158  11.042   0.870
  511    HB2  GLU  66           HB2      GLU  66  87.556  10.226   3.726
  512    HB3  GLU  66           HB3      GLU  66  88.979  11.128   3.207
  513    HG2  GLU  66           HG2      GLU  66  86.125  12.044   2.762
  514    HG3  GLU  66           HG3      GLU  66  87.150  12.596   4.086
  515    H    TYR  67           H        TYR  67  87.104   7.961   2.094
  516    HA   TYR  67           HA       TYR  67  89.731   6.764   2.156
  517    HB2  TYR  67           HB2      TYR  67  88.075   5.900   3.664
  518    HB3  TYR  67           HB3      TYR  67  86.930   5.657   2.351
  519    HD1  TYR  67           HD1      TYR  67  89.982   4.393   3.972
  520    HD2  TYR  67           HD2      TYR  67  87.156   3.794   0.793
  521    HE1  TYR  67           HE1      TYR  67  90.853   2.095   3.630
  522    HE2  TYR  67           HE2      TYR  67  88.029   1.498   0.450
  523    HH   TYR  67           HH       TYR  67  90.350   0.320   0.943
  524    H    LEU  68           H        LEU  68  87.169   7.184  -0.155
  525    HA   LEU  68           HA       LEU  68  88.075   5.133  -1.966
  526    HB2  LEU  68           HB2      LEU  68  85.875   7.102  -1.848
  527    HB3  LEU  68           HB3      LEU  68  86.438   6.721  -3.469
  528    HG   LEU  68           HG       LEU  68  85.687   4.626  -1.412
  529   HD11  LEU  68          HD11      LEU  68  83.637   5.650  -1.875
  530   HD12  LEU  68          HD12      LEU  68  83.693   4.368  -3.081
  531   HD13  LEU  68          HD13      LEU  68  84.078   6.028  -3.539
  532   HD21  LEU  68          HD21      LEU  68  85.415   3.438  -3.806
  533   HD22  LEU  68          HD22      LEU  68  86.940   3.442  -2.928
  534   HD23  LEU  68          HD23      LEU  68  86.670   4.597  -4.227
  535    H    GLU  69           H        GLU  69  88.900   8.428  -1.372
  536    HA   GLU  69           HA       GLU  69  90.117   8.739  -4.026
  537    HB2  GLU  69           HB2      GLU  69  90.208  11.026  -3.610
  538    HB3  GLU  69           HB3      GLU  69  88.754  10.555  -2.739
  539    HG2  GLU  69           HG2      GLU  69  89.772  11.742  -1.055
  540    HG3  GLU  69           HG3      GLU  69  90.531  10.181  -0.759
  541    H    ASN  70           H        ASN  70  90.917   7.646  -0.954
  542    HA   ASN  70           HA       ASN  70  93.643   7.200  -1.623
  543    HB2  ASN  70           HB2      ASN  70  93.411   9.752  -0.953
  544    HB3  ASN  70           HB1      ASN  70  93.440   9.102   0.681
  545   HD21  ASN  70          HD21      ASN  70  95.265   6.963   0.378
  546   HD22  ASN  70          HD22      ASN  70  96.782   7.584  -0.058
  547    HA   PRO  71           HA       PRO  71  91.382   4.506   1.505
  548    HB2  PRO  71           HB2      PRO  71  93.097   2.587  -0.018
  549    HB3  PRO  71           HB1      PRO  71  91.416   2.417   0.520
  550    HG2  PRO  71           HG2      PRO  71  92.019   2.927  -2.023
  551    HG3  PRO  71           HG1      PRO  71  90.586   3.625  -1.250
  552    HD2  PRO  71           HD2      PRO  71  93.156   4.946  -1.985
  553    HD3  PRO  71           HD1      PRO  71  91.521   5.633  -1.883
  554    H    LYS  72           H        LYS  72  94.778   4.589   0.482
  555    HA   LYS  72           HA       LYS  72  95.765   3.298   2.846
  556    HB2  LYS  72           HB2      LYS  72  96.926   3.269   0.639
  557    HB3  LYS  72           HB3      LYS  72  97.277   4.983   0.846
  558    HG2  LYS  72           HG2      LYS  72  99.105   4.442   2.055
  559    HG3  LYS  72           HG3      LYS  72  98.057   3.714   3.270
  560    HD2  LYS  72           HD2      LYS  72  98.947   2.240   0.776
  561    HD3  LYS  72           HD3      LYS  72  99.833   2.172   2.299
  562    HE2  LYS  72           HE2      LYS  72  96.926   1.384   1.924
  563    HE3  LYS  72           HE3      LYS  72  98.278   0.265   2.100
  564    HZ1  LYS  72           HZ1      LYS  72  97.185   2.150   4.098
  565    HZ2  LYS  72           HZ2      LYS  72  98.739   1.483   4.258
  566    HZ3  LYS  72           HZ3      LYS  72  97.374   0.470   4.228
  567    H    LYS  73           H        LYS  73  95.785   6.673   1.708
  568    HA   LYS  73           HA       LYS  73  97.160   7.716   3.927
  569    HB2  LYS  73           HB2      LYS  73  96.886   8.898   1.767
  570    HB3  LYS  73           HB3      LYS  73  95.183   9.144   2.143
  571    HG2  LYS  73           HG2      LYS  73  97.005   9.981   4.309
  572    HG3  LYS  73           HG3      LYS  73  97.207  10.895   2.816
  573    HD2  LYS  73           HD2      LYS  73  94.918  11.573   2.803
  574    HD3  LYS  73           HD3      LYS  73  94.492  10.408   4.058
  575    HE2  LYS  73           HE2      LYS  73  95.591  11.642   5.745
  576    HE3  LYS  73           HE3      LYS  73  96.527  12.575   4.575
  577    HZ1  LYS  73           HZ1      LYS  73  94.273  13.414   3.783
  578    HZ2  LYS  73           HZ2      LYS  73  94.858  14.016   5.260
  579    HZ3  LYS  73           HZ3      LYS  73  93.661  12.812   5.246
  580    H    TYR  74           H        TYR  74  93.745   7.020   3.436
  581    HA   TYR  74           HA       TYR  74  92.785   8.582   5.605
  582    HB2  TYR  74           HB2      TYR  74  91.529   7.379   3.603
  583    HB3  TYR  74           HB3      TYR  74  91.360   6.087   4.785
  584    HD1  TYR  74           HD1      TYR  74  91.071   9.831   4.639
  585    HD2  TYR  74           HD2      TYR  74  89.455   6.145   6.143
  586    HE1  TYR  74           HE1      TYR  74  89.226  11.081   5.725
  587    HE2  TYR  74           HE2      TYR  74  87.613   7.397   7.230
  588    HH   TYR  74           HH       TYR  74  87.305  10.921   6.837
  589    H    ILE  75           H        ILE  75  93.293   5.044   5.373
  590    HA   ILE  75           HA       ILE  75  93.752   5.024   8.301
  591    HB   ILE  75           HB       ILE  75  92.618   2.691   6.765
  592   HG12  ILE  75          HG12      ILE  75  91.120   4.934   8.158
  593   HG13  ILE  75          HG13      ILE  75  91.095   4.582   6.432
  594   HG21  ILE  75          HG21      ILE  75  92.374   3.483   9.681
  595   HG22  ILE  75          HG22      ILE  75  93.645   2.425   9.071
  596   HG23  ILE  75          HG23      ILE  75  91.956   1.931   8.953
  597   HD11  ILE  75          HD11      ILE  75  90.058   2.812   8.657
  598   HD12  ILE  75          HD12      ILE  75  90.188   2.304   6.972
  599   HD13  ILE  75          HD13      ILE  75  89.105   3.624   7.415
  600    HA   PRO  76           HA       PRO  76  97.630   3.825   5.867
  601    HB2  PRO  76           HB2      PRO  76  98.525   4.601   8.628
  602    HB3  PRO  76           HB1      PRO  76  99.312   4.901   7.066
  603    HG2  PRO  76           HG2      PRO  76  97.933   6.808   8.322
  604    HG3  PRO  76           HG1      PRO  76  97.933   6.665   6.556
  605    HD2  PRO  76           HD2      PRO  76  95.748   6.078   8.474
  606    HD3  PRO  76           HD1      PRO  76  95.657   6.460   6.742
  607    H    GLY  77           H        GLY  77  98.239   1.742   5.795
  608    HA2  GLY  77           HA2      GLY  77  99.220  -0.176   6.946
  609    HA3  GLY  77           HA3      GLY  77  98.085   0.109   8.263
  610    H    THR  78           H        THR  78  95.919   0.718   6.284
  611    HA   THR  78           HA       THR  78  94.665  -1.767   6.190
  612    HB   THR  78           HB       THR  78  93.525   0.431   5.918
  613    HG1  THR  78           HG1      THR  78  92.868  -0.937   3.606
  614   HG21  THR  78          HG21      THR  78  95.290   1.260   4.282
  615   HG22  THR  78          HG22      THR  78  93.617   1.598   3.840
  616   HG23  THR  78          HG23      THR  78  94.486   0.277   3.060
  617    H    LYS  79           H        LYS  79  94.498  -3.382   4.667
  618    HA   LYS  79           HA       LYS  79  96.651  -3.475   2.701
  619    HB2  LYS  79           HB2      LYS  79  95.785  -5.386   4.309
  620    HB3  LYS  79           HB3      LYS  79  94.639  -5.669   3.002
  621    HG2  LYS  79           HG2      LYS  79  96.354  -6.141   1.440
  622    HG3  LYS  79           HG3      LYS  79  97.601  -5.420   2.458
  623    HD2  LYS  79           HD2      LYS  79  97.276  -7.203   4.127
  624    HD3  LYS  79           HD3      LYS  79  96.044  -7.935   3.099
  625    HE2  LYS  79           HE2      LYS  79  98.964  -7.541   2.383
  626    HE3  LYS  79           HE3      LYS  79  98.181  -9.077   2.754
  627    HZ1  LYS  79           HZ1      LYS  79  96.590  -8.325   0.849
  628    HZ2  LYS  79           HZ2      LYS  79  98.073  -9.070   0.488
  629    HZ3  LYS  79           HZ3      LYS  79  97.918  -7.382   0.375
  630    H    MET  80           H        MET  80  96.004  -2.019   1.106
  631    HA   MET  80           HA       MET  80  94.418  -3.042  -0.978
  632    HB2  MET  80           HB2      MET  80  92.475  -2.585   0.370
  633    HB3  MET  80           HB1      MET  80  93.061  -0.968   0.760
  634    HG2  MET  80           HG2      MET  80  92.739  -0.199  -1.468
  635    HG3  MET  80           HG1      MET  80  92.555  -1.838  -2.090
  636    HE1  MET  80           HE1      MET  80  89.247   0.482  -2.236
  637    HE2  MET  80           HE2      MET  80  90.920   0.458  -2.785
  638    HE3  MET  80           HE3      MET  80  90.502   1.289  -1.290
  639    H    ILE  81           H        ILE  81  96.105  -2.377  -2.259
  640    HA   ILE  81           HA       ILE  81  96.633   0.531  -2.406
  641    HB   ILE  81           HB       ILE  81  98.316  -1.872  -3.133
  642   HG12  ILE  81          HG12      ILE  81  99.934  -0.689  -1.625
  643   HG13  ILE  81          HG13      ILE  81  98.691   0.516  -1.295
  644   HG21  ILE  81          HG21      ILE  81  98.593   1.024  -3.949
  645   HG22  ILE  81          HG22      ILE  81  98.681  -0.412  -4.970
  646   HG23  ILE  81          HG23      ILE  81  99.991  -0.047  -3.848
  647   HD11  ILE  81          HD11      ILE  81  97.479  -0.902   0.036
  648   HD12  ILE  81          HD12      ILE  81  99.047  -1.675   0.244
  649   HD13  ILE  81          HD13      ILE  81  97.893  -2.327  -0.917
  650    H    PHE  82           H        PHE  82  95.104   1.251  -3.827
  651    HA   PHE  82           HA       PHE  82  95.390   0.363  -6.602
  652    HB2  PHE  82           HB2      PHE  82  93.483  -0.917  -5.382
  653    HB3  PHE  82           HB1      PHE  82  92.614   0.615  -5.463
  654    HD1  PHE  82           HD1      PHE  82  94.509  -1.811  -7.594
  655    HD2  PHE  82           HD2      PHE  82  91.468   1.218  -7.429
  656    HE1  PHE  82           HE1      PHE  82  93.916  -2.277  -9.956
  657    HE2  PHE  82           HE2      PHE  82  90.875   0.751  -9.792
  658    HZ   PHE  82           HZ       PHE  82  92.099  -0.996 -11.055
  659    H    ALA  83           H        ALA  83  94.680   1.912  -8.126
  660    HA   ALA  83           HA       ALA  83  95.123   4.582  -7.480
  661    HB1  ALA  83           HB1      ALA  83  94.458   5.101  -9.679
  662    HB2  ALA  83           HB2      ALA  83  93.325   3.751  -9.749
  663    HB3  ALA  83           HB3      ALA  83  95.062   3.448  -9.793
  664    H    GLY  84           H        GLY  84  93.992   5.735  -6.050
  665    HA2  GLY  84           HA2      GLY  84  91.361   5.263  -5.214
  666    HA3  GLY  84           HA3      GLY  84  92.223   6.787  -5.019
  667    H    ILE  85           H        ILE  85  89.775   7.342  -5.373
  668    HA   ILE  85           HA       ILE  85  88.967   7.396  -8.167
  669    HB   ILE  85           HB       ILE  85  87.716   8.494  -5.646
  670   HG12  ILE  85          HG12      ILE  85  87.850   5.927  -6.273
  671   HG13  ILE  85          HG13      ILE  85  86.341   6.609  -5.674
  672   HG21  ILE  85          HG21      ILE  85  86.945   9.944  -7.350
  673   HG22  ILE  85          HG22      ILE  85  85.684   8.718  -7.215
  674   HG23  ILE  85          HG23      ILE  85  86.851   8.639  -8.533
  675   HD11  ILE  85          HD11      ILE  85  86.891   6.575  -8.631
  676   HD12  ILE  85          HD12      ILE  85  85.343   6.613  -7.788
  677   HD13  ILE  85          HD13      ILE  85  86.290   5.127  -7.825
  678    H    LYS  86           H        LYS  86  88.416   9.422  -9.259
  679    HA   LYS  86           HA       LYS  86  90.403  11.499  -8.644
  680    HB2  LYS  86           HB2      LYS  86  90.001  10.293 -10.973
  681    HB3  LYS  86           HB3      LYS  86  88.761  11.532 -11.143
  682    HG2  LYS  86           HG2      LYS  86  90.587  12.666 -12.018
  683    HG3  LYS  86           HG3      LYS  86  90.720  13.134 -10.323
  684    HD2  LYS  86           HD2      LYS  86  92.289  11.218  -9.965
  685    HD3  LYS  86           HD3      LYS  86  92.221  10.884 -11.695
  686    HE2  LYS  86           HE2      LYS  86  93.031  13.206 -12.133
  687    HE3  LYS  86           HE3      LYS  86  93.204  13.441 -10.393
  688    HZ1  LYS  86           HZ1      LYS  86  94.464  11.052 -10.997
  689    HZ2  LYS  86           HZ2      LYS  86  95.194  12.520 -10.550
  690    HZ3  LYS  86           HZ3      LYS  86  94.960  12.149 -12.192
  691    H    LYS  87           H        LYS  87  87.126  11.601 -10.085
  692    HA   LYS  87           HA       LYS  87  86.687  14.217  -8.899
  693    HB2  LYS  87           HB2      LYS  87  84.673  12.594 -10.443
  694    HB3  LYS  87           HB3      LYS  87  84.761  14.345 -10.264
  695    HG2  LYS  87           HG2      LYS  87  87.029  14.216 -11.434
  696    HG3  LYS  87           HG3      LYS  87  86.619  12.548 -11.835
  697    HD2  LYS  87           HD2      LYS  87  85.796  13.619 -13.719
  698    HD3  LYS  87           HD3      LYS  87  84.362  13.665 -12.695
  699    HE2  LYS  87           HE2      LYS  87  85.181  15.940 -11.872
  700    HE3  LYS  87           HE3      LYS  87  86.359  15.885 -13.183
  701    HZ1  LYS  87           HZ1      LYS  87  84.508  17.017 -14.033
  702    HZ2  LYS  87           HZ2      LYS  87  83.406  15.901 -13.380
  703    HZ3  LYS  87           HZ3      LYS  87  84.398  15.454 -14.684
  704    H    LYS  88           H        LYS  88  84.666  14.711  -7.748
  705    HA   LYS  88           HA       LYS  88  84.324  12.972  -5.505
  706    HB2  LYS  88           HB2      LYS  88  84.105  15.501  -5.489
  707    HB3  LYS  88           HB3      LYS  88  82.540  15.286  -6.275
  708    HG2  LYS  88           HG2      LYS  88  81.998  13.661  -4.342
  709    HG3  LYS  88           HG3      LYS  88  83.398  14.359  -3.530
  710    HD2  LYS  88           HD2      LYS  88  81.736  15.772  -2.743
  711    HD3  LYS  88           HD3      LYS  88  82.222  16.652  -4.191
  712    HE2  LYS  88           HE2      LYS  88  80.396  15.585  -5.460
  713    HE3  LYS  88           HE3      LYS  88  79.914  14.690  -4.020
  714    HZ1  LYS  88           HZ1      LYS  88  79.661  17.556  -4.601
  715    HZ2  LYS  88           HZ2      LYS  88  79.842  17.062  -2.986
  716    HZ3  LYS  88           HZ3      LYS  88  78.534  16.493  -3.910
  717    H    THR  89           H        THR  89  82.172  13.946  -8.188
  718    HA   THR  89           HA       THR  89  79.940  12.451  -7.505
  719    HB   THR  89           HB       THR  89  79.463  12.357  -9.958
  720    HG1  THR  89           HG1      THR  89  80.951  13.068 -11.356
  721   HG21  THR  89          HG21      THR  89  78.947  14.336  -8.481
  722   HG22  THR  89          HG22      THR  89  79.167  14.742 -10.184
  723   HG23  THR  89          HG23      THR  89  80.459  15.061  -9.027
  724    H    GLU  90           H        GLU  90  83.009  11.390  -8.766
  725    HA   GLU  90           HA       GLU  90  82.157   8.820  -9.664
  726    HB2  GLU  90           HB2      GLU  90  84.823  10.001  -8.909
  727    HB3  GLU  90           HB3      GLU  90  84.667   8.282  -9.265
  728    HG2  GLU  90           HG2      GLU  90  83.708   8.819 -11.466
  729    HG3  GLU  90           HG3      GLU  90  83.837  10.540 -11.110
  730    H    ARG  91           H        ARG  91  83.353  10.131  -6.618
  731    HA   ARG  91           HA       ARG  91  83.392   7.617  -5.235
  732    HB2  ARG  91           HB2      ARG  91  83.248  10.424  -4.099
  733    HB3  ARG  91           HB3      ARG  91  83.734   8.968  -3.236
  734    HG2  ARG  91           HG2      ARG  91  85.602   8.692  -4.891
  735    HG3  ARG  91           HG3      ARG  91  85.170  10.266  -5.561
  736    HD2  ARG  91           HD2      ARG  91  85.325  10.678  -2.783
  737    HD3  ARG  91           HD3      ARG  91  86.708   9.659  -3.172
  738    HE   ARG  91           HE       ARG  91  86.795  11.584  -5.097
  739   HH11  ARG  91          HH21      ARG  91  86.546  11.601  -1.642
  740   HH12  ARG  91          HH22      ARG  91  87.353  13.122  -1.456
  741   HH21  ARG  91          HH11      ARG  91  87.856  13.575  -4.856
  742   HH22  ARG  91          HH12      ARG  91  88.095  14.238  -3.274
  743    H    GLU  92           H        GLU  92  81.195  10.432  -5.231
  744    HA   GLU  92           HA       GLU  92  79.293   9.413  -3.443
  745    HB2  GLU  92           HB2      GLU  92  79.431  11.774  -4.378
  746    HB3  GLU  92           HB3      GLU  92  78.649  11.151  -5.831
  747    HG2  GLU  92           HG2      GLU  92  76.830  10.231  -4.297
  748    HG3  GLU  92           HG3      GLU  92  77.549  11.203  -3.014
  749    H    ASP  93           H        ASP  93  79.281   9.320  -7.020
  750    HA   ASP  93           HA       ASP  93  76.978   7.737  -7.306
  751    HB2  ASP  93           HB2      ASP  93  79.430   7.956  -9.069
  752    HB3  ASP  93           HB1      ASP  93  77.936   7.149  -9.541
  753    H    LEU  94           H        LEU  94  80.412   6.790  -7.252
  754    HA   LEU  94           HA       LEU  94  80.094   4.030  -7.472
  755    HB2  LEU  94           HB2      LEU  94  82.292   5.081  -7.602
  756    HB3  LEU  94           HB3      LEU  94  82.163   5.592  -5.921
  757    HG   LEU  94           HG       LEU  94  82.133   3.283  -5.165
  758   HD11  LEU  94          HD11      LEU  94  82.695   1.557  -7.060
  759   HD12  LEU  94          HD12      LEU  94  81.957   2.759  -8.116
  760   HD13  LEU  94          HD13      LEU  94  81.022   2.047  -6.802
  761   HD21  LEU  94          HD21      LEU  94  84.344   3.659  -7.203
  762   HD22  LEU  94          HD22      LEU  94  84.403   2.671  -5.746
  763   HD23  LEU  94          HD23      LEU  94  84.323   4.426  -5.615
  764    H    ILE  95           H        ILE  95  79.933   6.135  -4.660
  765    HA   ILE  95           HA       ILE  95  79.700   3.991  -2.796
  766    HB   ILE  95           HB       ILE  95  79.411   6.967  -2.630
  767   HG12  ILE  95          HG12      ILE  95  81.085   5.359  -0.770
  768   HG13  ILE  95          HG13      ILE  95  81.555   5.279  -2.462
  769   HG21  ILE  95          HG21      ILE  95  78.444   4.903  -0.671
  770   HG22  ILE  95          HG22      ILE  95  77.722   6.452  -1.101
  771   HG23  ILE  95          HG23      ILE  95  79.146   6.401  -0.062
  772   HD11  ILE  95          HD11      ILE  95  82.375   7.231  -0.750
  773   HD12  ILE  95          HD12      ILE  95  80.966   8.004  -1.469
  774   HD13  ILE  95          HD13      ILE  95  82.280   7.430  -2.494
  775    H    ALA  96           H        ALA  96  77.494   5.870  -4.713
  776    HA   ALA  96           HA       ALA  96  75.111   5.285  -3.292
  777    HB1  ALA  96           HB1      ALA  96  73.959   6.050  -5.217
  778    HB2  ALA  96           HB2      ALA  96  75.293   5.616  -6.285
  779    HB3  ALA  96           HB3      ALA  96  75.453   6.985  -5.187
  780    H    TYR  97           H        TYR  97  77.002   3.581  -5.713
  781    HA   TYR  97           HA       TYR  97  75.081   1.471  -6.097
  782    HB2  TYR  97           HB2      TYR  97  76.642   1.960  -7.887
  783    HB3  TYR  97           HB3      TYR  97  78.015   1.679  -6.817
  784    HD1  TYR  97           HD1      TYR  97  75.063   0.028  -8.388
  785    HD2  TYR  97           HD2      TYR  97  78.848  -0.515  -6.435
  786    HE1  TYR  97           HE1      TYR  97  74.993  -2.390  -8.928
  787    HE2  TYR  97           HE2      TYR  97  78.778  -2.934  -6.973
  788    HH   TYR  97           HH       TYR  97  76.436  -4.262  -9.151
  789    H    LEU  98           H        LEU  98  78.185   1.798  -4.361
  790    HA   LEU  98           HA       LEU  98  78.380  -0.762  -3.310
  791    HB2  LEU  98           HB2      LEU  98  79.270   1.934  -2.335
  792    HB3  LEU  98           HB3      LEU  98  79.508   0.517  -1.321
  793    HG   LEU  98           HG       LEU  98  80.362   0.378  -4.199
  794   HD11  LEU  98          HD11      LEU  98  82.145   1.499  -2.031
  795   HD12  LEU  98          HD12      LEU  98  81.282   2.523  -3.177
  796   HD13  LEU  98          HD13      LEU  98  82.482   1.377  -3.756
  797   HD21  LEU  98          HD21      LEU  98  81.879  -1.251  -3.363
  798   HD22  LEU  98          HD22      LEU  98  80.379  -1.541  -2.480
  799   HD23  LEU  98          HD23      LEU  98  81.705  -0.673  -1.708
  800    H    LYS  99           H        LYS  99  76.160   1.778  -2.545
  801    HA   LYS  99           HA       LYS  99  75.424   0.747   0.055
  802    HB2  LYS  99           HB2      LYS  99  74.359   2.914  -1.741
  803    HB3  LYS  99           HB3      LYS  99  73.459   2.396  -0.315
  804    HG2  LYS  99           HG2      LYS  99  75.382   2.892   1.118
  805    HG3  LYS  99           HG3      LYS  99  76.342   3.333  -0.293
  806    HD2  LYS  99           HD2      LYS  99  75.484   5.361   0.762
  807    HD3  LYS  99           HD3      LYS  99  74.708   5.142  -0.806
  808    HE2  LYS  99           HE2      LYS  99  72.666   4.517   0.142
  809    HE3  LYS  99           HE3      LYS  99  73.410   4.004   1.656
  810    HZ1  LYS  99           HZ1      LYS  99  73.581   6.823   0.844
  811    HZ2  LYS  99           HZ2      LYS  99  73.589   6.149   2.403
  812    HZ3  LYS  99           HZ3      LYS  99  72.139   6.246   1.525
  813    H    LYS 100           H        LYS 100  73.769   0.961  -3.105
  814    HA   LYS 100           HA       LYS 100  71.609  -0.732  -2.275
  815    HB2  LYS 100           HB2      LYS 100  72.518   0.387  -4.917
  816    HB3  LYS 100           HB3      LYS 100  71.213  -0.797  -4.836
  817    HG2  LYS 100           HG2      LYS 100  69.879   0.633  -3.452
  818    HG3  LYS 100           HG3      LYS 100  71.229   1.735  -3.178
  819    HD2  LYS 100           HD2      LYS 100  71.173   2.536  -5.414
  820    HD3  LYS 100           HD3      LYS 100  70.153   1.199  -5.950
  821    HE2  LYS 100           HE2      LYS 100  69.207   3.159  -3.857
  822    HE3  LYS 100           HE3      LYS 100  69.002   3.479  -5.579
  823    HZ1  LYS 100           HZ1      LYS 100  68.208   0.834  -4.722
  824    HZ2  LYS 100           HZ2      LYS 100  67.425   1.920  -5.769
  825    HZ3  LYS 100           HZ3      LYS 100  67.267   2.093  -4.086
  826    H    ALA 101           H        ALA 101  74.789  -1.295  -3.366
  827    HA   ALA 101           HA       ALA 101  74.255  -3.956  -4.418
  828    HB1  ALA 101           HB1      ALA 101  76.898  -2.581  -3.874
  829    HB2  ALA 101           HB2      ALA 101  76.024  -2.517  -5.405
  830    HB3  ALA 101           HB3      ALA 101  76.656  -4.054  -4.813
  831    H    THR 102           H        THR 102  75.456  -2.429  -1.494
  832    HA   THR 102           HA       THR 102  76.153  -5.018  -0.312
  833    HB   THR 102           HB       THR 102  76.915  -3.652   1.609
  834    HG1  THR 102           HG1      THR 102  75.500  -1.764   0.203
  835   HG21  THR 102          HG21      THR 102  78.578  -4.063  -0.026
  836   HG22  THR 102          HG22      THR 102  78.659  -2.325   0.265
  837   HG23  THR 102          HG23      THR 102  77.845  -2.943  -1.172
  838    H    ASN 103           H        ASN 103  73.435  -3.223  -0.759
  839    HA   ASN 103           HA       ASN 103  72.198  -4.018   1.802
  840    HB2  ASN 103           HB2      ASN 103  71.527  -1.945  -0.275
  841    HB3  ASN 103           HB1      ASN 103  70.329  -2.487   0.891
  842   HD21  ASN 103          HD21      ASN 103  73.747  -2.333   1.749
  843   HD22  ASN 103          HD22      ASN 103  73.596  -1.020   2.812
  844    H    GLU 104           H        GLU 104  72.275  -4.593  -1.595
  845    HA   GLU 104           HA       GLU 104  70.841  -5.770  -3.017
  846    HB2  GLU 104           HB2      GLU 104  71.350  -7.674  -0.721
  847    HB3  GLU 104           HB3      GLU 104  70.767  -8.151  -2.316
  848    HG2  GLU 104           HG2      GLU 104  72.841  -6.940  -3.245
  849    HG3  GLU 104           HG3      GLU 104  73.442  -6.953  -1.589
  850    HHA  HEC 201           HA       HEC 105  89.309  -3.500   3.186
  851    HHB  HEC 201           HB       HEC 105  85.631   0.118  -0.468
  852    HHC  HEC 201           HC       HEC 105  88.831  -1.808  -5.576
  853    HHD  HEC 201           HD       HEC 105  92.132  -5.828  -1.975
  854   HMA1  HEC 201          HMA1      HEC 105  84.692  -0.075   1.536
  855   HMA2  HEC 201          HMA2      HEC 105  85.866   0.960   2.349
  856   HMA3  HEC 201          HMA3      HEC 105  85.127  -0.389   3.212
  857   HAA1  HEC 201          HAA1      HEC 105  86.870  -0.924   4.466
  858   HAA2  HEC 201          HAA2      HEC 105  88.390  -1.794   4.441
  859   HBA1  HEC 201          HBA1      HEC 105  87.357  -3.878   4.552
  860   HBA2  HEC 201          HBA2      HEC 105  85.826  -3.269   3.934
  861   HMB1  HEC 201          HMB1      HEC 105  84.216   0.291  -2.696
  862   HMB2  HEC 201          HMB2      HEC 105  84.899   1.235  -4.015
  863   HMB3  HEC 201          HMB3      HEC 105  85.277   1.655  -2.348
  864    HAB  HEC 201           HAB      HEC 105  87.356  -0.584  -6.243
  865   HBB1  HEC 201          HBB1      HEC 105  86.353   1.861  -6.558
  866   HBB2  HEC 201          HBB2      HEC 105  86.821   2.014  -4.866
  867   HBB3  HEC 201          HBB3      HEC 105  88.031   1.619  -6.080
  868   HMC1  HEC 201          HMC1      HEC 105  91.321  -2.674  -6.682
  869   HMC2  HEC 201          HMC2      HEC 105  89.741  -3.421  -6.903
  870   HMC3  HEC 201          HMC3      HEC 105  91.191  -4.416  -6.918
  871    HAC  HEC 201           HAC      HEC 105  92.608  -6.243  -3.894
  872   HBC1  HEC 201          HBC1      HEC 105  94.297  -5.039  -4.860
  873   HBC2  HEC 201          HBC2      HEC 105  93.193  -4.104  -5.868
  874   HBC3  HEC 201          HBC3      HEC 105  93.660  -5.735  -6.349
  875   HMD1  HEC 201          HMD1      HEC 105  93.589  -6.203   0.467
  876   HMD2  HEC 201          HMD2      HEC 105  92.396  -7.287  -0.242
  877   HMD3  HEC 201          HMD3      HEC 105  92.577  -7.203   1.505
  878   HAD1  HEC 201          HAD1      HEC 105  91.883  -6.284   3.200
  879   HAD2  HEC 201          HAD2      HEC 105  90.334  -5.616   3.670
  880   HBD1  HEC 201          HBD1      HEC 105  91.483  -3.347   3.778
  881   HBD2  HEC 201          HBD2      HEC 105  93.005  -4.214   3.615
  882    H1   HOH 301           H2       HOH 200  79.970   3.502  -0.841
  883    H2   HOH 301           H1       HOH 200  80.726   2.232  -0.507
  884    H1   HOH 302           H2       HOH 201  86.034   4.946   5.742
  885    H2   HOH 302           H1       HOH 201  87.359   5.672   5.633
  886    H1   HOH 303           H2       HOH 202  81.671  -6.078   5.987
  887    H2   HOH 303           H1       HOH 202  83.000  -5.734   5.350
  888    H1   HOH 304           H2       HOH 203  81.948  -9.702   0.147
  889    H2   HOH 304           H1       HOH 203  80.844 -10.737   0.198
  Start of MODEL   15
    1    H1   GLY   1           H1       GLY   1  74.735   8.983  -5.383
    2    H2   GLY   1           H2       GLY   1  76.002   9.387  -6.440
    3    H3   GLY   1           H3       GLY   1  74.986   8.073  -6.792
    4    HA2  GLY   1           HA2      GLY   1  73.298  10.231  -6.487
    5    HA3  GLY   1           HA3      GLY   1  74.660  10.810  -7.449
    6    H    ASP   2           H        ASP   2  75.217   8.085  -8.474
    7    HA   ASP   2           HA       ASP   2  72.852   7.562 -10.152
    8    HB2  ASP   2           HB2      ASP   2  75.629   8.194 -11.164
    9    HB3  ASP   2           HB1      ASP   2  74.381   7.427 -12.144
   10    H    VAL   3           H        VAL   3  72.663   5.657  -8.888
   11    HA   VAL   3           HA       VAL   3  74.554   3.737  -8.352
   12    HB   VAL   3           HB       VAL   3  72.245   3.592  -7.556
   13   HG11  VAL   3          HG11      VAL   3  71.520   2.818 -10.395
   14   HG12  VAL   3          HG12      VAL   3  71.251   4.427  -9.724
   15   HG13  VAL   3          HG13      VAL   3  70.419   3.034  -9.034
   16   HG21  VAL   3          HG21      VAL   3  72.738   1.190  -9.327
   17   HG22  VAL   3          HG22      VAL   3  72.008   1.231  -7.722
   18   HG23  VAL   3          HG23      VAL   3  73.735   1.520  -7.912
   19    H    GLU   4           H        GLU   4  73.365   4.736 -11.417
   20    HA   GLU   4           HA       GLU   4  73.913   2.308 -12.845
   21    HB2  GLU   4           HB2      GLU   4  73.716   5.123 -13.934
   22    HB3  GLU   4           HB3      GLU   4  73.544   3.622 -14.844
   23    HG2  GLU   4           HG2      GLU   4  71.581   3.030 -13.421
   24    HG3  GLU   4           HG3      GLU   4  71.720   4.599 -12.628
   25    H    LYS   5           H        LYS   5  75.564   5.483 -12.840
   26    HA   LYS   5           HA       LYS   5  77.884   4.432 -14.155
   27    HB2  LYS   5           HB2      LYS   5  77.208   7.040 -12.810
   28    HB3  LYS   5           HB3      LYS   5  78.868   6.692 -13.290
   29    HG2  LYS   5           HG2      LYS   5  78.272   6.477 -15.586
   30    HG3  LYS   5           HG3      LYS   5  76.551   6.402 -15.210
   31    HD2  LYS   5           HD2      LYS   5  78.082   8.840 -14.368
   32    HD3  LYS   5           HD3      LYS   5  77.664   8.663 -16.071
   33    HE2  LYS   5           HE2      LYS   5  75.346   8.648 -15.627
   34    HE3  LYS   5           HE3      LYS   5  75.585   8.284 -13.920
   35    HZ1  LYS   5           HZ1      LYS   5  76.008  10.424 -13.425
   36    HZ2  LYS   5           HZ2      LYS   5  75.102  10.723 -14.831
   37    HZ3  LYS   5           HZ3      LYS   5  76.800  10.738 -14.892
   38    H    GLY   6           H        GLY   6  76.755   4.511 -10.928
   39    HA2  GLY   6           HA2      GLY   6  79.294   4.348  -9.602
   40    HA3  GLY   6           HA3      GLY   6  77.725   3.931  -8.907
   41    H    LYS   7           H        LYS   7  77.000   2.127 -11.026
   42    HA   LYS   7           HA       LYS   7  78.157  -0.281 -10.027
   43    HB2  LYS   7           HB2      LYS   7  75.815  -0.000 -10.984
   44    HB3  LYS   7           HB3      LYS   7  76.568   0.031 -12.578
   45    HG2  LYS   7           HG2      LYS   7  77.737  -2.177 -11.784
   46    HG3  LYS   7           HG3      LYS   7  76.439  -2.227 -10.594
   47    HD2  LYS   7           HD2      LYS   7  75.436  -3.401 -12.325
   48    HD3  LYS   7           HD3      LYS   7  74.916  -1.763 -12.725
   49    HE2  LYS   7           HE2      LYS   7  76.857  -1.542 -14.260
   50    HE3  LYS   7           HE3      LYS   7  77.323  -3.202 -13.887
   51    HZ1  LYS   7           HZ1      LYS   7  75.275  -2.233 -15.639
   52    HZ2  LYS   7           HZ2      LYS   7  74.695  -3.397 -14.545
   53    HZ3  LYS   7           HZ3      LYS   7  76.002  -3.765 -15.567
   54    H    LYS   8           H        LYS   8  78.514   1.607 -13.021
   55    HA   LYS   8           HA       LYS   8  80.203  -0.161 -14.402
   56    HB2  LYS   8           HB2      LYS   8  79.182   1.757 -15.498
   57    HB3  LYS   8           HB3      LYS   8  80.098   2.863 -14.475
   58    HG2  LYS   8           HG2      LYS   8  81.739   0.864 -15.926
   59    HG3  LYS   8           HG3      LYS   8  80.920   2.035 -16.956
   60    HD2  LYS   8           HD2      LYS   8  82.419   2.979 -14.519
   61    HD3  LYS   8           HD3      LYS   8  83.292   2.616 -16.007
   62    HE2  LYS   8           HE2      LYS   8  80.858   4.389 -16.069
   63    HE3  LYS   8           HE3      LYS   8  82.433   5.049 -15.632
   64    HZ1  LYS   8           HZ1      LYS   8  83.260   3.943 -17.736
   65    HZ2  LYS   8           HZ2      LYS   8  82.275   5.313 -17.932
   66    HZ3  LYS   8           HZ3      LYS   8  81.630   3.759 -18.168
   67    H    ILE   9           H        ILE   9  81.023   2.572 -12.274
   68    HA   ILE   9           HA       ILE   9  83.825   2.233 -12.429
   69    HB   ILE   9           HB       ILE   9  82.144   3.487 -10.250
   70   HG12  ILE   9          HG12      ILE   9  83.672   4.877 -12.458
   71   HG13  ILE   9          HG13      ILE   9  81.998   4.366 -12.676
   72   HG21  ILE   9          HG21      ILE   9  84.289   4.731  -9.788
   73   HG22  ILE   9          HG22      ILE   9  85.105   3.618 -10.885
   74   HG23  ILE   9          HG23      ILE   9  84.360   3.012  -9.406
   75   HD11  ILE   9          HD11      ILE   9  82.072   6.696 -11.908
   76   HD12  ILE   9          HD12      ILE   9  83.021   6.216 -10.501
   77   HD13  ILE   9          HD13      ILE   9  81.352   5.671 -10.667
   78    H    PHE  10           H        PHE  10  81.364   0.622 -10.587
   79    HA   PHE  10           HA       PHE  10  83.159  -0.395  -8.573
   80    HB2  PHE  10           HB2      PHE  10  80.988  -0.269  -7.768
   81    HB3  PHE  10           HB1      PHE  10  80.283  -0.827  -9.284
   82    HD1  PHE  10           HD1      PHE  10  80.238  -3.201  -9.862
   83    HD2  PHE  10           HD2      PHE  10  81.921  -1.848  -6.153
   84    HE1  PHE  10           HE1      PHE  10  80.233  -5.531  -9.015
   85    HE2  PHE  10           HE2      PHE  10  81.920  -4.178  -5.303
   86    HZ   PHE  10           HZ       PHE  10  81.076  -6.021  -6.738
   87    H    VAL  11           H        VAL  11  81.434  -1.906 -11.318
   88    HA   VAL  11           HA       VAL  11  82.449  -4.476 -11.033
   89    HB   VAL  11           HB       VAL  11  81.987  -4.759 -13.452
   90   HG11  VAL  11          HG11      VAL  11  79.825  -3.108 -12.144
   91   HG12  VAL  11          HG12      VAL  11  80.208  -4.745 -11.616
   92   HG13  VAL  11          HG13      VAL  11  79.634  -4.459 -13.258
   93   HG21  VAL  11          HG21      VAL  11  82.770  -2.480 -14.125
   94   HG22  VAL  11          HG22      VAL  11  81.343  -1.801 -13.344
   95   HG23  VAL  11          HG23      VAL  11  81.162  -2.857 -14.741
   96    H    GLN  12           H        GLN  12  83.931  -1.627 -12.398
   97    HA   GLN  12           HA       GLN  12  86.170  -3.210 -13.430
   98    HB2  GLN  12           HB2      GLN  12  86.892  -1.204 -14.523
   99    HB3  GLN  12           HB1      GLN  12  85.158  -1.384 -14.782
  100    HG2  GLN  12           HG2      GLN  12  84.780   0.148 -12.819
  101    HG3  GLN  12           HG1      GLN  12  86.521   0.431 -12.780
  102   HE21  GLN  12          HE21      GLN  12  85.919  -0.062 -15.975
  103   HE22  GLN  12          HE22      GLN  12  85.619   1.531 -16.467
  104    H    LYS  13           H        LYS  13  85.468  -1.079 -10.715
  105    HA   LYS  13           HA       LYS  13  88.346  -0.949 -10.097
  106    HB2  LYS  13           HB2      LYS  13  86.009   0.574  -8.950
  107    HB3  LYS  13           HB3      LYS  13  87.660   0.710  -8.360
  108    HG2  LYS  13           HG2      LYS  13  88.102   1.076 -11.016
  109    HG3  LYS  13           HG3      LYS  13  86.472   1.730 -10.890
  110    HD2  LYS  13           HD2      LYS  13  87.162   3.287  -9.167
  111    HD3  LYS  13           HD3      LYS  13  88.765   2.554  -9.089
  112    HE2  LYS  13           HE2      LYS  13  89.318   3.307 -11.292
  113    HE3  LYS  13           HE3      LYS  13  87.649   3.776 -11.620
  114    HZ1  LYS  13           HZ1      LYS  13  89.293   5.594 -10.967
  115    HZ2  LYS  13           HZ2      LYS  13  89.167   4.977  -9.390
  116    HZ3  LYS  13           HZ3      LYS  13  87.789   5.578 -10.183
  117    H    CYS  14           H        CYS  14  85.384  -1.452  -8.119
  118    HA   CYS  14           HA       CYS  14  87.008  -2.735  -6.094
  119    HB2  CYS  14           HB2      CYS  14  84.037  -2.602  -5.930
  120    HB3  CYS  14           HB1      CYS  14  85.234  -2.432  -4.652
  121    H    ALA  15           H        ALA  15  84.520  -3.860  -8.370
  122    HA   ALA  15           HA       ALA  15  83.970  -6.339  -7.308
  123    HB1  ALA  15           HB1      ALA  15  83.873  -7.105  -9.774
  124    HB2  ALA  15           HB2      ALA  15  84.289  -5.436 -10.156
  125    HB3  ALA  15           HB3      ALA  15  82.807  -5.794  -9.269
  126    H    GLN  16           H        GLN  16  86.935  -5.231  -8.742
  127    HA   GLN  16           HA       GLN  16  88.212  -7.526  -9.517
  128    HB2  GLN  16           HB2      GLN  16  89.022  -4.891  -8.562
  129    HB3  GLN  16           HB1      GLN  16  90.207  -6.134  -8.164
  130    HG2  GLN  16           HG2      GLN  16  90.140  -6.880 -10.558
  131    HG3  GLN  16           HG1      GLN  16  89.084  -5.513 -10.912
  132   HE21  GLN  16          HE21      GLN  16  90.530  -3.731  -8.962
  133   HE22  GLN  16          HE22      GLN  16  91.997  -3.341  -9.720
  134    H    CYS  17           H        CYS  17  88.568  -6.168  -6.206
  135    HA   CYS  17           HA       CYS  17  88.964  -8.950  -5.255
  136    HB2  CYS  17           HB2      CYS  17  90.112  -6.765  -3.626
  137    HB3  CYS  17           HB1      CYS  17  90.787  -8.337  -4.041
  138    H    HIS  18           H        HSD  18  86.363  -8.027  -5.305
  139    HA   HIS  18           HA       HSD  18  85.750  -8.056  -2.466
  140    HB2  HIS  18           HB2      HSD  18  85.131  -5.669  -4.194
  141    HB3  HIS  18           HB1      HSD  18  84.158  -6.055  -2.776
  142    HD1  HIS  18           HD1      HSD  18  86.649  -7.127  -1.053
  143    HD2  HIS  18           HD2      HSD  18  86.414  -3.454  -3.009
  144    HE1  HIS  18           HE1      HSD  18  88.286  -5.584   0.116
  145    H    THR  19           H        THR  19  83.173  -7.704  -2.312
  146    HA   THR  19           HA       THR  19  81.880  -9.209  -4.496
  147    HB   THR  19           HB       THR  19  80.765 -10.087  -2.020
  148    HG1  THR  19           HG1      THR  19  83.366 -10.933  -1.977
  149   HG21  THR  19          HG21      THR  19  82.608 -11.518  -3.954
  150   HG22  THR  19          HG22      THR  19  80.868 -11.329  -4.175
  151   HG23  THR  19          HG23      THR  19  81.488 -12.276  -2.822
  152    H    VAL  20           H        VAL  20  81.541  -7.217  -1.602
  153    HA   VAL  20           HA       VAL  20  79.804  -5.916  -0.829
  154    HB   VAL  20           HB       VAL  20  79.148  -4.190  -2.387
  155   HG11  VAL  20          HG11      VAL  20  81.994  -5.114  -2.884
  156   HG12  VAL  20          HG12      VAL  20  81.454  -4.140  -1.518
  157   HG13  VAL  20          HG13      VAL  20  81.382  -3.482  -3.150
  158   HG21  VAL  20          HG21      VAL  20  78.718  -5.847  -4.285
  159   HG22  VAL  20          HG22      VAL  20  80.455  -5.811  -4.573
  160   HG23  VAL  20          HG23      VAL  20  79.505  -4.339  -4.741
  161    H    GLU  21           H        GLU  21  78.975  -8.628  -1.637
  162    HA   GLU  21           HA       GLU  21  76.135  -8.009  -2.195
  163    HB2  GLU  21           HB2      GLU  21  75.911  -9.887  -3.604
  164    HB3  GLU  21           HB3      GLU  21  77.412  -9.120  -4.120
  165    HG2  GLU  21           HG2      GLU  21  78.552 -10.726  -2.421
  166    HG3  GLU  21           HG3      GLU  21  77.038 -11.627  -2.499
  167    H    LYS  22           H        LYS  22  74.906  -8.504  -0.529
  168    HA   LYS  22           HA       LYS  22  75.673  -9.720   1.817
  169    HB2  LYS  22           HB2      LYS  22  72.989  -9.444   0.480
  170    HB3  LYS  22           HB3      LYS  22  73.143 -10.262   2.034
  171    HG2  LYS  22           HG2      LYS  22  74.435  -7.572   1.685
  172    HG3  LYS  22           HG3      LYS  22  72.691  -7.650   1.932
  173    HD2  LYS  22           HD2      LYS  22  73.080  -9.024   3.982
  174    HD3  LYS  22           HD3      LYS  22  74.817  -8.808   3.761
  175    HE2  LYS  22           HE2      LYS  22  74.193  -7.109   5.295
  176    HE3  LYS  22           HE3      LYS  22  74.327  -6.281   3.743
  177    HZ1  LYS  22           HZ1      LYS  22  71.839  -7.226   5.056
  178    HZ2  LYS  22           HZ2      LYS  22  71.905  -6.624   3.469
  179    HZ3  LYS  22           HZ3      LYS  22  72.302  -5.618   4.779
  180    H    GLY  23           H        GLY  23  75.497 -11.781   2.697
  181    HA2  GLY  23           HA2      GLY  23  75.771 -14.066   2.676
  182    HA3  GLY  23           HA3      GLY  23  74.381 -14.056   1.596
  183    H    GLY  24           H        GLY  24  77.408 -12.486   0.778
  184    HA2  GLY  24           HA2      GLY  24  77.672 -14.242  -1.547
  185    HA3  GLY  24           HA3      GLY  24  78.541 -12.738  -1.268
  186    H    LYS  25           H        LYS  25  80.588 -13.471  -1.576
  187    HA   LYS  25           HA       LYS  25  81.730 -15.065   0.582
  188    HB2  LYS  25           HB2      LYS  25  82.992 -16.453  -1.177
  189    HB3  LYS  25           HB3      LYS  25  81.307 -16.875  -0.874
  190    HG2  LYS  25           HG2      LYS  25  81.704 -14.815  -2.968
  191    HG3  LYS  25           HG3      LYS  25  82.349 -16.405  -3.368
  192    HD2  LYS  25           HD2      LYS  25  80.170 -17.434  -2.869
  193    HD3  LYS  25           HD3      LYS  25  79.516 -15.854  -2.438
  194    HE2  LYS  25           HE2      LYS  25  78.834 -16.191  -4.687
  195    HE3  LYS  25           HE3      LYS  25  80.220 -15.105  -4.796
  196    HZ1  LYS  25           HZ1      LYS  25  81.105 -17.780  -4.786
  197    HZ2  LYS  25           HZ2      LYS  25  81.298 -16.600  -5.993
  198    HZ3  LYS  25           HZ3      LYS  25  79.920 -17.595  -5.985
  199    H    HIS  26           H        HIS  26  83.386 -13.888   1.264
  200    HA   HIS  26           HA       HIS  26  84.521 -11.709  -0.038
  201    HB2  HIS  26           HB2      HIS  26  86.545 -12.339   1.567
  202    HB3  HIS  26           HB1      HIS  26  85.023 -11.729   2.216
  203    HD1  HIS  26           HD1      HIS  26  85.863 -15.237   0.981
  204    HD2  HIS  26           HD2      HIS  26  84.624 -13.303   4.461
  205    HE1  HIS  26           HE1      HIS  26  85.401 -17.054   2.686
  206    HE2  HIS  26           HE2      HIS  26  84.645 -15.891   4.812
  207    H    LYS  27           H        LYS  27  85.818 -11.528  -1.727
  208    HA   LYS  27           HA       LYS  27  87.487 -13.849  -2.517
  209    HB2  LYS  27           HB2      LYS  27  85.974 -11.830  -4.169
  210    HB3  LYS  27           HB3      LYS  27  87.320 -12.750  -4.843
  211    HG2  LYS  27           HG2      LYS  27  86.198 -14.853  -4.292
  212    HG3  LYS  27           HG3      LYS  27  84.877 -13.972  -3.526
  213    HD2  LYS  27           HD2      LYS  27  84.323 -12.906  -5.673
  214    HD3  LYS  27           HD3      LYS  27  85.662 -13.754  -6.448
  215    HE2  LYS  27           HE2      LYS  27  83.301 -15.096  -5.099
  216    HE3  LYS  27           HE3      LYS  27  83.497 -14.902  -6.840
  217    HZ1  LYS  27           HZ1      LYS  27  84.359 -16.983  -6.503
  218    HZ2  LYS  27           HZ2      LYS  27  85.003 -16.602  -4.977
  219    HZ3  LYS  27           HZ3      LYS  27  85.765 -16.042  -6.389
  220    H    THR  28           H        THR  28  89.580 -13.475  -2.161
  221    HA   THR  28           HA       THR  28  91.538 -12.320  -1.730
  222    HB   THR  28           HB       THR  28  90.738 -10.617  -4.082
  223    HG1  THR  28           HG1      THR  28  90.770 -12.307  -5.311
  224   HG21  THR  28          HG21      THR  28  93.405 -11.910  -3.678
  225   HG22  THR  28          HG22      THR  28  92.994 -10.524  -2.669
  226   HG23  THR  28          HG23      THR  28  93.016 -10.362  -4.424
  227    H    GLY  29           H        GLY  29  89.061 -11.287  -0.469
  228    HA2  GLY  29           HA2      GLY  29  90.041  -9.097   0.897
  229    HA3  GLY  29           HA3      GLY  29  89.138  -8.431  -0.460
  230    HA   PRO  30           HA       PRO  30  86.346  -9.914   3.153
  231    HB2  PRO  30           HB2      PRO  30  85.924  -7.522   4.431
  232    HB3  PRO  30           HB1      PRO  30  87.203  -8.664   4.888
  233    HG2  PRO  30           HG2      PRO  30  87.383  -6.179   3.252
  234    HG3  PRO  30           HG1      PRO  30  88.498  -6.805   4.480
  235    HD2  PRO  30           HD2      PRO  30  88.966  -7.070   1.801
  236    HD3  PRO  30           HD1      PRO  30  89.532  -8.257   2.997
  237    H    ASN  31           H        ASN  31  84.085  -9.004   3.608
  238    HA   ASN  31           HA       ASN  31  82.959  -8.022   1.079
  239    HB2  ASN  31           HB2      ASN  31  80.887  -8.894   1.829
  240    HB3  ASN  31           HB1      ASN  31  82.086 -10.082   2.337
  241   HD21  ASN  31          HD21      ASN  31  83.024  -8.167   4.536
  242   HD22  ASN  31          HD22      ASN  31  81.841  -8.309   5.744
  243    H    LEU  32           H        LEU  32  81.129  -6.425   1.271
  244    HA   LEU  32           HA       LEU  32  81.707  -4.425   3.383
  245    HB2  LEU  32           HB2      LEU  32  80.627  -3.775   0.641
  246    HB3  LEU  32           HB3      LEU  32  81.268  -2.663   1.842
  247    HG   LEU  32           HG       LEU  32  82.815  -4.708   0.228
  248   HD11  LEU  32          HD11      LEU  32  83.566  -1.830   0.395
  249   HD12  LEU  32          HD12      LEU  32  82.076  -2.195  -0.469
  250   HD13  LEU  32          HD13      LEU  32  83.595  -2.923  -0.990
  251   HD21  LEU  32          HD21      LEU  32  84.740  -3.345   1.526
  252   HD22  LEU  32          HD22      LEU  32  84.051  -4.828   2.173
  253   HD23  LEU  32          HD23      LEU  32  83.485  -3.268   2.758
  254    H    HIS  33           H        HIS  33  79.804  -6.547   3.645
  255    HA   HIS  33           HA       HIS  33  77.166  -5.738   3.011
  256    HB2  HIS  33           HB2      HIS  33  78.128  -7.490   5.287
  257    HB3  HIS  33           HB1      HIS  33  76.469  -7.388   4.696
  258    HD1  HIS  33           HD1      HIS  33  77.668 -10.114   4.509
  259    HD2  HIS  33           HD2      HIS  33  78.196  -7.292   1.486
  260    HE1  HIS  33           HE1      HIS  33  78.237 -11.412   2.410
  261    HE2  HIS  33           HE2      HIS  33  78.557  -9.706   0.557
  262    H    GLY  34           H        GLY  34  75.684  -4.490   4.099
  263    HA2  GLY  34           HA2      GLY  34  75.136  -2.600   5.360
  264    HA3  GLY  34           HA3      GLY  34  75.447  -3.732   6.674
  265    H    LEU  35           H        LEU  35  77.937  -2.727   4.477
  266    HA   LEU  35           HA       LEU  35  79.907  -2.134   6.245
  267    HB2  LEU  35           HB2      LEU  35  80.305  -2.199   3.868
  268    HB3  LEU  35           HB3      LEU  35  79.269  -0.802   3.608
  269    HG   LEU  35           HG       LEU  35  81.012   0.304   5.345
  270   HD11  LEU  35          HD11      LEU  35  82.869  -1.430   3.759
  271   HD12  LEU  35          HD12      LEU  35  82.202  -2.053   5.267
  272   HD13  LEU  35          HD13      LEU  35  83.163  -0.575   5.269
  273   HD21  LEU  35          HD21      LEU  35  80.426   1.015   2.989
  274   HD22  LEU  35          HD22      LEU  35  81.692  -0.070   2.419
  275   HD23  LEU  35          HD23      LEU  35  82.105   1.303   3.445
  276    H    PHE  36           H        PHE  36  77.763   0.323   4.824
  277    HA   PHE  36           HA       PHE  36  78.634   2.504   6.305
  278    HB2  PHE  36           HB2      PHE  36  75.755   2.104   5.494
  279    HB3  PHE  36           HB1      PHE  36  76.654   3.616   5.622
  280    HD1  PHE  36           HD2      PHE  36  76.403   0.430   3.703
  281    HD2  PHE  36           HD1      PHE  36  77.969   4.433   3.798
  282    HE1  PHE  36           HE2      PHE  36  77.122   0.209   1.343
  283    HE2  PHE  36           HE1      PHE  36  78.673   4.210   1.441
  284    HZ   PHE  36           HZ       PHE  36  78.253   2.101   0.207
  285    H    GLY  37           H        GLY  37  79.010   1.939   8.484
  286    HA2  GLY  37           HA2      GLY  37  77.513   2.687  10.478
  287    HA3  GLY  37           HA3      GLY  37  76.643   1.213  10.084
  288    H    ARG  38           H        ARG  38  79.320  -0.090   9.361
  289    HA   ARG  38           HA       ARG  38  79.877  -0.980  12.090
  290    HB2  ARG  38           HB2      ARG  38  80.249  -2.077   9.377
  291    HB3  ARG  38           HB3      ARG  38  81.527  -2.478  10.523
  292    HG2  ARG  38           HG2      ARG  38  79.676  -3.178  12.142
  293    HG3  ARG  38           HG3      ARG  38  78.567  -3.054  10.776
  294    HD2  ARG  38           HD2      ARG  38  81.085  -4.656  10.460
  295    HD3  ARG  38           HD3      ARG  38  79.735  -5.358  11.342
  296    HE   ARG  38           HE       ARG  38  78.511  -4.527   9.104
  297   HH11  ARG  38          HH21      ARG  38  81.501  -6.216   9.613
  298   HH12  ARG  38          HH22      ARG  38  81.420  -7.075   8.113
  299   HH21  ARG  38          HH11      ARG  38  78.407  -5.671   7.150
  300   HH22  ARG  38          HH12      ARG  38  79.674  -6.774   6.725
  301    H    LYS  39           H        LYS  39  82.034  -1.272  12.888
  302    HA   LYS  39           HA       LYS  39  83.691   1.058  12.429
  303    HB2  LYS  39           HB2      LYS  39  83.157   0.119  14.700
  304    HB3  LYS  39           HB3      LYS  39  84.165  -1.266  14.298
  305    HG2  LYS  39           HG2      LYS  39  85.684   0.102  15.418
  306    HG3  LYS  39           HG3      LYS  39  85.982   0.553  13.746
  307    HD2  LYS  39           HD2      LYS  39  85.802   2.577  15.078
  308    HD3  LYS  39           HD3      LYS  39  84.391   2.470  14.030
  309    HE2  LYS  39           HE2      LYS  39  84.075   1.167  16.673
  310    HE3  LYS  39           HE3      LYS  39  84.250   2.921  16.719
  311    HZ1  LYS  39           HZ1      LYS  39  82.239   3.200  15.855
  312    HZ2  LYS  39           HZ2      LYS  39  81.962   1.553  16.166
  313    HZ3  LYS  39           HZ3      LYS  39  82.499   2.053  14.634
  314    H    THR  40           H        THR  40  85.899   1.030  11.874
  315    HA   THR  40           HA       THR  40  86.674  -0.438   9.693
  316    HB   THR  40           HB       THR  40  89.039   0.182  10.376
  317    HG1  THR  40           HG1      THR  40  87.635   1.497  12.455
  318   HG21  THR  40          HG21      THR  40  88.456   2.695  10.287
  319   HG22  THR  40          HG22      THR  40  86.776   2.166  10.190
  320   HG23  THR  40          HG23      THR  40  87.923   1.690   8.938
  321    H    GLY  41           H        GLY  41  87.798  -2.268   9.265
  322    HA2  GLY  41           HA2      GLY  41  88.394  -4.467   9.564
  323    HA3  GLY  41           HA3      GLY  41  89.331  -3.841  10.916
  324    H    GLN  42           H        GLN  42  85.837  -4.237  10.328
  325    HA   GLN  42           HA       GLN  42  85.672  -5.679  12.915
  326    HB2  GLN  42           HB2      GLN  42  84.508  -3.525  12.952
  327    HB3  GLN  42           HB1      GLN  42  83.562  -4.002  11.542
  328    HG2  GLN  42           HG2      GLN  42  82.357  -5.621  12.729
  329    HG3  GLN  42           HG1      GLN  42  83.584  -5.754  13.987
  330   HE21  GLN  42          HE21      GLN  42  81.582  -3.067  12.616
  331   HE22  GLN  42          HE22      GLN  42  81.128  -2.452  14.131
  332    H    ALA  43           H        ALA  43  85.086  -5.879   9.522
  333    HA   ALA  43           HA       ALA  43  83.026  -7.821   9.547
  334    HB1  ALA  43           HB1      ALA  43  83.137  -7.509   7.327
  335    HB2  ALA  43           HB2      ALA  43  84.783  -8.132   7.274
  336    HB3  ALA  43           HB3      ALA  43  84.498  -6.422   7.601
  337    HA   PRO  44           HA       PRO  44  85.694 -11.178  10.916
  338    HB2  PRO  44           HB2      PRO  44  83.788 -13.078  11.200
  339    HB3  PRO  44           HB1      PRO  44  83.936 -11.719  12.334
  340    HG2  PRO  44           HG2      PRO  44  82.030 -12.093  10.071
  341    HG3  PRO  44           HG1      PRO  44  81.741 -11.436  11.691
  342    HD2  PRO  44           HD2      PRO  44  82.110  -9.873   9.442
  343    HD3  PRO  44           HD1      PRO  44  82.444  -9.324  11.100
  344    H    GLY  45           H        GLY  45  86.990 -11.870   9.256
  345    HA2  GLY  45           HA2      GLY  45  86.498 -14.154   7.800
  346    HA3  GLY  45           HA3      GLY  45  85.974 -12.837   6.756
  347    H    PHE  46           H        PHE  46  87.544 -11.188   6.188
  348    HA   PHE  46           HA       PHE  46  90.077 -12.313   5.497
  349    HB2  PHE  46           HB2      PHE  46  88.755 -10.540   4.212
  350    HB3  PHE  46           HB1      PHE  46  89.364  -9.382   5.395
  351    HD1  PHE  46           HD1      PHE  46  90.403 -11.897   2.855
  352    HD2  PHE  46           HD2      PHE  46  91.599  -8.571   5.295
  353    HE1  PHE  46           HE1      PHE  46  92.551 -11.765   1.622
  354    HE2  PHE  46           HE2      PHE  46  93.747  -8.439   4.062
  355    HZ   PHE  46           HZ       PHE  46  94.223 -10.037   2.225
  356    H    THR  47           H        THR  47  92.161 -11.579   6.134
  357    HA   THR  47           HA       THR  47  92.368 -11.051   8.960
  358    HB   THR  47           HB       THR  47  94.645 -11.040   6.986
  359    HG1  THR  47           HG1      THR  47  93.493 -12.902   6.586
  360   HG21  THR  47          HG21      THR  47  95.824 -12.027   8.964
  361   HG22  THR  47          HG22      THR  47  94.355 -11.782   9.908
  362   HG23  THR  47          HG23      THR  47  95.223 -10.394   9.250
  363    H    TYR  48           H        TYR  48  91.361  -8.965   9.070
  364    HA   TYR  48           HA       TYR  48  92.155  -6.684   7.657
  365    HB2  TYR  48           HB2      TYR  48  90.821  -7.192  10.279
  366    HB3  TYR  48           HB3      TYR  48  91.402  -5.563   9.958
  367    HD1  TYR  48           HD2      TYR  48  90.875  -4.703   7.477
  368    HD2  TYR  48           HD1      TYR  48  88.643  -7.692   9.601
  369    HE1  TYR  48           HE2      TYR  48  88.903  -4.241   6.054
  370    HE2  TYR  48           HE1      TYR  48  86.670  -7.225   8.177
  371    HH   TYR  48           HH       TYR  48  86.288  -4.532   6.394
  372    H    THR  49           H        THR  49  93.538  -4.957   8.211
  373    HA   THR  49           HA       THR  49  95.994  -5.813   9.515
  374    HB   THR  49           HB       THR  49  96.908  -3.700   8.709
  375    HG1  THR  49           HG1      THR  49  95.647  -2.126   8.001
  376   HG21  THR  49          HG21      THR  49  96.435  -4.000   6.269
  377   HG22  THR  49          HG22      THR  49  95.145  -5.125   6.699
  378   HG23  THR  49          HG23      THR  49  96.821  -5.511   7.094
  379    H    ASP  50           H        ASP  50  96.969  -4.718  11.277
  380    HA   ASP  50           HA       ASP  50  95.416  -4.210  13.482
  381    HB2  ASP  50           HB2      ASP  50  97.808  -4.503  13.680
  382    HB3  ASP  50           HB1      ASP  50  98.104  -3.018  12.776
  383    H    ALA  51           H        ALA  51  96.540  -1.857  11.068
  384    HA   ALA  51           HA       ALA  51  95.669   0.496  12.247
  385    HB1  ALA  51           HB1      ALA  51  95.600  -0.290   9.325
  386    HB2  ALA  51           HB2      ALA  51  96.925   0.516  10.168
  387    HB3  ALA  51           HB3      ALA  51  95.392   1.354   9.928
  388    H    ASN  52           H        ASN  52  93.826  -1.552   9.975
  389    HA   ASN  52           HA       ASN  52  91.374  -0.156  10.333
  390    HB2  ASN  52           HB2      ASN  52  92.249  -2.704   9.067
  391    HB3  ASN  52           HB1      ASN  52  90.545  -2.580   9.491
  392   HD21  ASN  52          HD21      ASN  52  90.164  -2.573   7.085
  393   HD22  ASN  52          HD22      ASN  52  90.344  -1.111   6.237
  394    H    LYS  53           H        LYS  53  93.021  -2.622  12.103
  395    HA   LYS  53           HA       LYS  53  90.721  -3.510  13.598
  396    HB2  LYS  53           HB2      LYS  53  93.157  -4.615  13.005
  397    HB3  LYS  53           HB3      LYS  53  93.430  -4.051  14.652
  398    HG2  LYS  53           HG2      LYS  53  91.438  -5.241  15.412
  399    HG3  LYS  53           HG3      LYS  53  91.109  -5.770  13.761
  400    HD2  LYS  53           HD2      LYS  53  93.332  -6.916  13.733
  401    HD3  LYS  53           HD3      LYS  53  93.541  -6.480  15.429
  402    HE2  LYS  53           HE2      LYS  53  92.168  -8.150  16.128
  403    HE3  LYS  53           HE3      LYS  53  90.956  -7.774  14.904
  404    HZ1  LYS  53           HZ1      LYS  53  93.454  -9.007  14.018
  405    HZ2  LYS  53           HZ2      LYS  53  91.877  -9.189  13.411
  406    HZ3  LYS  53           HZ3      LYS  53  92.340  -9.990  14.837
  407    H    ASN  54           H        ASN  54  92.936  -0.945  13.694
  408    HA   ASN  54           HA       ASN  54  93.128  -0.505  16.476
  409    HB2  ASN  54           HB2      ASN  54  94.235   1.411  15.899
  410    HB3  ASN  54           HB1      ASN  54  94.355   0.564  14.364
  411   HD21  ASN  54          HD21      ASN  54  91.621   0.959  13.491
  412   HD22  ASN  54          HD22      ASN  54  91.411   2.615  13.189
  413    H    LYS  55           H        LYS  55  90.597  -0.066  14.246
  414    HA   LYS  55           HA       LYS  55  88.454   0.774  14.437
  415    HB2  LYS  55           HB2      LYS  55  89.068   0.636  17.399
  416    HB3  LYS  55           HB3      LYS  55  87.466   0.822  16.688
  417    HG2  LYS  55           HG2      LYS  55  87.416  -1.361  15.883
  418    HG3  LYS  55           HG3      LYS  55  89.173  -1.485  15.810
  419    HD2  LYS  55           HD2      LYS  55  88.245  -2.848  17.659
  420    HD3  LYS  55           HD3      LYS  55  89.289  -1.562  18.264
  421    HE2  LYS  55           HE2      LYS  55  87.383  -0.195  18.848
  422    HE3  LYS  55           HE3      LYS  55  86.277  -1.315  18.054
  423    HZ1  LYS  55           HZ1      LYS  55  87.485  -1.466  20.659
  424    HZ2  LYS  55           HZ2      LYS  55  87.614  -2.909  19.773
  425    HZ3  LYS  55           HZ3      LYS  55  86.088  -2.223  20.068
  426    H    GLY  56           H        GLY  56  89.809   2.705  13.546
  427    HA2  GLY  56           HA2      GLY  56  90.047   4.946  15.382
  428    HA3  GLY  56           HA3      GLY  56  90.474   4.941  13.676
  429    H    ILE  57           H        ILE  57  88.005   4.047  12.605
  430    HA   ILE  57           HA       ILE  57  86.006   5.983  13.532
  431    HB   ILE  57           HB       ILE  57  85.743   6.973  11.313
  432   HG12  ILE  57          HG12      ILE  57  87.826   6.459   9.745
  433   HG13  ILE  57          HG13      ILE  57  87.857   4.940  10.635
  434   HG21  ILE  57          HG21      ILE  57  87.697   8.357  11.358
  435   HG22  ILE  57          HG22      ILE  57  88.663   7.080  12.097
  436   HG23  ILE  57          HG23      ILE  57  87.393   7.876  13.027
  437   HD11  ILE  57          HD11      ILE  57  85.221   5.858   9.545
  438   HD12  ILE  57          HD12      ILE  57  85.845   4.222   9.748
  439   HD13  ILE  57          HD13      ILE  57  86.410   5.219   8.413
  440    H    THR  58           H        THR  58  84.078   5.850  11.819
  441    HA   THR  58           HA       THR  58  83.525   2.971  11.408
  442    HB   THR  58           HB       THR  58  81.764   5.223  12.355
  443    HG1  THR  58           HG1      THR  58  82.189   4.189  14.113
  444   HG21  THR  58          HG21      THR  58  81.021   2.742  10.858
  445   HG22  THR  58          HG22      THR  58  80.245   4.325  10.860
  446   HG23  THR  58          HG23      THR  58  80.004   3.222  12.215
  447    H    TRP  59           H        TRP  59  82.670   2.317   9.486
  448    HA   TRP  59           HA       TRP  59  83.082   3.935   7.198
  449    HB2  TRP  59           HB2      TRP  59  81.259   1.535   7.256
  450    HB3  TRP  59           HB1      TRP  59  82.271   2.121   5.933
  451    HD1  TRP  59           HD1      TRP  59  84.978   2.510   7.457
  452    HE1  TRP  59           HE1      TRP  59  86.314   0.460   8.268
  453    HE3  TRP  59           HE3      TRP  59  81.270  -0.991   7.570
  454    HZ2  TRP  59           HZ2      TRP  59  85.857  -2.301   8.912
  455    HZ3  TRP  59           HZ3      TRP  59  81.745  -3.316   8.275
  456    HH2  TRP  59           HH2      TRP  59  84.034  -3.971   8.947
  457    H    LYS  60           H        LYS  60  81.746   5.178   6.019
  458    HA   LYS  60           HA       LYS  60  78.873   5.190   6.467
  459    HB2  LYS  60           HB2      LYS  60  80.606   7.591   7.116
  460    HB3  LYS  60           HB3      LYS  60  78.852   7.645   6.949
  461    HG2  LYS  60           HG2      LYS  60  78.784   5.783   8.719
  462    HG3  LYS  60           HG3      LYS  60  80.478   6.168   9.023
  463    HD2  LYS  60           HD2      LYS  60  78.323   8.290   9.061
  464    HD3  LYS  60           HD3      LYS  60  78.750   7.363  10.498
  465    HE2  LYS  60           HE2      LYS  60  81.136   8.081  10.174
  466    HE3  LYS  60           HE3      LYS  60  80.592   9.131   8.866
  467    HZ1  LYS  60           HZ1      LYS  60  80.691   9.799  11.493
  468    HZ2  LYS  60           HZ2      LYS  60  79.049   9.430  11.264
  469    HZ3  LYS  60           HZ3      LYS  60  79.798  10.613  10.303
  470    H    GLU  61           H        GLU  61  78.333   7.631   5.189
  471    HA   GLU  61           HA       GLU  61  78.866   6.890   2.460
  472    HB2  GLU  61           HB2      GLU  61  76.709   7.868   3.106
  473    HB3  GLU  61           HB3      GLU  61  77.524   9.353   3.603
  474    HG2  GLU  61           HG2      GLU  61  78.234   9.814   1.354
  475    HG3  GLU  61           HG3      GLU  61  77.722   8.221   0.803
  476    H    GLU  62           H        GLU  62  79.549   9.858   4.332
  477    HA   GLU  62           HA       GLU  62  81.327  10.925   2.383
  478    HB2  GLU  62           HB2      GLU  62  80.931  11.565   5.314
  479    HB3  GLU  62           HB3      GLU  62  81.977  12.492   4.237
  480    HG2  GLU  62           HG2      GLU  62  79.067  11.967   3.608
  481    HG3  GLU  62           HG3      GLU  62  79.593  13.376   4.527
  482    H    THR  63           H        THR  63  81.837   9.132   5.407
  483    HA   THR  63           HA       THR  63  84.610   9.292   5.576
  484    HB   THR  63           HB       THR  63  84.494   7.159   6.805
  485    HG1  THR  63           HG1      THR  63  82.744   6.460   5.226
  486   HG21  THR  63          HG21      THR  63  82.319   9.190   7.294
  487   HG22  THR  63          HG22      THR  63  83.891   9.068   8.084
  488   HG23  THR  63          HG23      THR  63  82.643   7.866   8.410
  489    H    LEU  64           H        LEU  64  82.557   7.221   3.611
  490    HA   LEU  64           HA       LEU  64  84.654   5.568   2.615
  491    HB2  LEU  64           HB2      LEU  64  81.792   5.887   2.202
  492    HB3  LEU  64           HB3      LEU  64  82.634   5.585   0.691
  493    HG   LEU  64           HG       LEU  64  83.038   3.898   3.171
  494   HD11  LEU  64          HD11      LEU  64  80.906   3.886   1.121
  495   HD12  LEU  64          HD12      LEU  64  80.913   3.201   2.742
  496   HD13  LEU  64          HD13      LEU  64  81.657   2.319   1.410
  497   HD21  LEU  64          HD21      LEU  64  83.968   3.807   0.310
  498   HD22  LEU  64          HD22      LEU  64  83.721   2.290   1.173
  499   HD23  LEU  64          HD23      LEU  64  84.871   3.474   1.787
  500    H    MET  65           H        MET  65  83.211   8.622   1.602
  501    HA   MET  65           HA       MET  65  84.299   8.751  -0.992
  502    HB2  MET  65           HB2      MET  65  83.618  10.976   0.935
  503    HB3  MET  65           HB1      MET  65  83.993  11.211  -0.771
  504    HG2  MET  65           HG2      MET  65  82.093   9.934  -1.459
  505    HG3  MET  65           HG1      MET  65  81.808   9.355   0.182
  506    HE1  MET  65           HE1      MET  65  81.881  12.390  -2.214
  507    HE2  MET  65           HE2      MET  65  80.292  13.050  -1.835
  508    HE3  MET  65           HE3      MET  65  80.437  11.380  -2.376
  509    H    GLU  66           H        GLU  66  85.524  10.295   1.992
  510    HA   GLU  66           HA       GLU  66  87.933  11.211   0.865
  511    HB2  GLU  66           HB2      GLU  66  87.519  10.380   3.745
  512    HB3  GLU  66           HB3      GLU  66  88.686  11.549   3.126
  513    HG2  GLU  66           HG2      GLU  66  86.644  12.834   2.216
  514    HG3  GLU  66           HG3      GLU  66  85.682  11.809   3.279
  515    H    TYR  67           H        TYR  67  86.947   8.134   2.143
  516    HA   TYR  67           HA       TYR  67  89.599   6.998   2.254
  517    HB2  TYR  67           HB2      TYR  67  87.987   6.096   3.762
  518    HB3  TYR  67           HB3      TYR  67  86.814   5.864   2.473
  519    HD1  TYR  67           HD2      TYR  67  87.033   4.031   0.866
  520    HD2  TYR  67           HD1      TYR  67  89.866   4.562   4.049
  521    HE1  TYR  67           HE2      TYR  67  87.895   1.738   0.482
  522    HE2  TYR  67           HE1      TYR  67  90.727   2.268   3.666
  523    HH   TYR  67           HH       TYR  67  89.802   0.398   0.895
  524    H    LEU  68           H        LEU  68  87.042   7.297  -0.088
  525    HA   LEU  68           HA       LEU  68  88.027   5.241  -1.849
  526    HB2  LEU  68           HB2      LEU  68  85.788   7.174  -1.811
  527    HB3  LEU  68           HB3      LEU  68  86.387   6.763  -3.412
  528    HG   LEU  68           HG       LEU  68  85.630   4.707  -1.318
  529   HD11  LEU  68          HD11      LEU  68  83.572   5.673  -1.834
  530   HD12  LEU  68          HD12      LEU  68  83.674   4.391  -3.037
  531   HD13  LEU  68          HD13      LEU  68  84.039   6.057  -3.489
  532   HD21  LEU  68          HD21      LEU  68  86.638   4.624  -4.130
  533   HD22  LEU  68          HD22      LEU  68  85.418   3.444  -3.670
  534   HD23  LEU  68          HD23      LEU  68  86.941   3.520  -2.792
  535    H    GLU  69           H        GLU  69  88.765   8.557  -1.278
  536    HA   GLU  69           HA       GLU  69  90.007   8.891  -3.914
  537    HB2  GLU  69           HB2      GLU  69  89.878  11.143  -3.562
  538    HB3  GLU  69           HB3      GLU  69  88.655  10.669  -2.388
  539    HG2  GLU  69           HG2      GLU  69  90.507  10.561  -0.655
  540    HG3  GLU  69           HG3      GLU  69  91.568  11.303  -1.851
  541    H    ASN  70           H        ASN  70  90.809   7.796  -0.832
  542    HA   ASN  70           HA       ASN  70  93.546   7.392  -1.503
  543    HB2  ASN  70           HB2      ASN  70  93.252   9.931  -0.800
  544    HB3  ASN  70           HB1      ASN  70  93.298   9.258   0.825
  545   HD21  ASN  70          HD21      ASN  70  95.170   7.158   0.463
  546   HD22  ASN  70          HD22      ASN  70  96.674   7.827   0.049
  547    HA   PRO  71           HA       PRO  71  91.342   4.641   1.630
  548    HB2  PRO  71           HB2      PRO  71  93.020   2.733   0.053
  549    HB3  PRO  71           HB1      PRO  71  91.349   2.563   0.621
  550    HG2  PRO  71           HG2      PRO  71  91.905   3.091  -1.930
  551    HG3  PRO  71           HG1      PRO  71  90.488   3.785  -1.122
  552    HD2  PRO  71           HD2      PRO  71  93.051   5.109  -1.891
  553    HD3  PRO  71           HD1      PRO  71  91.417   5.797  -1.764
  554    H    LYS  72           H        LYS  72  94.707   4.759   0.520
  555    HA   LYS  72           HA       LYS  72  95.784   3.437   2.821
  556    HB2  LYS  72           HB2      LYS  72  96.895   3.487   0.598
  557    HB3  LYS  72           HB3      LYS  72  97.191   5.210   0.819
  558    HG2  LYS  72           HG2      LYS  72  99.054   4.740   2.001
  559    HG3  LYS  72           HG3      LYS  72  98.077   3.894   3.197
  560    HD2  LYS  72           HD2      LYS  72  98.996   2.595   0.620
  561    HD3  LYS  72           HD3      LYS  72  99.920   2.511   2.119
  562    HE2  LYS  72           HE2      LYS  72  97.101   1.489   1.670
  563    HE3  LYS  72           HE3      LYS  72  98.546   0.521   1.962
  564    HZ1  LYS  72           HZ1      LYS  72  97.118   2.301   3.837
  565    HZ2  LYS  72           HZ2      LYS  72  98.730   1.838   4.111
  566    HZ3  LYS  72           HZ3      LYS  72  97.508   0.661   4.024
  567    H    LYS  73           H        LYS  73  95.686   6.846   1.789
  568    HA   LYS  73           HA       LYS  73  97.089   7.857   4.010
  569    HB2  LYS  73           HB2      LYS  73  96.743   9.102   1.894
  570    HB3  LYS  73           HB3      LYS  73  95.041   9.291   2.308
  571    HG2  LYS  73           HG2      LYS  73  96.912  10.110   4.452
  572    HG3  LYS  73           HG3      LYS  73  97.007  11.087   2.989
  573    HD2  LYS  73           HD2      LYS  73  94.564  11.457   3.078
  574    HD3  LYS  73           HD3      LYS  73  94.474  10.494   4.552
  575    HE2  LYS  73           HE2      LYS  73  94.567  12.761   5.285
  576    HE3  LYS  73           HE3      LYS  73  96.189  12.117   5.542
  577    HZ1  LYS  73           HZ1      LYS  73  96.634  14.068   4.460
  578    HZ2  LYS  73           HZ2      LYS  73  95.237  13.996   3.495
  579    HZ3  LYS  73           HZ3      LYS  73  96.568  12.998   3.145
  580    H    TYR  74           H        TYR  74  93.665   7.148   3.539
  581    HA   TYR  74           HA       TYR  74  92.708   8.608   5.770
  582    HB2  TYR  74           HB2      TYR  74  91.493   7.294   3.748
  583    HB3  TYR  74           HB3      TYR  74  91.293   6.102   5.031
  584    HD1  TYR  74           HD1      TYR  74  91.035   9.821   4.551
  585    HD2  TYR  74           HD2      TYR  74  89.398   6.297   6.386
  586    HE1  TYR  74           HE1      TYR  74  89.195  11.176   5.515
  587    HE2  TYR  74           HE2      TYR  74  87.559   7.654   7.347
  588    HH   TYR  74           HH       TYR  74  87.601  10.802   7.728
  589    H    ILE  75           H        ILE  75  93.301   5.097   5.449
  590    HA   ILE  75           HA       ILE  75  93.884   5.026   8.351
  591    HB   ILE  75           HB       ILE  75  92.422   2.884   6.787
  592   HG12  ILE  75          HG12      ILE  75  91.264   4.661   8.941
  593   HG13  ILE  75          HG13      ILE  75  91.195   5.118   7.241
  594   HG21  ILE  75          HG21      ILE  75  91.944   2.132   9.209
  595   HG22  ILE  75          HG22      ILE  75  93.255   3.214   9.676
  596   HG23  ILE  75          HG23      ILE  75  93.573   1.858   8.594
  597   HD11  ILE  75          HD11      ILE  75  90.114   2.536   8.405
  598   HD12  ILE  75          HD12      ILE  75  90.040   3.010   6.708
  599   HD13  ILE  75          HD13      ILE  75  89.143   3.926   7.920
  600    HA   PRO  76           HA       PRO  76  97.535   3.690   5.670
  601    HB2  PRO  76           HB2      PRO  76  98.635   4.368   8.383
  602    HB3  PRO  76           HB1      PRO  76  99.337   4.666   6.780
  603    HG2  PRO  76           HG2      PRO  76  98.128   6.608   8.156
  604    HG3  PRO  76           HG1      PRO  76  98.015   6.504   6.391
  605    HD2  PRO  76           HD2      PRO  76  95.925   5.974   8.427
  606    HD3  PRO  76           HD1      PRO  76  95.742   6.396   6.711
  607    H    GLY  77           H        GLY  77  98.774   1.770   5.859
  608    HA2  GLY  77           HA2      GLY  77  99.479  -0.243   6.857
  609    HA3  GLY  77           HA3      GLY  77  98.368   0.051   8.192
  610    H    THR  78           H        THR  78  96.175   0.701   6.275
  611    HA   THR  78           HA       THR  78  94.889  -1.771   6.163
  612    HB   THR  78           HB       THR  78  93.751   0.428   5.964
  613    HG1  THR  78           HG1      THR  78  93.148  -0.947   3.613
  614   HG21  THR  78          HG21      THR  78  94.739   0.376   3.108
  615   HG22  THR  78          HG22      THR  78  95.492   1.345   4.375
  616   HG23  THR  78          HG23      THR  78  93.821   1.654   3.904
  617    H    LYS  79           H        LYS  79  94.674  -3.354   4.600
  618    HA   LYS  79           HA       LYS  79  96.786  -3.374   2.574
  619    HB2  LYS  79           HB2      LYS  79  95.833  -5.331   4.210
  620    HB3  LYS  79           HB3      LYS  79  94.918  -5.667   2.745
  621    HG2  LYS  79           HG2      LYS  79  96.861  -6.909   2.376
  622    HG3  LYS  79           HG3      LYS  79  97.249  -5.398   1.553
  623    HD2  LYS  79           HD2      LYS  79  98.238  -4.662   3.847
  624    HD3  LYS  79           HD3      LYS  79  98.212  -6.382   4.236
  625    HE2  LYS  79           HE2      LYS  79  99.638  -5.084   1.897
  626    HE3  LYS  79           HE3      LYS  79 100.391  -5.819   3.311
  627    HZ1  LYS  79           HZ1      LYS  79  98.856  -7.818   2.469
  628    HZ2  LYS  79           HZ2      LYS  79 100.467  -7.606   1.976
  629    HZ3  LYS  79           HZ3      LYS  79  99.195  -7.073   0.984
  630    H    MET  80           H        MET  80  96.049  -1.904   1.040
  631    HA   MET  80           HA       MET  80  94.416  -2.928  -1.014
  632    HB2  MET  80           HB2      MET  80  92.508  -2.501   0.385
  633    HB3  MET  80           HB1      MET  80  93.099  -0.890   0.793
  634    HG2  MET  80           HG2      MET  80  92.702  -0.067  -1.399
  635    HG3  MET  80           HG1      MET  80  92.538  -1.690  -2.066
  636    HE1  MET  80           HE1      MET  80  89.165   0.594  -2.032
  637    HE2  MET  80           HE2      MET  80  90.789   0.551  -2.713
  638    HE3  MET  80           HE3      MET  80  90.506   1.371  -1.182
  639    H    ILE  81           H        ILE  81  96.049  -2.239  -2.342
  640    HA   ILE  81           HA       ILE  81  96.297   0.689  -2.689
  641    HB   ILE  81           HB       ILE  81  98.513  -1.365  -2.929
  642   HG12  ILE  81          HG12      ILE  81  99.435   0.312  -1.093
  643   HG13  ILE  81          HG13      ILE  81  97.725   0.651  -0.836
  644   HG21  ILE  81          HG21      ILE  81  99.887   0.782  -3.197
  645   HG22  ILE  81          HG22      ILE  81  98.355   1.601  -3.497
  646   HG23  ILE  81          HG23      ILE  81  98.892   0.313  -4.576
  647   HD11  ILE  81          HD11      ILE  81  97.781  -1.143   0.554
  648   HD12  ILE  81          HD12      ILE  81  99.291  -1.740  -0.131
  649   HD13  ILE  81          HD13      ILE  81  97.759  -2.112  -0.918
  650    H    PHE  82           H        PHE  82  95.269   1.116  -4.545
  651    HA   PHE  82           HA       PHE  82  96.060  -0.370  -6.949
  652    HB2  PHE  82           HB2      PHE  82  94.053  -1.527  -6.303
  653    HB3  PHE  82           HB1      PHE  82  93.204  -0.008  -6.018
  654    HD1  PHE  82           HD1      PHE  82  95.224  -1.594  -8.765
  655    HD2  PHE  82           HD2      PHE  82  91.730   0.663  -7.693
  656    HE1  PHE  82           HE1      PHE  82  94.525  -1.544 -11.144
  657    HE2  PHE  82           HE2      PHE  82  91.031   0.713 -10.071
  658    HZ   PHE  82           HZ       PHE  82  92.429  -0.391 -11.797
  659    H    ALA  83           H        ALA  83  93.325   1.826  -6.570
  660    HA   ALA  83           HA       ALA  83  94.788   4.143  -7.471
  661    HB1  ALA  83           HB1      ALA  83  93.392   4.359  -9.576
  662    HB2  ALA  83           HB2      ALA  83  92.949   2.666  -9.360
  663    HB3  ALA  83           HB3      ALA  83  94.636   3.110  -9.621
  664    H    GLY  84           H        GLY  84  93.896   5.598  -6.149
  665    HA2  GLY  84           HA2      GLY  84  91.304   5.438  -5.041
  666    HA3  GLY  84           HA3      GLY  84  92.325   6.873  -5.050
  667    H    ILE  85           H        ILE  85  89.792   7.468  -5.296
  668    HA   ILE  85           HA       ILE  85  88.965   7.492  -8.096
  669    HB   ILE  85           HB       ILE  85  87.690   8.553  -5.571
  670   HG12  ILE  85          HG12      ILE  85  87.869   5.992  -6.223
  671   HG13  ILE  85          HG13      ILE  85  86.354   6.644  -5.611
  672   HG21  ILE  85          HG21      ILE  85  86.852   8.721  -8.463
  673   HG22  ILE  85          HG22      ILE  85  86.891  10.003  -7.252
  674   HG23  ILE  85          HG23      ILE  85  85.661   8.741  -7.163
  675   HD11  ILE  85          HD11      ILE  85  86.883   6.657  -8.571
  676   HD12  ILE  85          HD12      ILE  85  85.341   6.637  -7.715
  677   HD13  ILE  85          HD13      ILE  85  86.330   5.180  -7.782
  678    H    LYS  86           H        LYS  86  88.427   9.493  -9.200
  679    HA   LYS  86           HA       LYS  86  90.357  11.614  -8.557
  680    HB2  LYS  86           HB2      LYS  86  88.912  10.768 -11.049
  681    HB3  LYS  86           HB3      LYS  86  89.579  12.397 -10.925
  682    HG2  LYS  86           HG2      LYS  86  91.799  11.452 -10.404
  683    HG3  LYS  86           HG3      LYS  86  91.135   9.823 -10.532
  684    HD2  LYS  86           HD2      LYS  86  90.681  10.087 -12.864
  685    HD3  LYS  86           HD3      LYS  86  90.968  11.826 -12.792
  686    HE2  LYS  86           HE2      LYS  86  93.347  11.366 -12.183
  687    HE3  LYS  86           HE3      LYS  86  93.036   9.644 -12.396
  688    HZ1  LYS  86           HZ1      LYS  86  93.326   9.875 -14.563
  689    HZ2  LYS  86           HZ2      LYS  86  93.687  11.521 -14.348
  690    HZ3  LYS  86           HZ3      LYS  86  92.087  11.031 -14.645
  691    H    LYS  87           H        LYS  87  87.119  11.679 -10.069
  692    HA   LYS  87           HA       LYS  87  86.607  14.273  -8.876
  693    HB2  LYS  87           HB2      LYS  87  84.794  12.551 -10.575
  694    HB3  LYS  87           HB3      LYS  87  84.581  14.263 -10.210
  695    HG2  LYS  87           HG2      LYS  87  86.629  14.826 -11.387
  696    HG3  LYS  87           HG3      LYS  87  86.996  13.120 -11.643
  697    HD2  LYS  87           HD2      LYS  87  84.326  13.732 -12.618
  698    HD3  LYS  87           HD3      LYS  87  85.511  14.809 -13.355
  699    HE2  LYS  87           HE2      LYS  87  86.837  12.928 -14.117
  700    HE3  LYS  87           HE3      LYS  87  85.809  11.795 -13.239
  701    HZ1  LYS  87           HZ1      LYS  87  85.303  13.218 -15.732
  702    HZ2  LYS  87           HZ2      LYS  87  83.979  13.016 -14.686
  703    HZ3  LYS  87           HZ3      LYS  87  84.830  11.660 -15.256
  704    H    LYS  88           H        LYS  88  84.555  14.736  -7.777
  705    HA   LYS  88           HA       LYS  88  84.190  13.002  -5.535
  706    HB2  LYS  88           HB2      LYS  88  83.925  15.323  -5.127
  707    HB3  LYS  88           HB3      LYS  88  82.808  15.514  -6.474
  708    HG2  LYS  88           HG2      LYS  88  81.963  13.551  -4.403
  709    HG3  LYS  88           HG3      LYS  88  82.016  15.229  -3.867
  710    HD2  LYS  88           HD2      LYS  88  80.696  15.754  -6.044
  711    HD3  LYS  88           HD3      LYS  88  80.366  14.023  -6.088
  712    HE2  LYS  88           HE2      LYS  88  78.535  14.940  -4.901
  713    HE3  LYS  88           HE3      LYS  88  79.590  14.295  -3.644
  714    HZ1  LYS  88           HZ1      LYS  88  80.593  16.594  -3.562
  715    HZ2  LYS  88           HZ2      LYS  88  79.016  16.444  -2.950
  716    HZ3  LYS  88           HZ3      LYS  88  79.272  17.113  -4.491
  717    H    THR  89           H        THR  89  82.100  13.904  -8.295
  718    HA   THR  89           HA       THR  89  79.869  12.383  -7.647
  719    HB   THR  89           HB       THR  89  79.436  12.266 -10.093
  720    HG1  THR  89           HG1      THR  89  81.106  13.621 -11.258
  721   HG21  THR  89          HG21      THR  89  78.849  14.268  -8.749
  722   HG22  THR  89          HG22      THR  89  79.268  14.690 -10.410
  723   HG23  THR  89          HG23      THR  89  80.432  14.956  -9.112
  724    H    GLU  90           H        GLU  90  82.987  11.359  -8.810
  725    HA   GLU  90           HA       GLU  90  82.202   8.762  -9.694
  726    HB2  GLU  90           HB2      GLU  90  84.827  10.000  -8.893
  727    HB3  GLU  90           HB3      GLU  90  84.710   8.277  -9.237
  728    HG2  GLU  90           HG2      GLU  90  83.793   8.773 -11.462
  729    HG3  GLU  90           HG3      GLU  90  83.881  10.500 -11.122
  730    H    ARG  91           H        ARG  91  83.316  10.128  -6.638
  731    HA   ARG  91           HA       ARG  91  83.366   7.630  -5.227
  732    HB2  ARG  91           HB2      ARG  91  83.178  10.456  -4.143
  733    HB3  ARG  91           HB3      ARG  91  83.636   9.019  -3.232
  734    HG2  ARG  91           HG2      ARG  91  85.547   8.707  -4.844
  735    HG3  ARG  91           HG3      ARG  91  85.146  10.282  -5.529
  736    HD2  ARG  91           HD2      ARG  91  85.240  10.637  -2.716
  737    HD3  ARG  91           HD3      ARG  91  86.663   9.692  -3.144
  738    HE   ARG  91           HE       ARG  91  86.653  11.688  -5.002
  739   HH11  ARG  91          HH21      ARG  91  86.426  11.563  -1.548
  740   HH12  ARG  91          HH22      ARG  91  87.188  13.099  -1.308
  741   HH21  ARG  91          HH11      ARG  91  87.653  13.701  -4.688
  742   HH22  ARG  91          HH12      ARG  91  87.882  14.309  -3.083
  743    H    GLU  92           H        GLU  92  81.126  10.406  -5.312
  744    HA   GLU  92           HA       GLU  92  79.207   9.396  -3.536
  745    HB2  GLU  92           HB2      GLU  92  79.321  11.744  -4.469
  746    HB3  GLU  92           HB3      GLU  92  78.623  11.111  -5.959
  747    HG2  GLU  92           HG2      GLU  92  76.711  10.205  -4.596
  748    HG3  GLU  92           HG3      GLU  92  77.377  11.050  -3.199
  749    H    ASP  93           H        ASP  93  79.252   9.257  -7.112
  750    HA   ASP  93           HA       ASP  93  76.965   7.649  -7.404
  751    HB2  ASP  93           HB2      ASP  93  79.429   7.866  -9.150
  752    HB3  ASP  93           HB1      ASP  93  77.936   7.059  -9.627
  753    H    LEU  94           H        LEU  94  80.404   6.758  -7.220
  754    HA   LEU  94           HA       LEU  94  80.110   3.981  -7.453
  755    HB2  LEU  94           HB2      LEU  94  82.300   5.050  -7.578
  756    HB3  LEU  94           HB3      LEU  94  82.152   5.582  -5.905
  757    HG   LEU  94           HG       LEU  94  82.140   3.283  -5.120
  758   HD11  LEU  94          HD11      LEU  94  81.982   2.720  -8.064
  759   HD12  LEU  94          HD12      LEU  94  81.056   2.009  -6.742
  760   HD13  LEU  94          HD13      LEU  94  82.737   1.540  -6.993
  761   HD21  LEU  94          HD21      LEU  94  84.419   2.704  -5.644
  762   HD22  LEU  94          HD22      LEU  94  84.319   4.462  -5.599
  763   HD23  LEU  94          HD23      LEU  94  84.364   3.619  -7.147
  764    H    ILE  95           H        ILE  95  79.858   6.125  -4.681
  765    HA   ILE  95           HA       ILE  95  79.646   3.994  -2.785
  766    HB   ILE  95           HB       ILE  95  79.356   6.972  -2.661
  767   HG12  ILE  95          HG12      ILE  95  81.027   5.364  -0.792
  768   HG13  ILE  95          HG13      ILE  95  81.503   5.309  -2.483
  769   HG21  ILE  95          HG21      ILE  95  78.391   4.936  -0.672
  770   HG22  ILE  95          HG22      ILE  95  77.663   6.475  -1.128
  771   HG23  ILE  95          HG23      ILE  95  79.085   6.449  -0.086
  772   HD11  ILE  95          HD11      ILE  95  82.224   7.455  -2.478
  773   HD12  ILE  95          HD12      ILE  95  82.283   7.255  -0.732
  774   HD13  ILE  95          HD13      ILE  95  80.884   8.015  -1.480
  775    H    ALA  96           H        ALA  96  77.452   5.825  -4.753
  776    HA   ALA  96           HA       ALA  96  75.061   5.285  -3.324
  777    HB1  ALA  96           HB1      ALA  96  75.457   5.695  -6.302
  778    HB2  ALA  96           HB2      ALA  96  75.214   6.982  -5.120
  779    HB3  ALA  96           HB3      ALA  96  73.926   5.818  -5.432
  780    H    TYR  97           H        TYR  97  76.948   3.528  -5.716
  781    HA   TYR  97           HA       TYR  97  75.018   1.416  -6.035
  782    HB2  TYR  97           HB2      TYR  97  76.495   1.787  -7.881
  783    HB3  TYR  97           HB3      TYR  97  77.918   1.689  -6.844
  784    HD1  TYR  97           HD1      TYR  97  75.079  -0.280  -8.235
  785    HD2  TYR  97           HD2      TYR  97  78.893  -0.412  -6.266
  786    HE1  TYR  97           HE1      TYR  97  75.169  -2.732  -8.577
  787    HE2  TYR  97           HE2      TYR  97  78.982  -2.867  -6.610
  788    HH   TYR  97           HH       TYR  97  76.468  -4.725  -7.242
  789    H    LEU  98           H        LEU  98  78.149   1.761  -4.347
  790    HA   LEU  98           HA       LEU  98  78.336  -0.786  -3.259
  791    HB2  LEU  98           HB2      LEU  98  79.227   1.908  -2.251
  792    HB3  LEU  98           HB3      LEU  98  79.531   0.446  -1.321
  793    HG   LEU  98           HG       LEU  98  80.279   0.522  -4.236
  794   HD11  LEU  98          HD11      LEU  98  82.069   1.497  -1.998
  795   HD12  LEU  98          HD12      LEU  98  81.250   2.563  -3.137
  796   HD13  LEU  98          HD13      LEU  98  82.460   1.421  -3.715
  797   HD21  LEU  98          HD21      LEU  98  81.921  -0.726  -2.080
  798   HD22  LEU  98          HD22      LEU  98  81.575  -1.307  -3.706
  799   HD23  LEU  98          HD23      LEU  98  80.365  -1.478  -2.434
  800    H    LYS  99           H        LYS  99  76.153   1.786  -2.521
  801    HA   LYS  99           HA       LYS  99  75.396   0.794   0.088
  802    HB2  LYS  99           HB2      LYS  99  74.494   3.008  -1.713
  803    HB3  LYS  99           HB3      LYS  99  73.412   2.472  -0.429
  804    HG2  LYS  99           HG2      LYS  99  75.387   2.740   1.171
  805    HG3  LYS  99           HG3      LYS  99  76.218   3.571  -0.144
  806    HD2  LYS  99           HD2      LYS  99  73.489   4.383   0.896
  807    HD3  LYS  99           HD3      LYS  99  75.000   5.107   1.446
  808    HE2  LYS  99           HE2      LYS  99  75.489   5.584  -1.030
  809    HE3  LYS  99           HE3      LYS  99  73.795   5.193  -1.324
  810    HZ1  LYS  99           HZ1      LYS  99  74.436   7.086   0.815
  811    HZ2  LYS  99           HZ2      LYS  99  73.073   7.016  -0.196
  812    HZ3  LYS  99           HZ3      LYS  99  74.545   7.627  -0.788
  813    H    LYS 100           H        LYS 100  73.921   0.849  -3.151
  814    HA   LYS 100           HA       LYS 100  71.668  -0.745  -2.297
  815    HB2  LYS 100           HB2      LYS 100  72.634   0.214  -4.991
  816    HB3  LYS 100           HB3      LYS 100  71.214  -0.816  -4.799
  817    HG2  LYS 100           HG2      LYS 100  70.046   0.824  -3.556
  818    HG3  LYS 100           HG3      LYS 100  71.515   1.744  -3.230
  819    HD2  LYS 100           HD2      LYS 100  71.699   2.283  -5.644
  820    HD3  LYS 100           HD3      LYS 100  70.195   1.407  -5.939
  821    HE2  LYS 100           HE2      LYS 100  68.912   2.966  -4.692
  822    HE3  LYS 100           HE3      LYS 100  70.347   3.669  -3.943
  823    HZ1  LYS 100           HZ1      LYS 100  71.028   4.505  -6.096
  824    HZ2  LYS 100           HZ2      LYS 100  69.474   5.073  -5.710
  825    HZ3  LYS 100           HZ3      LYS 100  69.666   3.811  -6.831
  826    H    ALA 101           H        ALA 101  74.861  -1.379  -3.294
  827    HA   ALA 101           HA       ALA 101  74.314  -4.039  -4.340
  828    HB1  ALA 101           HB1      ALA 101  77.006  -2.838  -3.682
  829    HB2  ALA 101           HB2      ALA 101  76.161  -2.517  -5.196
  830    HB3  ALA 101           HB3      ALA 101  76.652  -4.162  -4.792
  831    H    THR 102           H        THR 102  75.476  -2.510  -1.403
  832    HA   THR 102           HA       THR 102  76.133  -5.076  -0.169
  833    HB   THR 102           HB       THR 102  76.740  -3.650   1.790
  834    HG1  THR 102           HG1      THR 102  75.272  -1.900   0.438
  835   HG21  THR 102          HG21      THR 102  78.649  -2.511   0.630
  836   HG22  THR 102          HG22      THR 102  77.891  -2.913  -0.911
  837   HG23  THR 102          HG23      THR 102  78.443  -4.199   0.161
  838    H    ASN 103           H        ASN 103  73.390  -3.401  -0.777
  839    HA   ASN 103           HA       ASN 103  72.066  -4.005   1.776
  840    HB2  ASN 103           HB2      ASN 103  71.364  -2.341  -0.627
  841    HB3  ASN 103           HB1      ASN 103  70.134  -2.812   0.535
  842   HD21  ASN 103          HD21      ASN 103  73.451  -2.233   1.573
  843   HD22  ASN 103          HD22      ASN 103  73.123  -0.793   2.406
  844    H    GLU 104           H        GLU 104  72.374  -5.099  -1.484
  845    HA   GLU 104           HA       GLU 104  69.933  -6.555  -1.683
  846    HB2  GLU 104           HB2      GLU 104  72.580  -6.744  -3.119
  847    HB3  GLU 104           HB3      GLU 104  71.238  -7.830  -3.482
  848    HG2  GLU 104           HG2      GLU 104  70.765  -4.861  -3.420
  849    HG3  GLU 104           HG3      GLU 104  71.502  -5.593  -4.843
  850    HHA  HEC 201           HA       HEC 105  89.340  -3.369   3.281
  851    HHB  HEC 201           HB       HEC 105  85.593   0.139  -0.403
  852    HHC  HEC 201           HC       HEC 105  88.829  -1.784  -5.494
  853    HHD  HEC 201           HD       HEC 105  92.154  -5.753  -1.858
  854   HMA1  HEC 201          HMA1      HEC 105  84.528  -0.446   2.062
  855   HMA2  HEC 201          HMA2      HEC 105  85.549   0.966   1.803
  856   HMA3  HEC 201          HMA3      HEC 105  85.529   0.170   3.374
  857   HAA1  HEC 201          HAA1      HEC 105  87.027  -0.724   4.538
  858   HAA2  HEC 201          HAA2      HEC 105  88.398  -1.809   4.511
  859   HBA1  HEC 201          HBA1      HEC 105  87.103  -3.686   4.815
  860   HBA2  HEC 201          HBA2      HEC 105  85.707  -2.992   3.996
  861   HMB1  HEC 201          HMB1      HEC 105  85.200   1.629  -2.259
  862   HMB2  HEC 201          HMB2      HEC 105  84.171   0.261  -2.679
  863   HMB3  HEC 201          HMB3      HEC 105  84.877   1.253  -3.948
  864    HAB  HEC 201           HAB      HEC 105  87.331  -0.580  -6.172
  865   HBB1  HEC 201          HBB1      HEC 105  86.321   1.852  -6.514
  866   HBB2  HEC 201          HBB2      HEC 105  86.760   2.027  -4.816
  867   HBB3  HEC 201          HBB3      HEC 105  87.995   1.633  -6.007
  868   HMC1  HEC 201          HMC1      HEC 105  89.760  -3.646  -6.828
  869   HMC2  HEC 201          HMC2      HEC 105  91.411  -4.258  -6.776
  870   HMC3  HEC 201          HMC3      HEC 105  91.103  -2.531  -6.596
  871    HAC  HEC 201           HAC      HEC 105  92.616  -6.190  -3.780
  872   HBC1  HEC 201          HBC1      HEC 105  93.527  -5.504  -6.358
  873   HBC2  HEC 201          HBC2      HEC 105  94.369  -5.230  -4.834
  874   HBC3  HEC 201          HBC3      HEC 105  93.338  -3.970  -5.511
  875   HMD1  HEC 201          HMD1      HEC 105  93.434  -6.215   0.008
  876   HMD2  HEC 201          HMD2      HEC 105  92.224  -7.429   0.428
  877   HMD3  HEC 201          HMD3      HEC 105  93.114  -6.592   1.697
  878   HAD1  HEC 201          HAD1      HEC 105  91.688  -6.270   3.336
  879   HAD2  HEC 201          HAD2      HEC 105  90.412  -5.196   3.861
  880   HBD1  HEC 201          HBD1      HEC 105  92.655  -3.555   3.216
  881   HBD2  HEC 201          HBD2      HEC 105  93.251  -4.896   4.187
  882    H1   HOH 301           H2       HOH 200  81.656   3.353  -0.833
  883    H2   HOH 301           H1       HOH 200  80.725   2.202  -0.512
  884    H1   HOH 302           H2       HOH 201  85.551   5.524   6.311
  885    H2   HOH 302           H1       HOH 201  86.218   6.679   5.598
  886    H1   HOH 303           H2       HOH 202  82.794  -5.234   5.625
  887    H2   HOH 303           H1       HOH 202  81.910  -5.847   6.688
  888    H1   HOH 304           H2       HOH 203  82.223  -9.917   0.318
  889    H2   HOH 304           H1       HOH 203  81.540 -11.205   0.723
  Start of MODEL   16
    1    H1   GLY   1           H1       GLY   1  73.699  11.441  -7.762
    2    H2   GLY   1           H2       GLY   1  74.552  11.716  -6.318
    3    H3   GLY   1           H3       GLY   1  73.014  10.993  -6.276
    4    HA2  GLY   1           HA2      GLY   1  75.564   9.836  -7.229
    5    HA3  GLY   1           HA3      GLY   1  74.487   9.222  -5.973
    6    H    ASP   2           H        ASP   2  75.481   8.584  -8.985
    7    HA   ASP   2           HA       ASP   2  72.841   7.671  -9.963
    8    HB2  ASP   2           HB2      ASP   2  75.448   8.140 -11.421
    9    HB3  ASP   2           HB1      ASP   2  74.006   7.441 -12.157
   10    H    VAL   3           H        VAL   3  72.745   5.809  -8.672
   11    HA   VAL   3           HA       VAL   3  74.614   3.875  -8.205
   12    HB   VAL   3           HB       VAL   3  72.398   3.705  -7.270
   13   HG11  VAL   3          HG11      VAL   3  71.186   4.697  -9.189
   14   HG12  VAL   3          HG12      VAL   3  70.445   3.183  -8.671
   15   HG13  VAL   3          HG13      VAL   3  71.460   3.220 -10.113
   16   HG21  VAL   3          HG21      VAL   3  72.602   1.375  -9.182
   17   HG22  VAL   3          HG22      VAL   3  72.052   1.374  -7.506
   18   HG23  VAL   3          HG23      VAL   3  73.761   1.593  -7.873
   19    H    GLU   4           H        GLU   4  73.303   4.799 -11.245
   20    HA   GLU   4           HA       GLU   4  73.768   2.328 -12.626
   21    HB2  GLU   4           HB2      GLU   4  73.635   5.089 -13.844
   22    HB3  GLU   4           HB3      GLU   4  73.274   3.548 -14.623
   23    HG2  GLU   4           HG2      GLU   4  71.437   3.241 -12.886
   24    HG3  GLU   4           HG3      GLU   4  71.702   4.925 -12.435
   25    H    LYS   5           H        LYS   5  75.467   5.473 -12.763
   26    HA   LYS   5           HA       LYS   5  77.724   4.347 -14.126
   27    HB2  LYS   5           HB2      LYS   5  77.081   7.009 -12.892
   28    HB3  LYS   5           HB3      LYS   5  78.749   6.640 -13.329
   29    HG2  LYS   5           HG2      LYS   5  78.261   6.476 -15.609
   30    HG3  LYS   5           HG3      LYS   5  76.554   6.137 -15.325
   31    HD2  LYS   5           HD2      LYS   5  77.657   8.789 -14.450
   32    HD3  LYS   5           HD3      LYS   5  77.327   8.532 -16.163
   33    HE2  LYS   5           HE2      LYS   5  75.027   8.179 -15.796
   34    HE3  LYS   5           HE3      LYS   5  75.259   7.846 -14.079
   35    HZ1  LYS   5           HZ1      LYS   5  74.344  10.047 -14.418
   36    HZ2  LYS   5           HZ2      LYS   5  75.654  10.471 -15.413
   37    HZ3  LYS   5           HZ3      LYS   5  75.903  10.157 -13.761
   38    H    GLY   6           H        GLY   6  76.713   4.543 -10.865
   39    HA2  GLY   6           HA2      GLY   6  79.289   4.424  -9.617
   40    HA3  GLY   6           HA3      GLY   6  77.746   4.004  -8.866
   41    H    LYS   7           H        LYS   7  76.937   2.126 -10.838
   42    HA   LYS   7           HA       LYS   7  78.174  -0.235  -9.846
   43    HB2  LYS   7           HB2      LYS   7  75.811  -0.102 -10.647
   44    HB3  LYS   7           HB3      LYS   7  76.419   0.082 -12.292
   45    HG2  LYS   7           HG2      LYS   7  77.614  -2.089 -12.064
   46    HG3  LYS   7           HG3      LYS   7  76.917  -2.279 -10.456
   47    HD2  LYS   7           HD2      LYS   7  75.387  -3.477 -11.738
   48    HD3  LYS   7           HD3      LYS   7  74.634  -1.883 -11.727
   49    HE2  LYS   7           HE2      LYS   7  75.637  -1.368 -13.906
   50    HE3  LYS   7           HE3      LYS   7  76.463  -2.926 -13.912
   51    HZ1  LYS   7           HZ1      LYS   7  74.172  -2.614 -15.101
   52    HZ2  LYS   7           HZ2      LYS   7  73.558  -2.887 -13.540
   53    HZ3  LYS   7           HZ3      LYS   7  74.539  -4.056 -14.286
   54    H    LYS   8           H        LYS   8  78.375   1.561 -12.911
   55    HA   LYS   8           HA       LYS   8  80.032  -0.216 -14.312
   56    HB2  LYS   8           HB2      LYS   8  78.969   1.648 -15.430
   57    HB3  LYS   8           HB3      LYS   8  79.862   2.801 -14.441
   58    HG2  LYS   8           HG2      LYS   8  81.569   0.843 -15.857
   59    HG3  LYS   8           HG3      LYS   8  80.674   1.924 -16.922
   60    HD2  LYS   8           HD2      LYS   8  82.165   3.033 -14.548
   61    HD3  LYS   8           HD3      LYS   8  83.018   2.679 -16.049
   62    HE2  LYS   8           HE2      LYS   8  81.820   4.280 -17.265
   63    HE3  LYS   8           HE3      LYS   8  80.479   4.292 -16.120
   64    HZ1  LYS   8           HZ1      LYS   8  83.011   5.713 -16.029
   65    HZ2  LYS   8           HZ2      LYS   8  82.464   5.081 -14.549
   66    HZ3  LYS   8           HZ3      LYS   8  81.490   6.162 -15.426
   67    H    ILE   9           H        ILE   9  80.889   2.525 -12.214
   68    HA   ILE   9           HA       ILE   9  83.696   2.244 -12.481
   69    HB   ILE   9           HB       ILE   9  82.060   3.478 -10.256
   70   HG12  ILE   9          HG12      ILE   9  83.502   4.858 -12.530
   71   HG13  ILE   9          HG13      ILE   9  81.813   4.365 -12.654
   72   HG21  ILE   9          HG21      ILE   9  84.279   3.070  -9.437
   73   HG22  ILE   9          HG22      ILE   9  84.218   4.771  -9.899
   74   HG23  ILE   9          HG23      ILE   9  85.003   3.598 -10.956
   75   HD11  ILE   9          HD11      ILE   9  82.931   6.161 -10.481
   76   HD12  ILE   9          HD12      ILE   9  81.238   5.719 -10.700
   77   HD13  ILE   9          HD13      ILE   9  82.048   6.727 -11.898
   78    H    PHE  10           H        PHE  10  81.335   0.572 -10.588
   79    HA   PHE  10           HA       PHE  10  83.219  -0.416  -8.628
   80    HB2  PHE  10           HB2      PHE  10  81.099  -0.289  -7.706
   81    HB3  PHE  10           HB1      PHE  10  80.307  -0.805  -9.194
   82    HD1  PHE  10           HD1      PHE  10  80.245  -3.177  -9.836
   83    HD2  PHE  10           HD2      PHE  10  82.008  -1.905  -6.139
   84    HE1  PHE  10           HE1      PHE  10  80.238  -5.521  -9.034
   85    HE2  PHE  10           HE2      PHE  10  82.005  -4.252  -5.332
   86    HZ   PHE  10           HZ       PHE  10  81.120  -6.061  -6.784
   87    H    VAL  11           H        VAL  11  81.352  -1.926 -11.279
   88    HA   VAL  11           HA       VAL  11  82.349  -4.508 -11.051
   89    HB   VAL  11           HB       VAL  11  81.775  -4.764 -13.453
   90   HG11  VAL  11          HG11      VAL  11  79.440  -4.454 -13.148
   91   HG12  VAL  11          HG12      VAL  11  79.687  -3.100 -12.048
   92   HG13  VAL  11          HG13      VAL  11  80.079  -4.738 -11.530
   93   HG21  VAL  11          HG21      VAL  11  82.543  -2.530 -14.188
   94   HG22  VAL  11          HG22      VAL  11  81.242  -1.788 -13.260
   95   HG23  VAL  11          HG23      VAL  11  80.862  -2.807 -14.646
   96    H    GLN  12           H        GLN  12  83.796  -1.679 -12.510
   97    HA   GLN  12           HA       GLN  12  85.963  -3.301 -13.641
   98    HB2  GLN  12           HB2      GLN  12  86.655  -1.302 -14.769
   99    HB3  GLN  12           HB1      GLN  12  84.908  -1.464 -14.948
  100    HG2  GLN  12           HG2      GLN  12  84.650   0.065 -12.952
  101    HG3  GLN  12           HG1      GLN  12  86.390   0.348 -13.026
  102   HE21  GLN  12          HE21      GLN  12  85.631  -0.141 -16.172
  103   HE22  GLN  12          HE22      GLN  12  85.281   1.446 -16.648
  104    H    LYS  13           H        LYS  13  85.387  -1.149 -10.930
  105    HA   LYS  13           HA       LYS  13  88.282  -1.019 -10.419
  106    HB2  LYS  13           HB2      LYS  13  86.695   1.021 -10.402
  107    HB3  LYS  13           HB3      LYS  13  86.219   0.443  -8.806
  108    HG2  LYS  13           HG2      LYS  13  88.462   0.623  -7.978
  109    HG3  LYS  13           HG3      LYS  13  89.113   0.876  -9.595
  110    HD2  LYS  13           HD2      LYS  13  87.038   2.793  -8.596
  111    HD3  LYS  13           HD3      LYS  13  88.676   2.933  -7.960
  112    HE2  LYS  13           HE2      LYS  13  87.982   2.880 -10.912
  113    HE3  LYS  13           HE3      LYS  13  88.302   4.346  -9.986
  114    HZ1  LYS  13           HZ1      LYS  13  90.141   2.298 -10.914
  115    HZ2  LYS  13           HZ2      LYS  13  90.435   2.903  -9.353
  116    HZ3  LYS  13           HZ3      LYS  13  90.392   3.960 -10.683
  117    H    CYS  14           H        CYS  14  85.417  -1.410  -8.276
  118    HA   CYS  14           HA       CYS  14  87.090  -2.670  -6.292
  119    HB2  CYS  14           HB2      CYS  14  84.118  -2.581  -6.082
  120    HB3  CYS  14           HB1      CYS  14  85.325  -2.416  -4.815
  121    H    ALA  15           H        ALA  15  84.618  -3.869  -8.526
  122    HA   ALA  15           HA       ALA  15  84.076  -6.328  -7.423
  123    HB1  ALA  15           HB1      ALA  15  82.890  -5.933  -9.370
  124    HB2  ALA  15           HB2      ALA  15  84.082  -7.099  -9.943
  125    HB3  ALA  15           HB3      ALA  15  84.316  -5.379 -10.247
  126    H    GLN  16           H        GLN  16  87.048  -5.240  -8.867
  127    HA   GLN  16           HA       GLN  16  88.333  -7.541  -9.609
  128    HB2  GLN  16           HB2      GLN  16  89.338  -5.060  -8.243
  129    HB3  GLN  16           HB1      GLN  16  90.438  -6.375  -8.652
  130    HG2  GLN  16           HG2      GLN  16  89.685  -6.251 -11.010
  131    HG3  GLN  16           HG1      GLN  16  88.628  -4.904 -10.591
  132   HE21  GLN  16          HE21      GLN  16  91.660  -5.585 -11.847
  133   HE22  GLN  16          HE22      GLN  16  92.436  -4.123 -11.473
  134    H    CYS  17           H        CYS  17  88.535  -6.177  -6.287
  135    HA   CYS  17           HA       CYS  17  88.954  -8.947  -5.317
  136    HB2  CYS  17           HB2      CYS  17  90.122  -6.776  -3.688
  137    HB3  CYS  17           HB1      CYS  17  90.790  -8.345  -4.121
  138    H    HIS  18           H        HSD  18  86.378  -8.105  -5.376
  139    HA   HIS  18           HA       HSD  18  85.730  -8.046  -2.554
  140    HB2  HIS  18           HB2      HSD  18  85.158  -5.683  -4.330
  141    HB3  HIS  18           HB1      HSD  18  84.149  -6.041  -2.931
  142    HD1  HIS  18           HD1      HSD  18  86.552  -7.087  -1.101
  143    HD2  HIS  18           HD2      HSD  18  86.461  -3.475  -3.176
  144    HE1  HIS  18           HE1      HSD  18  88.180  -5.539   0.076
  145    H    THR  19           H        THR  19  83.153  -7.667  -2.445
  146    HA   THR  19           HA       THR  19  81.863  -9.175  -4.619
  147    HB   THR  19           HB       THR  19  81.178  -9.842  -1.780
  148    HG1  THR  19           HG1      THR  19  82.838 -11.631  -2.378
  149   HG21  THR  19          HG21      THR  19  80.069 -10.639  -4.038
  150   HG22  THR  19          HG22      THR  19  80.315 -11.781  -2.716
  151   HG23  THR  19          HG23      THR  19  81.439 -11.747  -4.073
  152    H    VAL  20           H        VAL  20  81.527  -7.232  -1.698
  153    HA   VAL  20           HA       VAL  20  79.851  -5.880  -0.913
  154    HB   VAL  20           HB       VAL  20  79.228  -4.127  -2.441
  155   HG11  VAL  20          HG11      VAL  20  81.589  -4.248  -1.643
  156   HG12  VAL  20          HG12      VAL  20  81.445  -3.464  -3.215
  157   HG13  VAL  20          HG13      VAL  20  82.010  -5.129  -3.108
  158   HG21  VAL  20          HG21      VAL  20  78.685  -5.779  -4.332
  159   HG22  VAL  20          HG22      VAL  20  80.409  -5.759  -4.686
  160   HG23  VAL  20          HG23      VAL  20  79.471  -4.274  -4.800
  161    H    GLU  21           H        GLU  21  78.878  -8.546  -1.570
  162    HA   GLU  21           HA       GLU  21  76.058  -7.812  -2.050
  163    HB2  GLU  21           HB2      GLU  21  75.675  -9.613  -3.513
  164    HB3  GLU  21           HB3      GLU  21  77.204  -8.932  -4.066
  165    HG2  GLU  21           HG2      GLU  21  78.325 -10.648  -2.507
  166    HG3  GLU  21           HG3      GLU  21  76.748 -11.436  -2.448
  167    H    LYS  22           H        LYS  22  74.924  -8.270  -0.309
  168    HA   LYS  22           HA       LYS  22  75.792  -9.670   1.922
  169    HB2  LYS  22           HB2      LYS  22  73.045  -9.019   0.873
  170    HB3  LYS  22           HB3      LYS  22  73.250  -9.933   2.367
  171    HG2  LYS  22           HG2      LYS  22  74.917  -7.484   2.138
  172    HG3  LYS  22           HG3      LYS  22  73.182  -7.205   2.266
  173    HD2  LYS  22           HD2      LYS  22  74.527  -9.134   4.148
  174    HD3  LYS  22           HD3      LYS  22  74.608  -7.400   4.458
  175    HE2  LYS  22           HE2      LYS  22  72.280  -7.206   4.715
  176    HE3  LYS  22           HE3      LYS  22  71.963  -8.720   3.867
  177    HZ1  LYS  22           HZ1      LYS  22  71.854  -9.626   5.880
  178    HZ2  LYS  22           HZ2      LYS  22  72.538  -8.267   6.635
  179    HZ3  LYS  22           HZ3      LYS  22  73.539  -9.458   5.956
  180    H    GLY  23           H        GLY  23  75.882 -11.762   2.510
  181    HA2  GLY  23           HA2      GLY  23  75.634 -14.055   2.454
  182    HA3  GLY  23           HA3      GLY  23  74.265 -13.821   1.373
  183    H    GLY  24           H        GLY  24  77.392 -12.485   0.599
  184    HA2  GLY  24           HA2      GLY  24  77.534 -14.244  -1.749
  185    HA3  GLY  24           HA3      GLY  24  78.428 -12.744  -1.515
  186    H    LYS  25           H        LYS  25  80.465 -13.525  -1.868
  187    HA   LYS  25           HA       LYS  25  81.608 -15.134   0.286
  188    HB2  LYS  25           HB2      LYS  25  82.839 -16.525  -1.480
  189    HB3  LYS  25           HB3      LYS  25  81.142 -16.912  -1.202
  190    HG2  LYS  25           HG2      LYS  25  81.690 -14.849  -3.282
  191    HG3  LYS  25           HG3      LYS  25  82.168 -16.497  -3.677
  192    HD2  LYS  25           HD2      LYS  25  79.875 -17.277  -3.112
  193    HD3  LYS  25           HD3      LYS  25  79.405 -15.607  -2.798
  194    HE2  LYS  25           HE2      LYS  25  80.393 -15.222  -5.236
  195    HE3  LYS  25           HE3      LYS  25  80.030 -16.940  -5.406
  196    HZ1  LYS  25           HZ1      LYS  25  77.790 -16.589  -5.078
  197    HZ2  LYS  25           HZ2      LYS  25  78.226 -15.211  -5.971
  198    HZ3  LYS  25           HZ3      LYS  25  78.015 -15.105  -4.289
  199    H    HIS  26           H        HIS  26  83.238 -13.923   0.988
  200    HA   HIS  26           HA       HIS  26  84.427 -11.804  -0.404
  201    HB2  HIS  26           HB2      HIS  26  86.353 -12.324   1.361
  202    HB3  HIS  26           HB1      HIS  26  84.809 -11.640   1.865
  203    HD1  HIS  26           HD1      HIS  26  86.626 -14.962   1.670
  204    HD2  HIS  26           HD2      HIS  26  83.284 -13.297   3.525
  205    HE1  HIS  26           HE1      HIS  26  85.785 -16.693   3.318
  206    HE2  HIS  26           HE2      HIS  26  83.747 -15.692   4.456
  207    H    LYS  27           H        LYS  27  85.925 -11.708  -1.944
  208    HA   LYS  27           HA       LYS  27  87.658 -14.064  -2.410
  209    HB2  LYS  27           HB2      LYS  27  86.168 -12.384  -4.434
  210    HB3  LYS  27           HB3      LYS  27  87.505 -13.449  -4.866
  211    HG2  LYS  27           HG2      LYS  27  86.219 -15.318  -3.689
  212    HG3  LYS  27           HG3      LYS  27  84.841 -14.217  -3.659
  213    HD2  LYS  27           HD2      LYS  27  86.323 -15.165  -6.128
  214    HD3  LYS  27           HD3      LYS  27  84.698 -15.645  -5.637
  215    HE2  LYS  27           HE2      LYS  27  84.164 -13.103  -5.687
  216    HE3  LYS  27           HE3      LYS  27  85.644 -12.962  -6.637
  217    HZ1  LYS  27           HZ1      LYS  27  83.804 -15.061  -7.442
  218    HZ2  LYS  27           HZ2      LYS  27  84.727 -13.998  -8.393
  219    HZ3  LYS  27           HZ3      LYS  27  83.266 -13.474  -7.701
  220    H    THR  28           H        THR  28  89.650 -13.431  -1.868
  221    HA   THR  28           HA       THR  28  91.576 -12.188  -1.732
  222    HB   THR  28           HB       THR  28  90.637 -10.639  -4.134
  223    HG1  THR  28           HG1      THR  28  90.168 -12.874  -4.429
  224   HG21  THR  28          HG21      THR  28  92.923 -10.455  -4.626
  225   HG22  THR  28          HG22      THR  28  93.341 -11.865  -3.652
  226   HG23  THR  28          HG23      THR  28  92.906 -10.348  -2.865
  227    H    GLY  29           H        GLY  29  89.071 -11.245  -0.454
  228    HA2  GLY  29           HA2      GLY  29  89.936  -8.935   0.774
  229    HA3  GLY  29           HA3      GLY  29  88.980  -8.389  -0.600
  230    HA   PRO  30           HA       PRO  30  86.347  -9.904   3.144
  231    HB2  PRO  30           HB2      PRO  30  85.858  -7.485   4.371
  232    HB3  PRO  30           HB1      PRO  30  87.160  -8.592   4.850
  233    HG2  PRO  30           HG2      PRO  30  87.287  -6.136   3.168
  234    HG3  PRO  30           HG1      PRO  30  88.421  -6.726   4.395
  235    HD2  PRO  30           HD2      PRO  30  88.881  -7.020   1.724
  236    HD3  PRO  30           HD1      PRO  30  89.462  -8.192   2.927
  237    H    ASN  31           H        ASN  31  84.056  -9.138   3.601
  238    HA   ASN  31           HA       ASN  31  82.864  -8.150   1.096
  239    HB2  ASN  31           HB2      ASN  31  80.776  -9.095   1.983
  240    HB3  ASN  31           HB1      ASN  31  82.056 -10.304   1.954
  241   HD21  ASN  31          HD21      ASN  31  80.343  -8.050   4.155
  242   HD22  ASN  31          HD22      ASN  31  80.678  -8.933   5.565
  243    H    LEU  32           H        LEU  32  82.061  -6.159   0.975
  244    HA   LEU  32           HA       LEU  32  82.056  -4.428   3.283
  245    HB2  LEU  32           HB2      LEU  32  80.964  -3.754   0.553
  246    HB3  LEU  32           HB3      LEU  32  81.606  -2.657   1.771
  247    HG   LEU  32           HG       LEU  32  83.123  -4.620   0.042
  248   HD11  LEU  32          HD11      LEU  32  83.154  -1.630   0.494
  249   HD12  LEU  32          HD12      LEU  32  82.913  -2.503  -1.017
  250   HD13  LEU  32          HD13      LEU  32  84.507  -2.465  -0.268
  251   HD21  LEU  32          HD21      LEU  32  83.959  -3.266   2.609
  252   HD22  LEU  32          HD22      LEU  32  85.134  -3.798   1.408
  253   HD23  LEU  32          HD23      LEU  32  84.081  -4.973   2.193
  254    H    HIS  33           H        HIS  33  80.197  -6.641   3.427
  255    HA   HIS  33           HA       HIS  33  77.542  -5.905   2.838
  256    HB2  HIS  33           HB2      HIS  33  78.614  -7.643   5.076
  257    HB3  HIS  33           HB1      HIS  33  76.923  -7.554   4.589
  258    HD1  HIS  33           HD1      HIS  33  78.355 -10.239   4.339
  259    HD2  HIS  33           HD2      HIS  33  78.227  -7.443   1.250
  260    HE1  HIS  33           HE1      HIS  33  78.755 -11.523   2.194
  261    HE2  HIS  33           HE2      HIS  33  78.681  -9.832   0.301
  262    H    GLY  34           H        GLY  34  75.992  -4.769   3.975
  263    HA2  GLY  34           HA2      GLY  34  75.390  -2.871   5.214
  264    HA3  GLY  34           HA3      GLY  34  75.722  -4.002   6.525
  265    H    LEU  35           H        LEU  35  78.148  -2.795   4.326
  266    HA   LEU  35           HA       LEU  35  80.080  -2.165   6.165
  267    HB2  LEU  35           HB2      LEU  35  80.525  -2.256   3.787
  268    HB3  LEU  35           HB3      LEU  35  79.486  -0.865   3.500
  269    HG   LEU  35           HG       LEU  35  81.175   0.254   5.277
  270   HD11  LEU  35          HD11      LEU  35  82.390  -2.037   5.349
  271   HD12  LEU  35          HD12      LEU  35  83.376  -0.586   5.164
  272   HD13  LEU  35          HD13      LEU  35  83.013  -1.589   3.762
  273   HD21  LEU  35          HD21      LEU  35  80.663   0.968   2.919
  274   HD22  LEU  35          HD22      LEU  35  81.917  -0.143   2.369
  275   HD23  LEU  35          HD23      LEU  35  82.341   1.227   3.395
  276    H    PHE  36           H        PHE  36  77.894   0.209   4.650
  277    HA   PHE  36           HA       PHE  36  78.667   2.432   6.111
  278    HB2  PHE  36           HB2      PHE  36  75.848   1.857   5.179
  279    HB3  PHE  36           HB1      PHE  36  76.576   3.439   5.456
  280    HD1  PHE  36           HD2      PHE  36  76.713   0.397   3.317
  281    HD2  PHE  36           HD1      PHE  36  77.968   4.481   3.798
  282    HE1  PHE  36           HE2      PHE  36  77.582   0.407   0.997
  283    HE2  PHE  36           HE1      PHE  36  78.829   4.487   1.482
  284    HZ   PHE  36           HZ       PHE  36  78.638   2.452   0.076
  285    H    GLY  37           H        GLY  37  79.024   1.948   8.306
  286    HA2  GLY  37           HA2      GLY  37  77.492   2.681  10.265
  287    HA3  GLY  37           HA3      GLY  37  76.652   1.187   9.887
  288    H    ARG  38           H        ARG  38  79.288  -0.158   9.236
  289    HA   ARG  38           HA       ARG  38  79.869  -0.924  11.997
  290    HB2  ARG  38           HB2      ARG  38  80.189  -2.148   9.333
  291    HB3  ARG  38           HB3      ARG  38  81.496  -2.493  10.464
  292    HG2  ARG  38           HG2      ARG  38  79.665  -3.102  12.158
  293    HG3  ARG  38           HG3      ARG  38  78.549  -3.081  10.793
  294    HD2  ARG  38           HD2      ARG  38  81.074  -4.647  10.486
  295    HD3  ARG  38           HD3      ARG  38  79.831  -5.313  11.535
  296    HE   ARG  38           HE       ARG  38  78.300  -4.989   9.514
  297   HH11  ARG  38          HH21      ARG  38  81.725  -5.561   9.254
  298   HH12  ARG  38          HH22      ARG  38  81.606  -6.314   7.700
  299   HH21  ARG  38          HH11      ARG  38  78.166  -5.990   7.496
  300   HH22  ARG  38          HH12      ARG  38  79.600  -6.563   6.713
  301    H    LYS  39           H        LYS  39  81.919  -0.974  12.928
  302    HA   LYS  39           HA       LYS  39  83.584   1.265  12.356
  303    HB2  LYS  39           HB2      LYS  39  83.499  -0.919  14.347
  304    HB3  LYS  39           HB3      LYS  39  85.094  -0.236  14.044
  305    HG2  LYS  39           HG2      LYS  39  82.710   1.549  14.544
  306    HG3  LYS  39           HG3      LYS  39  83.624   0.862  15.885
  307    HD2  LYS  39           HD2      LYS  39  85.715   1.813  14.624
  308    HD3  LYS  39           HD3      LYS  39  84.537   2.824  13.790
  309    HE2  LYS  39           HE2      LYS  39  84.869   2.637  16.799
  310    HE3  LYS  39           HE3      LYS  39  85.443   3.964  15.788
  311    HZ1  LYS  39           HZ1      LYS  39  83.449   4.875  15.949
  312    HZ2  LYS  39           HZ2      LYS  39  82.876   3.560  16.861
  313    HZ3  LYS  39           HZ3      LYS  39  82.764   3.536  15.166
  314    H    THR  40           H        THR  40  85.986   1.064  12.065
  315    HA   THR  40           HA       THR  40  86.564  -0.330   9.672
  316    HB   THR  40           HB       THR  40  88.966   0.364  10.238
  317    HG1  THR  40           HG1      THR  40  87.820   2.069  12.107
  318   HG21  THR  40          HG21      THR  40  88.246   2.873  10.051
  319   HG22  THR  40          HG22      THR  40  86.619   2.211   9.903
  320   HG23  THR  40          HG23      THR  40  87.860   1.770   8.731
  321    H    GLY  41           H        GLY  41  87.769  -2.130   9.244
  322    HA2  GLY  41           HA2      GLY  41  88.401  -4.317   9.597
  323    HA3  GLY  41           HA3      GLY  41  89.395  -3.616  10.872
  324    H    GLN  42           H        GLN  42  85.878  -4.064  10.493
  325    HA   GLN  42           HA       GLN  42  85.837  -5.303  13.178
  326    HB2  GLN  42           HB2      GLN  42  84.453  -3.177  12.570
  327    HB3  GLN  42           HB1      GLN  42  83.390  -4.313  11.740
  328    HG2  GLN  42           HG2      GLN  42  83.450  -5.665  13.953
  329    HG3  GLN  42           HG1      GLN  42  84.075  -4.183  14.675
  330   HE21  GLN  42          HE21      GLN  42  81.239  -5.616  13.093
  331   HE22  GLN  42          HE22      GLN  42  80.157  -4.389  13.547
  332    H    ALA  43           H        ALA  43  85.349  -5.890   9.834
  333    HA   ALA  43           HA       ALA  43  83.609  -8.171  10.173
  334    HB1  ALA  43           HB1      ALA  43  84.551  -8.442   7.655
  335    HB2  ALA  43           HB2      ALA  43  84.890  -6.731   7.916
  336    HB3  ALA  43           HB3      ALA  43  83.243  -7.335   8.074
  337    HA   PRO  44           HA       PRO  44  86.985 -10.961  10.995
  338    HB2  PRO  44           HB2      PRO  44  85.689 -13.332  10.712
  339    HB3  PRO  44           HB1      PRO  44  85.391 -12.247  12.081
  340    HG2  PRO  44           HG2      PRO  44  83.789 -12.618   9.590
  341    HG3  PRO  44           HG1      PRO  44  83.241 -12.445  11.266
  342    HD2  PRO  44           HD2      PRO  44  83.229 -10.368   9.469
  343    HD3  PRO  44           HD1      PRO  44  83.396 -10.140  11.225
  344    H    GLY  45           H        GLY  45  85.497 -13.283   8.949
  345    HA2  GLY  45           HA2      GLY  45  86.518 -14.440   7.188
  346    HA3  GLY  45           HA3      GLY  45  86.086 -12.930   6.396
  347    H    PHE  46           H        PHE  46  87.680 -11.351   6.041
  348    HA   PHE  46           HA       PHE  46  90.309 -12.397   5.577
  349    HB2  PHE  46           HB2      PHE  46  89.165 -10.717   4.115
  350    HB3  PHE  46           HB1      PHE  46  89.377  -9.525   5.399
  351    HD1  PHE  46           HD2      PHE  46  91.080 -11.591   2.869
  352    HD2  PHE  46           HD1      PHE  46  91.595  -8.678   5.984
  353    HE1  PHE  46           HE2      PHE  46  93.393 -11.162   2.085
  354    HE2  PHE  46           HE1      PHE  46  93.908  -8.249   5.199
  355    HZ   PHE  46           HZ       PHE  46  94.808  -9.491   3.250
  356    H    THR  47           H        THR  47  92.290 -11.562   6.412
  357    HA   THR  47           HA       THR  47  92.159 -10.972   9.256
  358    HB   THR  47           HB       THR  47  94.529 -11.368   7.416
  359    HG1  THR  47           HG1      THR  47  93.090 -13.176   7.794
  360   HG21  THR  47          HG21      THR  47  94.265 -11.031  10.407
  361   HG22  THR  47          HG22      THR  47  95.277 -10.109   9.295
  362   HG23  THR  47          HG23      THR  47  95.675 -11.786   9.664
  363    H    TYR  48           H        TYR  48  91.307  -8.871   9.271
  364    HA   TYR  48           HA       TYR  48  92.234  -6.694   7.777
  365    HB2  TYR  48           HB2      TYR  48  90.746  -7.014  10.346
  366    HB3  TYR  48           HB3      TYR  48  91.370  -5.415   9.941
  367    HD1  TYR  48           HD2      TYR  48  90.740  -4.347   7.771
  368    HD2  TYR  48           HD1      TYR  48  88.881  -7.944   9.186
  369    HE1  TYR  48           HE2      TYR  48  88.868  -3.994   6.194
  370    HE2  TYR  48           HE1      TYR  48  87.001  -7.597   7.604
  371    HH   TYR  48           HH       TYR  48  86.403  -4.701   6.088
  372    H    THR  49           H        THR  49  93.563  -4.927   8.345
  373    HA   THR  49           HA       THR  49  95.985  -5.722   9.728
  374    HB   THR  49           HB       THR  49  96.820  -3.514   8.984
  375    HG1  THR  49           HG1      THR  49  94.665  -2.552   9.164
  376   HG21  THR  49          HG21      THR  49  96.141  -3.957   6.435
  377   HG22  THR  49          HG22      THR  49  95.538  -5.466   7.117
  378   HG23  THR  49          HG23      THR  49  97.239  -5.035   7.297
  379    H    ASP  50           H        ASP  50  96.945  -4.476  11.448
  380    HA   ASP  50           HA       ASP  50  95.324  -4.049  13.652
  381    HB2  ASP  50           HB2      ASP  50  97.311  -2.532  14.406
  382    HB3  ASP  50           HB1      ASP  50  97.588  -4.254  14.152
  383    H    ALA  51           H        ALA  51  96.551  -1.645  11.340
  384    HA   ALA  51           HA       ALA  51  95.527   0.659  12.523
  385    HB1  ALA  51           HB1      ALA  51  95.523   1.591  10.192
  386    HB2  ALA  51           HB2      ALA  51  95.914  -0.027   9.605
  387    HB3  ALA  51           HB3      ALA  51  97.040   0.824  10.662
  388    H    ASN  52           H        ASN  52  93.946  -1.683  10.396
  389    HA   ASN  52           HA       ASN  52  91.493  -0.146  10.273
  390    HB2  ASN  52           HB2      ASN  52  92.606  -2.528   8.994
  391    HB3  ASN  52           HB1      ASN  52  90.910  -2.731   9.421
  392   HD21  ASN  52          HD21      ASN  52  90.169  -2.577   7.203
  393   HD22  ASN  52          HD22      ASN  52  90.227  -1.113   6.344
  394    H    LYS  53           H        LYS  53  92.838  -2.681  12.237
  395    HA   LYS  53           HA       LYS  53  90.291  -3.399  13.428
  396    HB2  LYS  53           HB2      LYS  53  91.645  -5.270  13.389
  397    HB3  LYS  53           HB3      LYS  53  93.119  -4.337  13.610
  398    HG2  LYS  53           HG2      LYS  53  92.668  -4.024  15.951
  399    HG3  LYS  53           HG3      LYS  53  91.047  -4.700  15.783
  400    HD2  LYS  53           HD2      LYS  53  92.227  -6.841  14.952
  401    HD3  LYS  53           HD3      LYS  53  93.700  -6.130  15.611
  402    HE2  LYS  53           HE2      LYS  53  91.169  -6.854  17.100
  403    HE3  LYS  53           HE3      LYS  53  92.792  -7.495  17.353
  404    HZ1  LYS  53           HZ1      LYS  53  92.892  -5.939  18.939
  405    HZ2  LYS  53           HZ2      LYS  53  91.612  -5.030  18.289
  406    HZ3  LYS  53           HZ3      LYS  53  93.181  -4.860  17.662
  407    H    ASN  54           H        ASN  54  92.623  -1.001  13.766
  408    HA   ASN  54           HA       ASN  54  92.639  -0.600  16.570
  409    HB2  ASN  54           HB2      ASN  54  93.815   1.320  16.104
  410    HB3  ASN  54           HB1      ASN  54  94.088   0.432  14.611
  411   HD21  ASN  54          HD21      ASN  54  91.457   0.847  13.452
  412   HD22  ASN  54          HD22      ASN  54  91.317   2.496  13.080
  413    H    LYS  55           H        LYS  55  90.312  -0.063  14.152
  414    HA   LYS  55           HA       LYS  55  88.208   0.877  14.154
  415    HB2  LYS  55           HB2      LYS  55  88.541   0.537  17.141
  416    HB3  LYS  55           HB3      LYS  55  87.024   0.930  16.335
  417    HG2  LYS  55           HG2      LYS  55  87.522  -1.202  14.900
  418    HG3  LYS  55           HG3      LYS  55  88.619  -1.621  16.215
  419    HD2  LYS  55           HD2      LYS  55  85.672  -0.982  16.536
  420    HD3  LYS  55           HD3      LYS  55  86.373  -2.600  16.566
  421    HE2  LYS  55           HE2      LYS  55  87.866  -1.754  18.468
  422    HE3  LYS  55           HE3      LYS  55  86.801  -0.351  18.540
  423    HZ1  LYS  55           HZ1      LYS  55  84.928  -2.007  18.716
  424    HZ2  LYS  55           HZ2      LYS  55  85.945  -1.887  20.071
  425    HZ3  LYS  55           HZ3      LYS  55  86.108  -3.192  18.996
  426    H    GLY  56           H        GLY  56  89.711   2.790  13.484
  427    HA2  GLY  56           HA2      GLY  56  89.868   4.955  15.404
  428    HA3  GLY  56           HA3      GLY  56  90.370   5.012  13.718
  429    H    ILE  57           H        ILE  57  88.007   4.238  12.455
  430    HA   ILE  57           HA       ILE  57  85.953   6.133  13.363
  431    HB   ILE  57           HB       ILE  57  85.798   7.217  11.210
  432   HG12  ILE  57          HG12      ILE  57  87.756   6.656   9.557
  433   HG13  ILE  57          HG13      ILE  57  87.844   5.135  10.440
  434   HG21  ILE  57          HG21      ILE  57  88.708   7.096  12.049
  435   HG22  ILE  57          HG22      ILE  57  87.474   8.044  12.878
  436   HG23  ILE  57          HG23      ILE  57  87.905   8.424  11.211
  437   HD11  ILE  57          HD11      ILE  57  86.180   5.622   8.299
  438   HD12  ILE  57          HD12      ILE  57  85.098   5.882   9.663
  439   HD13  ILE  57          HD13      ILE  57  85.942   4.346   9.485
  440    H    THR  58           H        THR  58  83.982   5.954  11.833
  441    HA   THR  58           HA       THR  58  83.526   3.080  11.321
  442    HB   THR  58           HB       THR  58  81.601   5.297  12.037
  443    HG1  THR  58           HG1      THR  58  81.752   2.970  13.489
  444   HG21  THR  58          HG21      THR  58  79.952   3.358  12.127
  445   HG22  THR  58          HG22      THR  58  81.147   2.421  11.234
  446   HG23  THR  58          HG23      THR  58  80.442   3.866  10.511
  447    H    TRP  59           H        TRP  59  82.707   2.375   9.401
  448    HA   TRP  59           HA       TRP  59  83.114   3.951   7.087
  449    HB2  TRP  59           HB2      TRP  59  81.299   1.544   7.199
  450    HB3  TRP  59           HB1      TRP  59  82.267   2.129   5.845
  451    HD1  TRP  59           HD1      TRP  59  85.029   2.520   7.249
  452    HE1  TRP  59           HE1      TRP  59  86.389   0.469   8.029
  453    HE3  TRP  59           HE3      TRP  59  81.308  -0.954   7.580
  454    HZ2  TRP  59           HZ2      TRP  59  85.941  -2.271   8.733
  455    HZ3  TRP  59           HZ3      TRP  59  81.800  -3.270   8.297
  456    HH2  TRP  59           HH2      TRP  59  84.112  -3.930   8.875
  457    H    LYS  60           H        LYS  60  81.749   5.144   5.861
  458    HA   LYS  60           HA       LYS  60  78.887   5.142   6.305
  459    HB2  LYS  60           HB2      LYS  60  80.598   7.527   7.054
  460    HB3  LYS  60           HB3      LYS  60  78.856   7.616   6.799
  461    HG2  LYS  60           HG2      LYS  60  78.665   5.728   8.531
  462    HG3  LYS  60           HG3      LYS  60  80.347   6.073   8.927
  463    HD2  LYS  60           HD2      LYS  60  78.249   8.247   8.885
  464    HD3  LYS  60           HD3      LYS  60  78.560   7.280  10.326
  465    HE2  LYS  60           HE2      LYS  60  80.977   7.927  10.174
  466    HE3  LYS  60           HE3      LYS  60  80.560   9.007   8.844
  467    HZ1  LYS  60           HZ1      LYS  60  79.594   9.145  11.644
  468    HZ2  LYS  60           HZ2      LYS  60  78.937  10.070  10.379
  469    HZ3  LYS  60           HZ3      LYS  60  80.562  10.276  10.830
  470    H    GLU  61           H        GLU  61  78.366   7.634   5.078
  471    HA   GLU  61           HA       GLU  61  78.902   6.942   2.337
  472    HB2  GLU  61           HB2      GLU  61  76.760   7.974   3.125
  473    HB3  GLU  61           HB3      GLU  61  77.646   9.468   3.431
  474    HG2  GLU  61           HG2      GLU  61  78.263   9.644   1.090
  475    HG3  GLU  61           HG3      GLU  61  77.549   8.071   0.743
  476    H    GLU  62           H        GLU  62  79.609   9.863   4.279
  477    HA   GLU  62           HA       GLU  62  81.416  10.937   2.355
  478    HB2  GLU  62           HB2      GLU  62  81.029  11.561   5.291
  479    HB3  GLU  62           HB3      GLU  62  82.036  12.506   4.194
  480    HG2  GLU  62           HG2      GLU  62  80.020  12.826   2.727
  481    HG3  GLU  62           HG3      GLU  62  79.050  12.037   3.970
  482    H    THR  63           H        THR  63  81.870   9.099   5.362
  483    HA   THR  63           HA       THR  63  84.648   9.250   5.551
  484    HB   THR  63           HB       THR  63  84.530   7.150   6.807
  485    HG1  THR  63           HG1      THR  63  82.737   5.914   6.753
  486   HG21  THR  63          HG21      THR  63  82.608   7.815   8.357
  487   HG22  THR  63          HG22      THR  63  82.304   9.137   7.232
  488   HG23  THR  63          HG23      THR  63  83.850   9.032   8.073
  489    H    LEU  64           H        LEU  64  82.587   7.219   3.555
  490    HA   LEU  64           HA       LEU  64  84.681   5.546   2.578
  491    HB2  LEU  64           HB2      LEU  64  81.825   5.891   2.108
  492    HB3  LEU  64           HB3      LEU  64  82.704   5.563   0.623
  493    HG   LEU  64           HG       LEU  64  83.017   3.907   3.139
  494   HD11  LEU  64          HD11      LEU  64  80.904   3.213   2.629
  495   HD12  LEU  64          HD12      LEU  64  81.713   2.295   1.360
  496   HD13  LEU  64          HD13      LEU  64  80.977   3.850   0.987
  497   HD21  LEU  64          HD21      LEU  64  84.888   3.382   1.887
  498   HD22  LEU  64          HD22      LEU  64  84.134   3.845   0.362
  499   HD23  LEU  64          HD23      LEU  64  83.741   2.296   1.105
  500    H    MET  65           H        MET  65  83.286   8.623   1.576
  501    HA   MET  65           HA       MET  65  84.390   8.759  -1.009
  502    HB2  MET  65           HB2      MET  65  83.768  10.985   0.939
  503    HB3  MET  65           HB1      MET  65  84.147  11.222  -0.767
  504    HG2  MET  65           HG2      MET  65  82.211   9.978  -1.454
  505    HG3  MET  65           HG1      MET  65  81.903   9.440   0.195
  506    HE1  MET  65           HE1      MET  65  81.953  12.404  -2.305
  507    HE2  MET  65           HE2      MET  65  80.360  13.039  -1.899
  508    HE3  MET  65           HE3      MET  65  80.535  11.348  -2.359
  509    H    GLU  66           H        GLU  66  85.641  10.222   2.003
  510    HA   GLU  66           HA       GLU  66  88.085  11.089   0.909
  511    HB2  GLU  66           HB2      GLU  66  87.252  10.387   3.726
  512    HB3  GLU  66           HB3      GLU  66  88.865  10.987   3.341
  513    HG2  GLU  66           HG2      GLU  66  86.394  12.455   2.424
  514    HG3  GLU  66           HG3      GLU  66  87.078  12.727   4.025
  515    H    TYR  67           H        TYR  67  87.006   8.011   2.126
  516    HA   TYR  67           HA       TYR  67  89.635   6.821   2.230
  517    HB2  TYR  67           HB2      TYR  67  87.971   5.936   3.711
  518    HB3  TYR  67           HB3      TYR  67  86.836   5.701   2.388
  519    HD1  TYR  67           HD2      TYR  67  87.124   3.882   0.770
  520    HD2  TYR  67           HD1      TYR  67  89.842   4.408   4.054
  521    HE1  TYR  67           HE2      TYR  67  88.021   1.600   0.395
  522    HE2  TYR  67           HE1      TYR  67  90.737   2.126   3.681
  523    HH   TYR  67           HH       TYR  67  90.343   0.427   0.937
  524    H    LEU  68           H        LEU  68  87.092   7.214  -0.106
  525    HA   LEU  68           HA       LEU  68  88.020   5.169  -1.904
  526    HB2  LEU  68           HB2      LEU  68  85.847   7.178  -1.834
  527    HB3  LEU  68           HB3      LEU  68  86.426   6.761  -3.441
  528    HG   LEU  68           HG       LEU  68  85.610   4.713  -1.361
  529   HD11  LEU  68          HD11      LEU  68  83.625   4.459  -3.017
  530   HD12  LEU  68          HD12      LEU  68  84.057   6.083  -3.552
  531   HD13  LEU  68          HD13      LEU  68  83.596   5.798  -1.875
  532   HD21  LEU  68          HD21      LEU  68  85.342   3.486  -3.735
  533   HD22  LEU  68          HD22      LEU  68  86.860   3.484  -2.843
  534   HD23  LEU  68          HD23      LEU  68  86.619   4.618  -4.166
  535    H    GLU  69           H        GLU  69  88.802   8.498  -1.330
  536    HA   GLU  69           HA       GLU  69  90.146   8.735  -3.934
  537    HB2  GLU  69           HB2      GLU  69  90.187  11.039  -3.602
  538    HB3  GLU  69           HB3      GLU  69  88.691  10.580  -2.797
  539    HG2  GLU  69           HG2      GLU  69  89.668  11.913  -1.164
  540    HG3  GLU  69           HG3      GLU  69  90.246  10.322  -0.687
  541    H    ASN  70           H        ASN  70  90.796   7.776  -0.779
  542    HA   ASN  70           HA       ASN  70  93.591   7.450  -1.325
  543    HB2  ASN  70           HB2      ASN  70  94.481   8.859   0.436
  544    HB3  ASN  70           HB1      ASN  70  93.553   9.847  -0.685
  545   HD21  ASN  70          HD21      ASN  70  93.516   8.434   2.582
  546   HD22  ASN  70          HD22      ASN  70  92.245   9.399   3.161
  547    HA   PRO  71           HA       PRO  71  91.252   4.496   1.551
  548    HB2  PRO  71           HB2      PRO  71  93.030   2.710  -0.061
  549    HB3  PRO  71           HB1      PRO  71  91.347   2.467   0.443
  550    HG2  PRO  71           HG2      PRO  71  91.988   3.155  -2.060
  551    HG3  PRO  71           HG1      PRO  71  90.507   3.727  -1.275
  552    HD2  PRO  71           HD2      PRO  71  92.994   5.230  -1.912
  553    HD3  PRO  71           HD1      PRO  71  91.331   5.825  -1.723
  554    H    LYS  72           H        LYS  72  94.648   4.732   0.561
  555    HA   LYS  72           HA       LYS  72  95.641   3.389   2.911
  556    HB2  LYS  72           HB2      LYS  72  96.807   3.302   0.735
  557    HB3  LYS  72           HB3      LYS  72  97.113   5.032   0.845
  558    HG2  LYS  72           HG2      LYS  72  99.099   4.181   1.717
  559    HG3  LYS  72           HG3      LYS  72  98.161   4.404   3.190
  560    HD2  LYS  72           HD2      LYS  72  98.970   2.216   3.432
  561    HD3  LYS  72           HD3      LYS  72  97.360   1.952   2.767
  562    HE2  LYS  72           HE2      LYS  72  98.596   0.609   1.347
  563    HE3  LYS  72           HE3      LYS  72  98.667   2.125   0.451
  564    HZ1  LYS  72           HZ1      LYS  72 100.799   0.665   1.355
  565    HZ2  LYS  72           HZ2      LYS  72 100.706   1.973   2.437
  566    HZ3  LYS  72           HZ3      LYS  72 100.845   2.255   0.767
  567    H    LYS  73           H        LYS  73  95.678   6.767   1.748
  568    HA   LYS  73           HA       LYS  73  97.049   7.779   4.004
  569    HB2  LYS  73           HB2      LYS  73  96.486   8.829   1.621
  570    HB3  LYS  73           HB3      LYS  73  95.152   9.544   2.526
  571    HG2  LYS  73           HG2      LYS  73  96.881  10.283   4.249
  572    HG3  LYS  73           HG3      LYS  73  98.115   9.810   3.082
  573    HD2  LYS  73           HD2      LYS  73  97.863  12.039   2.500
  574    HD3  LYS  73           HD3      LYS  73  96.656  11.316   1.440
  575    HE2  LYS  73           HE2      LYS  73  95.504  13.101   2.478
  576    HE3  LYS  73           HE3      LYS  73  95.003  11.685   3.401
  577    HZ1  LYS  73           HZ1      LYS  73  95.947  13.872   4.536
  578    HZ2  LYS  73           HZ2      LYS  73  97.413  13.047   4.300
  579    HZ3  LYS  73           HZ3      LYS  73  96.167  12.329   5.205
  580    H    TYR  74           H        TYR  74  93.765   6.823   3.587
  581    HA   TYR  74           HA       TYR  74  92.673   8.533   5.626
  582    HB2  TYR  74           HB2      TYR  74  91.491   7.209   3.647
  583    HB3  TYR  74           HB3      TYR  74  91.356   5.955   4.877
  584    HD1  TYR  74           HD1      TYR  74  90.946   9.688   4.636
  585    HD2  TYR  74           HD2      TYR  74  89.401   5.976   6.152
  586    HE1  TYR  74           HE1      TYR  74  89.039  10.897   5.658
  587    HE2  TYR  74           HE2      TYR  74  87.495   7.188   7.173
  588    HH   TYR  74           HH       TYR  74  86.601   9.176   7.603
  589    H    ILE  75           H        ILE  75  93.299   5.019   5.497
  590    HA   ILE  75           HA       ILE  75  93.785   5.092   8.417
  591    HB   ILE  75           HB       ILE  75  92.386   2.890   6.876
  592   HG12  ILE  75          HG12      ILE  75  91.200   4.616   9.052
  593   HG13  ILE  75          HG13      ILE  75  91.159   5.137   7.370
  594   HG21  ILE  75          HG21      ILE  75  93.546   1.862   8.671
  595   HG22  ILE  75          HG22      ILE  75  91.929   2.143   9.312
  596   HG23  ILE  75          HG23      ILE  75  93.251   3.223   9.752
  597   HD11  ILE  75          HD11      ILE  75  89.097   3.905   8.021
  598   HD12  ILE  75          HD12      ILE  75  90.084   2.489   8.381
  599   HD13  ILE  75          HD13      ILE  75  89.979   3.094   6.728
  600    HA   PRO  76           HA       PRO  76  97.574   3.767   5.965
  601    HB2  PRO  76           HB2      PRO  76  98.561   4.557   8.688
  602    HB3  PRO  76           HB1      PRO  76  99.298   4.842   7.098
  603    HG2  PRO  76           HG2      PRO  76  97.991   6.774   8.384
  604    HG3  PRO  76           HG1      PRO  76  97.912   6.612   6.620
  605    HD2  PRO  76           HD2      PRO  76  95.816   6.036   8.646
  606    HD3  PRO  76           HD1      PRO  76  95.638   6.456   6.929
  607    H    GLY  77           H        GLY  77  98.101   1.670   5.890
  608    HA2  GLY  77           HA2      GLY  77  99.115  -0.229   7.098
  609    HA3  GLY  77           HA3      GLY  77  97.927   0.051   8.370
  610    H    THR  78           H        THR  78  95.821   0.654   6.366
  611    HA   THR  78           HA       THR  78  94.593  -1.840   6.184
  612    HB   THR  78           HB       THR  78  93.468   0.386   5.935
  613    HG1  THR  78           HG1      THR  78  93.097  -1.858   4.392
  614   HG21  THR  78          HG21      THR  78  94.367   0.229   3.060
  615   HG22  THR  78          HG22      THR  78  95.258   1.162   4.263
  616   HG23  THR  78          HG23      THR  78  93.584   1.575   3.889
  617    H    LYS  79           H        LYS  79  94.508  -3.437   4.648
  618    HA   LYS  79           HA       LYS  79  96.666  -3.423   2.678
  619    HB2  LYS  79           HB2      LYS  79  96.074  -5.402   4.200
  620    HB3  LYS  79           HB3      LYS  79  94.682  -5.646   3.149
  621    HG2  LYS  79           HG2      LYS  79  95.994  -6.762   1.691
  622    HG3  LYS  79           HG3      LYS  79  96.936  -5.296   1.437
  623    HD2  LYS  79           HD2      LYS  79  97.428  -7.175   3.762
  624    HD3  LYS  79           HD3      LYS  79  98.257  -7.329   2.214
  625    HE2  LYS  79           HE2      LYS  79  98.240  -4.740   3.776
  626    HE3  LYS  79           HE3      LYS  79  99.475  -5.975   4.013
  627    HZ1  LYS  79           HZ1      LYS  79  99.626  -4.030   2.184
  628    HZ2  LYS  79           HZ2      LYS  79  98.947  -5.280   1.255
  629    HZ3  LYS  79           HZ3      LYS  79 100.428  -5.519   2.053
  630    H    MET  80           H        MET  80  95.949  -1.961   1.119
  631    HA   MET  80           HA       MET  80  94.359  -3.019  -0.964
  632    HB2  MET  80           HB2      MET  80  92.428  -2.549   0.389
  633    HB3  MET  80           HB1      MET  80  93.027  -0.936   0.779
  634    HG2  MET  80           HG2      MET  80  92.708  -0.165  -1.454
  635    HG3  MET  80           HG1      MET  80  92.493  -1.803  -2.068
  636    HE1  MET  80           HE1      MET  80  90.374  -0.094  -3.167
  637    HE2  MET  80           HE2      MET  80  90.855   1.127  -1.992
  638    HE3  MET  80           HE3      MET  80  89.171   0.618  -2.083
  639    H    ILE  81           H        ILE  81  95.949  -2.354  -2.337
  640    HA   ILE  81           HA       ILE  81  96.241   0.564  -2.698
  641    HB   ILE  81           HB       ILE  81  98.471  -1.480  -2.867
  642   HG12  ILE  81          HG12      ILE  81  99.305   0.194  -0.972
  643   HG13  ILE  81          HG13      ILE  81  97.579   0.479  -0.766
  644   HG21  ILE  81          HG21      ILE  81  98.374   1.519  -3.299
  645   HG22  ILE  81          HG22      ILE  81  98.792   0.287  -4.489
  646   HG23  ILE  81          HG23      ILE  81  99.869   0.600  -3.129
  647   HD11  ILE  81          HD11      ILE  81  99.186  -1.904  -0.092
  648   HD12  ILE  81          HD12      ILE  81  97.655  -2.265  -0.885
  649   HD13  ILE  81          HD13      ILE  81  97.674  -1.332   0.609
  650    H    PHE  82           H        PHE  82  94.830   0.577  -4.444
  651    HA   PHE  82           HA       PHE  82  95.807  -0.821  -6.868
  652    HB2  PHE  82           HB2      PHE  82  93.742  -1.878  -6.047
  653    HB3  PHE  82           HB1      PHE  82  92.926  -0.317  -6.084
  654    HD1  PHE  82           HD1      PHE  82  94.926  -2.586  -8.303
  655    HD2  PHE  82           HD2      PHE  82  91.758   0.302  -8.016
  656    HE1  PHE  82           HE1      PHE  82  94.403  -2.920 -10.704
  657    HE2  PHE  82           HE2      PHE  82  91.237  -0.033 -10.417
  658    HZ   PHE  82           HZ       PHE  82  92.559  -1.643 -11.761
  659    H    ALA  83           H        ALA  83  93.273   1.589  -6.186
  660    HA   ALA  83           HA       ALA  83  94.678   3.800  -7.274
  661    HB1  ALA  83           HB1      ALA  83  92.719   2.420  -9.123
  662    HB2  ALA  83           HB2      ALA  83  94.447   2.639  -9.396
  663    HB3  ALA  83           HB3      ALA  83  93.372   4.036  -9.381
  664    H    GLY  84           H        GLY  84  93.786   5.448  -6.224
  665    HA2  GLY  84           HA2      GLY  84  91.186   5.254  -5.015
  666    HA3  GLY  84           HA3      GLY  84  92.254   6.654  -4.978
  667    H    ILE  85           H        ILE  85  89.750   7.336  -5.243
  668    HA   ILE  85           HA       ILE  85  88.983   7.479  -8.063
  669    HB   ILE  85           HB       ILE  85  87.649   8.460  -5.533
  670   HG12  ILE  85          HG12      ILE  85  87.850   5.910  -6.255
  671   HG13  ILE  85          HG13      ILE  85  86.329   6.544  -5.636
  672   HG21  ILE  85          HG21      ILE  85  86.875   8.673  -8.442
  673   HG22  ILE  85          HG22      ILE  85  86.903   9.943  -7.218
  674   HG23  ILE  85          HG23      ILE  85  85.662   8.691  -7.163
  675   HD11  ILE  85          HD11      ILE  85  86.260   5.150  -7.820
  676   HD12  ILE  85          HD12      ILE  85  86.921   6.592  -8.590
  677   HD13  ILE  85          HD13      ILE  85  85.359   6.665  -7.776
  678    H    LYS  86           H        LYS  86  88.385   9.599  -9.002
  679    HA   LYS  86           HA       LYS  86  90.312  11.673  -8.157
  680    HB2  LYS  86           HB2      LYS  86  89.055  11.070 -10.835
  681    HB3  LYS  86           HB3      LYS  86  90.013  12.515 -10.511
  682    HG2  LYS  86           HG2      LYS  86  91.968  11.226 -10.028
  683    HG3  LYS  86           HG3      LYS  86  91.046   9.724  -9.967
  684    HD2  LYS  86           HD2      LYS  86  90.478  10.043 -12.391
  685    HD3  LYS  86           HD3      LYS  86  91.561  11.436 -12.416
  686    HE2  LYS  86           HE2      LYS  86  93.452  10.025 -11.783
  687    HE3  LYS  86           HE3      LYS  86  92.389   8.624 -11.638
  688    HZ1  LYS  86           HZ1      LYS  86  93.633   9.651 -13.943
  689    HZ2  LYS  86           HZ2      LYS  86  91.949   9.738 -14.146
  690    HZ3  LYS  86           HZ3      LYS  86  92.688   8.252 -13.783
  691    H    LYS  87           H        LYS  87  87.215  11.697  -9.964
  692    HA   LYS  87           HA       LYS  87  86.573  14.300  -8.890
  693    HB2  LYS  87           HB2      LYS  87  84.791  12.470 -10.502
  694    HB3  LYS  87           HB3      LYS  87  84.636  14.214 -10.304
  695    HG2  LYS  87           HG2      LYS  87  87.013  12.843 -11.595
  696    HG3  LYS  87           HG3      LYS  87  85.678  13.574 -12.485
  697    HD2  LYS  87           HD2      LYS  87  86.215  15.715 -11.114
  698    HD3  LYS  87           HD3      LYS  87  87.755  14.928 -10.768
  699    HE2  LYS  87           HE2      LYS  87  86.653  15.407 -13.552
  700    HE3  LYS  87           HE3      LYS  87  87.878  16.406 -12.769
  701    HZ1  LYS  87           HZ1      LYS  87  89.286  14.443 -12.573
  702    HZ2  LYS  87           HZ2      LYS  87  88.900  14.765 -14.196
  703    HZ3  LYS  87           HZ3      LYS  87  88.115  13.507 -13.367
  704    H    LYS  88           H        LYS  88  84.476  14.765  -7.883
  705    HA   LYS  88           HA       LYS  88  84.084  13.150  -5.559
  706    HB2  LYS  88           HB2      LYS  88  83.764  15.568  -5.469
  707    HB3  LYS  88           HB3      LYS  88  82.468  15.463  -6.660
  708    HG2  LYS  88           HG2      LYS  88  81.144  14.070  -5.111
  709    HG3  LYS  88           HG3      LYS  88  82.441  14.156  -3.920
  710    HD2  LYS  88           HD2      LYS  88  81.977  16.344  -3.366
  711    HD3  LYS  88           HD3      LYS  88  81.431  16.752  -4.992
  712    HE2  LYS  88           HE2      LYS  88  79.297  15.793  -4.644
  713    HE3  LYS  88           HE3      LYS  88  79.838  14.892  -3.229
  714    HZ1  LYS  88           HZ1      LYS  88  78.573  16.779  -2.521
  715    HZ2  LYS  88           HZ2      LYS  88  79.529  17.836  -3.447
  716    HZ3  LYS  88           HZ3      LYS  88  80.196  17.038  -2.104
  717    H    THR  89           H        THR  89  81.949  13.944  -8.317
  718    HA   THR  89           HA       THR  89  79.800  12.335  -7.662
  719    HB   THR  89           HB       THR  89  79.366  12.194 -10.118
  720    HG1  THR  89           HG1      THR  89  81.630  12.135 -10.669
  721   HG21  THR  89          HG21      THR  89  80.127  14.841  -8.870
  722   HG22  THR  89          HG22      THR  89  78.524  14.113  -8.966
  723   HG23  THR  89          HG23      THR  89  79.305  14.723 -10.425
  724    H    GLU  90           H        GLU  90  82.946  11.413  -8.825
  725    HA   GLU  90           HA       GLU  90  82.257   8.795  -9.721
  726    HB2  GLU  90           HB2      GLU  90  84.841  10.065  -8.817
  727    HB3  GLU  90           HB3      GLU  90  84.749   8.364  -9.267
  728    HG2  GLU  90           HG2      GLU  90  84.149   8.867 -11.494
  729    HG3  GLU  90           HG3      GLU  90  83.701  10.523 -11.092
  730    H    ARG  91           H        ARG  91  83.285  10.182  -6.646
  731    HA   ARG  91           HA       ARG  91  83.350   7.664  -5.251
  732    HB2  ARG  91           HB2      ARG  91  83.273  10.516  -4.218
  733    HB3  ARG  91           HB3      ARG  91  83.584   9.086  -3.236
  734    HG2  ARG  91           HG2      ARG  91  85.494   8.568  -4.851
  735    HG3  ARG  91           HG3      ARG  91  85.279  10.204  -5.470
  736    HD2  ARG  91           HD2      ARG  91  85.365  10.303  -2.590
  737    HD3  ARG  91           HD3      ARG  91  86.755   9.400  -3.177
  738    HE   ARG  91           HE       ARG  91  87.559  11.351  -4.177
  739   HH11  ARG  91          HH21      ARG  91  84.300  11.741  -3.058
  740   HH12  ARG  91          HH22      ARG  91  84.294  13.460  -3.269
  741   HH21  ARG  91          HH11      ARG  91  87.546  13.599  -4.458
  742   HH22  ARG  91          HH12      ARG  91  86.127  14.510  -4.062
  743    H    GLU  92           H        GLU  92  81.124  10.455  -5.324
  744    HA   GLU  92           HA       GLU  92  79.221   9.450  -3.525
  745    HB2  GLU  92           HB2      GLU  92  79.358  11.800  -4.504
  746    HB3  GLU  92           HB3      GLU  92  78.566  11.146  -5.938
  747    HG2  GLU  92           HG2      GLU  92  76.740  10.278  -4.422
  748    HG3  GLU  92           HG3      GLU  92  77.487  11.187  -3.109
  749    H    ASP  93           H        ASP  93  79.240   9.304  -7.099
  750    HA   ASP  93           HA       ASP  93  76.942   7.706  -7.376
  751    HB2  ASP  93           HB2      ASP  93  79.395   7.847  -9.150
  752    HB3  ASP  93           HB1      ASP  93  77.843   7.147  -9.609
  753    H    LEU  94           H        LEU  94  80.382   6.800  -7.243
  754    HA   LEU  94           HA       LEU  94  80.082   4.028  -7.461
  755    HB2  LEU  94           HB2      LEU  94  82.274   5.081  -7.598
  756    HB3  LEU  94           HB3      LEU  94  82.135   5.633  -5.931
  757    HG   LEU  94           HG       LEU  94  82.130   3.347  -5.114
  758   HD11  LEU  94          HD11      LEU  94  82.673   1.564  -6.954
  759   HD12  LEU  94          HD12      LEU  94  81.943   2.736  -8.051
  760   HD13  LEU  94          HD13      LEU  94  81.003   2.073  -6.715
  761   HD21  LEU  94          HD21      LEU  94  84.318   3.700  -7.184
  762   HD22  LEU  94          HD22      LEU  94  84.398   2.716  -5.725
  763   HD23  LEU  94          HD23      LEU  94  84.313   4.471  -5.598
  764    H    ILE  95           H        ILE  95  79.896   6.165  -4.673
  765    HA   ILE  95           HA       ILE  95  79.686   4.041  -2.780
  766    HB   ILE  95           HB       ILE  95  79.358   7.017  -2.661
  767   HG12  ILE  95          HG12      ILE  95  81.047   5.418  -0.795
  768   HG13  ILE  95          HG13      ILE  95  81.524   5.388  -2.485
  769   HG21  ILE  95          HG21      ILE  95  79.099   6.476  -0.080
  770   HG22  ILE  95          HG22      ILE  95  78.397   4.974  -0.680
  771   HG23  ILE  95          HG23      ILE  95  77.678   6.521  -1.122
  772   HD11  ILE  95          HD11      ILE  95  82.296   7.320  -0.724
  773   HD12  ILE  95          HD12      ILE  95  80.874   8.077  -1.435
  774   HD13  ILE  95          HD13      ILE  95  82.204   7.553  -2.465
  775    H    ALA  96           H        ALA  96  77.443   5.886  -4.707
  776    HA   ALA  96           HA       ALA  96  75.073   5.303  -3.281
  777    HB1  ALA  96           HB1      ALA  96  73.909   5.865  -5.332
  778    HB2  ALA  96           HB2      ALA  96  75.384   5.641  -6.274
  779    HB3  ALA  96           HB3      ALA  96  75.262   6.979  -5.131
  780    H    TYR  97           H        TYR  97  76.956   3.550  -5.677
  781    HA   TYR  97           HA       TYR  97  75.056   1.415  -5.985
  782    HB2  TYR  97           HB2      TYR  97  76.573   1.818  -7.807
  783    HB3  TYR  97           HB3      TYR  97  77.973   1.682  -6.743
  784    HD1  TYR  97           HD1      TYR  97  75.091  -0.229  -8.145
  785    HD2  TYR  97           HD2      TYR  97  78.943  -0.432  -6.261
  786    HE1  TYR  97           HE1      TYR  97  75.150  -2.676  -8.532
  787    HE2  TYR  97           HE2      TYR  97  79.003  -2.880  -6.646
  788    HH   TYR  97           HH       TYR  97  77.775  -4.476  -8.504
  789    H    LEU  98           H        LEU  98  78.197   1.760  -4.310
  790    HA   LEU  98           HA       LEU  98  78.396  -0.757  -3.189
  791    HB2  LEU  98           HB2      LEU  98  79.277   1.961  -2.266
  792    HB3  LEU  98           HB3      LEU  98  79.526   0.564  -1.227
  793    HG   LEU  98           HG       LEU  98  80.379   0.415  -4.110
  794   HD11  LEU  98          HD11      LEU  98  82.285   1.362  -1.991
  795   HD12  LEU  98          HD12      LEU  98  81.313   2.532  -2.880
  796   HD13  LEU  98          HD13      LEU  98  82.426   1.478  -3.743
  797   HD21  LEU  98          HD21      LEU  98  81.595  -0.715  -1.579
  798   HD22  LEU  98          HD22      LEU  98  81.940  -1.202  -3.238
  799   HD23  LEU  98          HD23      LEU  98  80.369  -1.562  -2.520
  800    H    LYS  99           H        LYS  99  76.177   1.795  -2.432
  801    HA   LYS  99           HA       LYS  99  75.467   0.779   0.180
  802    HB2  LYS  99           HB2      LYS  99  74.441   2.965  -1.606
  803    HB3  LYS  99           HB3      LYS  99  73.483   2.436  -0.223
  804    HG2  LYS  99           HG2      LYS  99  75.569   2.774   1.200
  805    HG3  LYS  99           HG3      LYS  99  76.290   3.571  -0.197
  806    HD2  LYS  99           HD2      LYS  99  73.635   4.404   1.001
  807    HD3  LYS  99           HD3      LYS  99  75.174   5.128   1.466
  808    HE2  LYS  99           HE2      LYS  99  75.542   5.587  -1.027
  809    HE3  LYS  99           HE3      LYS  99  73.841   5.179  -1.247
  810    HZ1  LYS  99           HZ1      LYS  99  73.801   7.451  -0.925
  811    HZ2  LYS  99           HZ2      LYS  99  75.031   7.423   0.246
  812    HZ3  LYS  99           HZ3      LYS  99  73.472   6.867   0.633
  813    H    LYS 100           H        LYS 100  73.823   0.919  -2.991
  814    HA   LYS 100           HA       LYS 100  71.630  -0.703  -2.105
  815    HB2  LYS 100           HB2      LYS 100  71.663   0.986  -4.047
  816    HB3  LYS 100           HB3      LYS 100  72.430  -0.297  -4.981
  817    HG2  LYS 100           HG2      LYS 100  70.373  -1.704  -3.924
  818    HG3  LYS 100           HG3      LYS 100  69.634  -0.105  -3.964
  819    HD2  LYS 100           HD2      LYS 100  69.091  -0.901  -6.086
  820    HD3  LYS 100           HD3      LYS 100  70.594  -0.042  -6.422
  821    HE2  LYS 100           HE2      LYS 100  70.849  -2.156  -7.479
  822    HE3  LYS 100           HE3      LYS 100  71.781  -2.281  -5.987
  823    HZ1  LYS 100           HZ1      LYS 100  68.948  -3.069  -6.009
  824    HZ2  LYS 100           HZ2      LYS 100  70.207  -3.608  -5.003
  825    HZ3  LYS 100           HZ3      LYS 100  70.116  -4.138  -6.615
  826    H    ALA 101           H        ALA 101  74.795  -1.368  -3.260
  827    HA   ALA 101           HA       ALA 101  74.174  -4.065  -4.153
  828    HB1  ALA 101           HB1      ALA 101  75.923  -2.722  -5.283
  829    HB2  ALA 101           HB2      ALA 101  76.563  -4.228  -4.624
  830    HB3  ALA 101           HB3      ALA 101  76.853  -2.704  -3.785
  831    H    THR 102           H        THR 102  75.494  -2.438  -1.341
  832    HA   THR 102           HA       THR 102  76.286  -4.952  -0.086
  833    HB   THR 102           HB       THR 102  76.946  -3.484   1.810
  834    HG1  THR 102           HG1      THR 102  75.532  -1.686   0.251
  835   HG21  THR 102          HG21      THR 102  77.891  -2.934  -0.993
  836   HG22  THR 102          HG22      THR 102  78.694  -3.836   0.290
  837   HG23  THR 102          HG23      THR 102  78.606  -2.077   0.373
  838    H    ASN 103           H        ASN 103  73.505  -3.140  -0.472
  839    HA   ASN 103           HA       ASN 103  72.310  -3.800   2.105
  840    HB2  ASN 103           HB2      ASN 103  71.495  -2.210  -0.303
  841    HB3  ASN 103           HB1      ASN 103  70.266  -2.749   0.833
  842   HD21  ASN 103          HD21      ASN 103  73.510  -2.040   1.983
  843   HD22  ASN 103          HD22      ASN 103  73.103  -0.609   2.798
  844    H    GLU 104           H        GLU 104  72.420  -4.984  -1.156
  845    HA   GLU 104           HA       GLU 104  70.991  -7.382  -0.387
  846    HB2  GLU 104           HB2      GLU 104  69.333  -7.172  -2.253
  847    HB3  GLU 104           HB3      GLU 104  69.085  -6.006  -0.952
  848    HG2  GLU 104           HG2      GLU 104  70.430  -4.346  -2.289
  849    HG3  GLU 104           HG3      GLU 104  70.431  -5.503  -3.619
  850    HHA  HEC 201           HA       HEC 105  89.268  -3.398   3.201
  851    HHB  HEC 201           HB       HEC 105  85.563   0.144  -0.496
  852    HHC  HEC 201           HC       HEC 105  88.850  -1.738  -5.565
  853    HHD  HEC 201           HD       HEC 105  92.122  -5.752  -1.930
  854   HMA1  HEC 201          HMA1      HEC 105  85.053  -0.339   3.187
  855   HMA2  HEC 201          HMA2      HEC 105  84.620  -0.045   1.506
  856   HMA3  HEC 201          HMA3      HEC 105  85.775   1.013   2.316
  857   HAA1  HEC 201          HAA1      HEC 105  86.810  -0.818   4.445
  858   HAA2  HEC 201          HAA2      HEC 105  88.350  -1.656   4.428
  859   HBA1  HEC 201          HBA1      HEC 105  87.364  -3.757   4.598
  860   HBA2  HEC 201          HBA2      HEC 105  85.821  -3.202   3.964
  861   HMB1  HEC 201          HMB1      HEC 105  84.861   1.259  -4.044
  862   HMB2  HEC 201          HMB2      HEC 105  85.171   1.639  -2.353
  863   HMB3  HEC 201          HMB3      HEC 105  84.159   0.260  -2.778
  864    HAB  HEC 201           HAB      HEC 105  87.396  -0.499  -6.245
  865   HBB1  HEC 201          HBB1      HEC 105  86.726   2.067  -4.855
  866   HBB2  HEC 201          HBB2      HEC 105  88.009   1.724  -6.009
  867   HBB3  HEC 201          HBB3      HEC 105  86.350   1.916  -6.569
  868   HMC1  HEC 201          HMC1      HEC 105  89.785  -3.283  -6.877
  869   HMC2  HEC 201          HMC2      HEC 105  91.165  -4.373  -6.894
  870   HMC3  HEC 201          HMC3      HEC 105  91.411  -2.646  -6.648
  871    HAC  HEC 201           HAC      HEC 105  92.607  -6.179  -3.841
  872   HBC1  HEC 201          HBC1      HEC 105  94.278  -4.879  -4.760
  873   HBC2  HEC 201          HBC2      HEC 105  93.192  -4.100  -5.906
  874   HBC3  HEC 201          HBC3      HEC 105  93.762  -5.738  -6.210
  875   HMD1  HEC 201          HMD1      HEC 105  93.326  -6.278  -0.145
  876   HMD2  HEC 201          HMD2      HEC 105  92.186  -7.456   0.502
  877   HMD3  HEC 201          HMD3      HEC 105  93.170  -6.484   1.595
  878   HAD1  HEC 201          HAD1      HEC 105  91.781  -6.222   3.239
  879   HAD2  HEC 201          HAD2      HEC 105  90.265  -5.475   3.700
  880   HBD1  HEC 201          HBD1      HEC 105  91.490  -3.274   3.838
  881   HBD2  HEC 201          HBD2      HEC 105  92.988  -4.173   3.616
  882    H1   HOH 301           H2       HOH 200  81.344   3.474  -1.142
  883    H2   HOH 301           H1       HOH 200  82.805   3.443  -1.533
  884    H1   HOH 302           H2       HOH 201  86.129   5.980   5.102
  885    H2   HOH 302           H1       HOH 201  85.333   5.149   6.082
  886    H1   HOH 303           H2       HOH 202  82.306  -5.673   5.665
  887    H2   HOH 303           H1       HOH 202  83.584  -4.953   5.290
  888    H1   HOH 304           H2       HOH 203  83.271  -9.556  -0.926
  889    H2   HOH 304           H1       HOH 203  82.061  -9.605  -0.018
  Start of MODEL   17
    1    H1   GLY   1           H1       GLY   1  73.511  12.138  -7.103
    2    H2   GLY   1           H2       GLY   1  74.469  11.853  -8.478
    3    H3   GLY   1           H3       GLY   1  75.202  12.151  -6.974
    4    HA2  GLY   1           HA2      GLY   1  75.395   9.900  -7.020
    5    HA3  GLY   1           HA3      GLY   1  73.812  10.064  -6.257
    6    H    ASP   2           H        ASP   2  75.214   8.144  -8.307
    7    HA   ASP   2           HA       ASP   2  72.784   7.697  -9.875
    8    HB2  ASP   2           HB2      ASP   2  75.501   8.134 -11.129
    9    HB3  ASP   2           HB1      ASP   2  74.101   7.474 -11.974
   10    H    VAL   3           H        VAL   3  72.627   5.855  -8.522
   11    HA   VAL   3           HA       VAL   3  74.465   3.900  -7.995
   12    HB   VAL   3           HB       VAL   3  72.241   3.767  -7.083
   13   HG11  VAL   3          HG11      VAL   3  70.996   4.785  -8.907
   14   HG12  VAL   3          HG12      VAL   3  70.310   3.198  -8.574
   15   HG13  VAL   3          HG13      VAL   3  71.366   3.425  -9.965
   16   HG21  VAL   3          HG21      VAL   3  72.401   1.437  -9.000
   17   HG22  VAL   3          HG22      VAL   3  71.829   1.446  -7.331
   18   HG23  VAL   3          HG23      VAL   3  73.549   1.619  -7.675
   19    H    GLU   4           H        GLU   4  73.154   4.791 -11.055
   20    HA   GLU   4           HA       GLU   4  73.643   2.310 -12.410
   21    HB2  GLU   4           HB2      GLU   4  73.125   5.132 -13.340
   22    HB3  GLU   4           HB3      GLU   4  73.476   3.827 -14.475
   23    HG2  GLU   4           HG2      GLU   4  71.318   3.566 -12.378
   24    HG3  GLU   4           HG3      GLU   4  70.995   4.286 -13.954
   25    H    LYS   5           H        LYS   5  75.311   5.472 -12.592
   26    HA   LYS   5           HA       LYS   5  77.562   4.374 -13.974
   27    HB2  LYS   5           HB2      LYS   5  76.960   7.010 -12.656
   28    HB3  LYS   5           HB3      LYS   5  78.604   6.641 -13.173
   29    HG2  LYS   5           HG2      LYS   5  77.923   6.352 -15.451
   30    HG3  LYS   5           HG3      LYS   5  76.215   6.369 -15.012
   31    HD2  LYS   5           HD2      LYS   5  77.890   8.752 -14.297
   32    HD3  LYS   5           HD3      LYS   5  77.394   8.550 -15.977
   33    HE2  LYS   5           HE2      LYS   5  75.104   8.682 -15.449
   34    HE3  LYS   5           HE3      LYS   5  75.379   8.313 -13.747
   35    HZ1  LYS   5           HZ1      LYS   5  75.000  10.594 -13.796
   36    HZ2  LYS   5           HZ2      LYS   5  75.934  10.826 -15.197
   37    HZ3  LYS   5           HZ3      LYS   5  76.691  10.474 -13.717
   38    H    GLY   6           H        GLY   6  76.592   4.527 -10.693
   39    HA2  GLY   6           HA2      GLY   6  79.184   4.376  -9.490
   40    HA3  GLY   6           HA3      GLY   6  77.652   3.956  -8.718
   41    H    LYS   7           H        LYS   7  76.828   2.114 -10.747
   42    HA   LYS   7           HA       LYS   7  78.053  -0.270  -9.785
   43    HB2  LYS   7           HB2      LYS   7  75.708  -0.201 -10.510
   44    HB3  LYS   7           HB3      LYS   7  76.219   0.181 -12.152
   45    HG2  LYS   7           HG2      LYS   7  77.526  -2.216 -11.019
   46    HG3  LYS   7           HG3      LYS   7  75.781  -2.371 -11.206
   47    HD2  LYS   7           HD2      LYS   7  76.006  -1.607 -13.577
   48    HD3  LYS   7           HD3      LYS   7  77.758  -1.599 -13.372
   49    HE2  LYS   7           HE2      LYS   7  77.441  -3.724 -14.255
   50    HE3  LYS   7           HE3      LYS   7  77.350  -4.075 -12.529
   51    HZ1  LYS   7           HZ1      LYS   7  75.112  -4.372 -12.608
   52    HZ2  LYS   7           HZ2      LYS   7  75.498  -4.871 -14.185
   53    HZ3  LYS   7           HZ3      LYS   7  74.888  -3.309 -13.912
   54    H    LYS   8           H        LYS   8  78.248   1.572 -12.817
   55    HA   LYS   8           HA       LYS   8  79.878  -0.191 -14.267
   56    HB2  LYS   8           HB2      LYS   8  78.799   1.681 -15.347
   57    HB3  LYS   8           HB3      LYS   8  79.692   2.826 -14.347
   58    HG2  LYS   8           HG2      LYS   8  81.401   0.907 -15.815
   59    HG3  LYS   8           HG3      LYS   8  80.484   1.998 -16.853
   60    HD2  LYS   8           HD2      LYS   8  81.987   3.088 -14.478
   61    HD3  LYS   8           HD3      LYS   8  82.835   2.756 -15.987
   62    HE2  LYS   8           HE2      LYS   8  80.399   4.542 -15.700
   63    HE3  LYS   8           HE3      LYS   8  82.059   5.096 -15.915
   64    HZ1  LYS   8           HZ1      LYS   8  80.204   4.117 -17.858
   65    HZ2  LYS   8           HZ2      LYS   8  81.692   3.299 -17.927
   66    HZ3  LYS   8           HZ3      LYS   8  81.642   4.990 -18.080
   67    H    ILE   9           H        ILE   9  80.804   2.584 -12.232
   68    HA   ILE   9           HA       ILE   9  83.594   2.257 -12.528
   69    HB   ILE   9           HB       ILE   9  82.027   3.498 -10.254
   70   HG12  ILE   9          HG12      ILE   9  83.343   4.827 -12.638
   71   HG13  ILE   9          HG13      ILE   9  81.630   4.409 -12.587
   72   HG21  ILE   9          HG21      ILE   9  84.920   3.835 -11.103
   73   HG22  ILE   9          HG22      ILE   9  84.371   3.001  -9.648
   74   HG23  ILE   9          HG23      ILE   9  84.118   4.736  -9.819
   75   HD11  ILE   9          HD11      ILE   9  81.360   5.791 -10.552
   76   HD12  ILE   9          HD12      ILE   9  81.960   6.748 -11.902
   77   HD13  ILE   9          HD13      ILE   9  83.064   6.229 -10.632
   78    H    PHE  10           H        PHE  10  81.239   0.669 -10.521
   79    HA   PHE  10           HA       PHE  10  83.118  -0.354  -8.605
   80    HB2  PHE  10           HB2      PHE  10  80.990  -0.264  -7.706
   81    HB3  PHE  10           HB1      PHE  10  80.222  -0.782  -9.206
   82    HD1  PHE  10           HD1      PHE  10  80.185  -3.151  -9.859
   83    HD2  PHE  10           HD2      PHE  10  81.915  -1.880  -6.143
   84    HE1  PHE  10           HE1      PHE  10  80.194  -5.499  -9.065
   85    HE2  PHE  10           HE2      PHE  10  81.928  -4.229  -5.346
   86    HZ   PHE  10           HZ       PHE  10  81.067  -6.040  -6.811
   87    H    VAL  11           H        VAL  11  81.314  -1.887 -11.289
   88    HA   VAL  11           HA       VAL  11  82.342  -4.449 -11.038
   89    HB   VAL  11           HB       VAL  11  81.859  -4.706 -13.468
   90   HG11  VAL  11          HG11      VAL  11  79.671  -3.123 -12.122
   91   HG12  VAL  11          HG12      VAL  11  80.116  -4.739 -11.573
   92   HG13  VAL  11          HG13      VAL  11  79.515  -4.499 -13.212
   93   HG21  VAL  11          HG21      VAL  11  81.016  -2.819 -14.725
   94   HG22  VAL  11          HG22      VAL  11  82.582  -2.361 -14.056
   95   HG23  VAL  11          HG23      VAL  11  81.098  -1.784 -13.302
   96    H    GLN  12           H        GLN  12  83.795  -1.602 -12.429
   97    HA   GLN  12           HA       GLN  12  86.029  -3.187 -13.479
   98    HB2  GLN  12           HB2      GLN  12  86.789  -1.057 -14.465
   99    HB3  GLN  12           HB1      GLN  12  85.146  -1.481 -14.941
  100    HG2  GLN  12           HG2      GLN  12  84.543  -0.017 -12.776
  101    HG3  GLN  12           HG1      GLN  12  86.095   0.721 -13.157
  102   HE21  GLN  12          HE21      GLN  12  83.527  -0.551 -15.335
  103   HE22  GLN  12          HE22      GLN  12  83.332   0.903 -16.181
  104    H    LYS  13           H        LYS  13  85.332  -1.092 -10.758
  105    HA   LYS  13           HA       LYS  13  88.217  -0.871 -10.184
  106    HB2  LYS  13           HB2      LYS  13  85.837   0.570  -9.018
  107    HB3  LYS  13           HB3      LYS  13  87.484   0.760  -8.430
  108    HG2  LYS  13           HG2      LYS  13  87.506   1.017 -11.301
  109    HG3  LYS  13           HG3      LYS  13  86.268   2.083 -10.648
  110    HD2  LYS  13           HD2      LYS  13  87.847   3.178  -9.205
  111    HD3  LYS  13           HD3      LYS  13  89.091   1.980  -9.562
  112    HE2  LYS  13           HE2      LYS  13  89.290   2.735 -11.831
  113    HE3  LYS  13           HE3      LYS  13  87.851   3.744 -11.686
  114    HZ1  LYS  13           HZ1      LYS  13  89.815   4.333  -9.691
  115    HZ2  LYS  13           HZ2      LYS  13  89.019   5.378 -10.768
  116    HZ3  LYS  13           HZ3      LYS  13  90.417   4.548 -11.262
  117    H    CYS  14           H        CYS  14  85.308  -1.443  -8.153
  118    HA   CYS  14           HA       CYS  14  86.989  -2.720  -6.169
  119    HB2  CYS  14           HB2      CYS  14  84.021  -2.607  -5.948
  120    HB3  CYS  14           HB1      CYS  14  85.240  -2.437  -4.690
  121    H    ALA  15           H        ALA  15  84.488  -3.848  -8.422
  122    HA   ALA  15           HA       ALA  15  83.940  -6.325  -7.358
  123    HB1  ALA  15           HB1      ALA  15  82.766  -5.819  -9.312
  124    HB2  ALA  15           HB2      ALA  15  83.870  -7.086  -9.844
  125    HB3  ALA  15           HB3      ALA  15  84.231  -5.397 -10.197
  126    H    GLN  16           H        GLN  16  86.908  -5.222  -8.789
  127    HA   GLN  16           HA       GLN  16  88.187  -7.514  -9.568
  128    HB2  GLN  16           HB2      GLN  16  89.028  -4.905  -8.505
  129    HB3  GLN  16           HB1      GLN  16  90.211  -6.188  -8.266
  130    HG2  GLN  16           HG2      GLN  16  90.096  -6.740 -10.671
  131    HG3  GLN  16           HG1      GLN  16  88.917  -5.451 -10.909
  132   HE21  GLN  16          HE21      GLN  16  92.047  -5.613  -9.107
  133   HE22  GLN  16          HE22      GLN  16  92.705  -4.235  -9.852
  134    H    CYS  17           H        CYS  17  88.640  -6.175  -6.263
  135    HA   CYS  17           HA       CYS  17  88.992  -8.966  -5.326
  136    HB2  CYS  17           HB2      CYS  17  90.156  -6.816  -3.670
  137    HB3  CYS  17           HB1      CYS  17  90.834  -8.371  -4.142
  138    H    HIS  18           H        HSD  18  86.400  -8.020  -5.371
  139    HA   HIS  18           HA       HSD  18  85.787  -8.067  -2.528
  140    HB2  HIS  18           HB2      HSD  18  85.155  -5.689  -4.262
  141    HB3  HIS  18           HB1      HSD  18  84.175  -6.082  -2.852
  142    HD1  HIS  18           HD1      HSD  18  86.651  -7.134  -1.107
  143    HD2  HIS  18           HD2      HSD  18  86.416  -3.466  -3.068
  144    HE1  HIS  18           HE1      HSD  18  88.271  -5.581   0.073
  145    H    THR  19           H        THR  19  83.205  -7.738  -2.385
  146    HA   THR  19           HA       THR  19  81.940  -9.259  -4.567
  147    HB   THR  19           HB       THR  19  81.082  -9.999  -1.835
  148    HG1  THR  19           HG1      THR  19  82.982 -11.464  -1.807
  149   HG21  THR  19          HG21      THR  19  80.754 -12.090  -2.821
  150   HG22  THR  19          HG22      THR  19  82.031 -11.839  -4.011
  151   HG23  THR  19          HG23      THR  19  80.489 -11.001  -4.182
  152    H    VAL  20           H        VAL  20  81.564  -7.286  -1.667
  153    HA   VAL  20           HA       VAL  20  79.822  -6.001  -0.892
  154    HB   VAL  20           HB       VAL  20  79.134  -4.281  -2.445
  155   HG11  VAL  20          HG11      VAL  20  81.994  -5.155  -2.957
  156   HG12  VAL  20          HG12      VAL  20  81.444  -4.205  -1.578
  157   HG13  VAL  20          HG13      VAL  20  81.354  -3.530  -3.203
  158   HG21  VAL  20          HG21      VAL  20  79.488  -4.419  -4.800
  159   HG22  VAL  20          HG22      VAL  20  78.728  -5.942  -4.347
  160   HG23  VAL  20          HG23      VAL  20  80.464  -5.875  -4.638
  161    H    GLU  21           H        GLU  21  78.991  -8.708  -1.607
  162    HA   GLU  21           HA       GLU  21  76.147  -8.112  -2.144
  163    HB2  GLU  21           HB2      GLU  21  75.895  -9.947  -3.594
  164    HB3  GLU  21           HB3      GLU  21  77.399  -9.190  -4.116
  165    HG2  GLU  21           HG2      GLU  21  78.564 -10.838  -2.502
  166    HG3  GLU  21           HG3      GLU  21  77.030 -11.708  -2.501
  167    H    LYS  22           H        LYS  22  75.024  -8.568  -0.397
  168    HA   LYS  22           HA       LYS  22  75.837  -9.829   1.890
  169    HB2  LYS  22           HB2      LYS  22  73.766  -8.597   1.818
  170    HB3  LYS  22           HB3      LYS  22  73.066  -9.752   0.682
  171    HG2  LYS  22           HG2      LYS  22  72.808 -11.404   2.303
  172    HG3  LYS  22           HG3      LYS  22  74.106 -10.763   3.312
  173    HD2  LYS  22           HD2      LYS  22  72.757  -9.039   4.173
  174    HD3  LYS  22           HD3      LYS  22  71.589  -9.169   2.859
  175    HE2  LYS  22           HE2      LYS  22  72.050 -11.453   4.779
  176    HE3  LYS  22           HE3      LYS  22  70.907 -10.159   5.144
  177    HZ1  LYS  22           HZ1      LYS  22  70.402 -12.379   3.638
  178    HZ2  LYS  22           HZ2      LYS  22  70.605 -11.151   2.482
  179    HZ3  LYS  22           HZ3      LYS  22  69.444 -10.981   3.710
  180    H    GLY  23           H        GLY  23  75.678 -11.895   2.764
  181    HA2  GLY  23           HA2      GLY  23  75.947 -14.181   2.725
  182    HA3  GLY  23           HA3      GLY  23  74.522 -14.162   1.693
  183    H    GLY  24           H        GLY  24  77.493 -12.581   0.732
  184    HA2  GLY  24           HA2      GLY  24  77.663 -14.319  -1.602
  185    HA3  GLY  24           HA3      GLY  24  78.597 -12.854  -1.313
  186    H    LYS  25           H        LYS  25  80.611 -13.654  -1.682
  187    HA   LYS  25           HA       LYS  25  81.743 -15.337   0.411
  188    HB2  LYS  25           HB2      LYS  25  82.909 -16.702  -1.483
  189    HB3  LYS  25           HB3      LYS  25  81.262 -17.126  -1.017
  190    HG2  LYS  25           HG2      LYS  25  80.360 -15.821  -2.877
  191    HG3  LYS  25           HG3      LYS  25  81.983 -15.291  -3.321
  192    HD2  LYS  25           HD2      LYS  25  82.643 -17.564  -3.852
  193    HD3  LYS  25           HD3      LYS  25  81.110 -18.192  -3.245
  194    HE2  LYS  25           HE2      LYS  25  79.955 -16.758  -4.994
  195    HE3  LYS  25           HE3      LYS  25  81.550 -16.451  -5.681
  196    HZ1  LYS  25           HZ1      LYS  25  80.095 -18.445  -6.498
  197    HZ2  LYS  25           HZ2      LYS  25  80.767 -19.223  -5.146
  198    HZ3  LYS  25           HZ3      LYS  25  81.778 -18.600  -6.359
  199    H    HIS  26           H        HIS  26  83.366 -14.100   1.081
  200    HA   HIS  26           HA       HIS  26  84.575 -12.022  -0.314
  201    HB2  HIS  26           HB2      HIS  26  86.573 -12.878   1.407
  202    HB3  HIS  26           HB1      HIS  26  85.273 -11.764   1.818
  203    HD1  HIS  26           HD1      HIS  26  85.433 -15.571   1.464
  204    HD2  HIS  26           HD2      HIS  26  84.091 -12.660   4.129
  205    HE1  HIS  26           HE1      HIS  26  84.367 -16.808   3.400
  206    HE2  HIS  26           HE2      HIS  26  83.544 -15.048   5.033
  207    H    LYS  27           H        LYS  27  85.902 -11.948  -1.972
  208    HA   LYS  27           HA       LYS  27  87.625 -14.287  -2.554
  209    HB2  LYS  27           HB2      LYS  27  85.635 -13.923  -4.126
  210    HB3  LYS  27           HB3      LYS  27  86.460 -12.457  -4.653
  211    HG2  LYS  27           HG2      LYS  27  88.509 -13.931  -5.073
  212    HG3  LYS  27           HG3      LYS  27  87.429 -15.313  -4.871
  213    HD2  LYS  27           HD2      LYS  27  87.172 -13.096  -6.925
  214    HD3  LYS  27           HD3      LYS  27  87.567 -14.786  -7.239
  215    HE2  LYS  27           HE2      LYS  27  85.305 -15.314  -6.084
  216    HE3  LYS  27           HE3      LYS  27  84.940 -13.608  -6.339
  217    HZ1  LYS  27           HZ1      LYS  27  85.445 -15.708  -8.349
  218    HZ2  LYS  27           HZ2      LYS  27  85.654 -14.067  -8.735
  219    HZ3  LYS  27           HZ3      LYS  27  84.134 -14.637  -8.236
  220    H    THR  28           H        THR  28  89.585 -13.598  -1.890
  221    HA   THR  28           HA       THR  28  91.542 -12.400  -1.848
  222    HB   THR  28           HB       THR  28  90.472 -10.837  -4.201
  223    HG1  THR  28           HG1      THR  28  90.862 -12.514  -5.445
  224   HG21  THR  28          HG21      THR  28  93.183 -11.468  -3.057
  225   HG22  THR  28          HG22      THR  28  92.531  -9.914  -3.571
  226   HG23  THR  28          HG23      THR  28  93.009 -11.111  -4.773
  227    H    GLY  29           H        GLY  29  89.077 -11.501  -0.465
  228    HA2  GLY  29           HA2      GLY  29  89.964  -9.281   0.865
  229    HA3  GLY  29           HA3      GLY  29  89.062  -8.626  -0.498
  230    HA   PRO  30           HA       PRO  30  86.230 -10.076   3.070
  231    HB2  PRO  30           HB2      PRO  30  85.803  -7.706   4.356
  232    HB3  PRO  30           HB1      PRO  30  87.124  -8.811   4.786
  233    HG2  PRO  30           HG2      PRO  30  87.196  -6.329   3.133
  234    HG3  PRO  30           HG1      PRO  30  88.347  -6.906   4.352
  235    HD2  PRO  30           HD2      PRO  30  88.775  -7.187   1.663
  236    HD3  PRO  30           HD1      PRO  30  89.417  -8.324   2.870
  237    H    ASN  31           H        ASN  31  83.947  -9.284   3.435
  238    HA   ASN  31           HA       ASN  31  82.907  -8.097   0.946
  239    HB2  ASN  31           HB2      ASN  31  82.139 -10.379   2.086
  240    HB3  ASN  31           HB1      ASN  31  81.115  -9.293   3.020
  241   HD21  ASN  31          HD21      ASN  31  80.555 -11.281   0.689
  242   HD22  ASN  31          HD22      ASN  31  79.638 -10.354  -0.400
  243    H    LEU  32           H        LEU  32  82.022  -6.148   0.923
  244    HA   LEU  32           HA       LEU  32  82.071  -4.520   3.296
  245    HB2  LEU  32           HB2      LEU  32  80.915  -3.717   0.632
  246    HB3  LEU  32           HB3      LEU  32  81.629  -2.688   1.869
  247    HG   LEU  32           HG       LEU  32  83.041  -4.635   0.034
  248   HD11  LEU  32          HD11      LEU  32  83.089  -1.653   0.505
  249   HD12  LEU  32          HD12      LEU  32  82.880  -2.527  -1.009
  250   HD13  LEU  32          HD13      LEU  32  84.462  -2.471  -0.240
  251   HD21  LEU  32          HD21      LEU  32  83.977  -3.356   2.606
  252   HD22  LEU  32          HD22      LEU  32  85.111  -3.851   1.352
  253   HD23  LEU  32          HD23      LEU  32  84.079  -5.050   2.130
  254    H    HIS  33           H        HIS  33  80.198  -6.705   3.452
  255    HA   HIS  33           HA       HIS  33  77.534  -6.030   2.933
  256    HB2  HIS  33           HB2      HIS  33  78.753  -7.616   5.203
  257    HB3  HIS  33           HB1      HIS  33  77.017  -7.499   4.925
  258    HD1  HIS  33           HD1      HIS  33  78.092 -10.260   4.698
  259    HD2  HIS  33           HD2      HIS  33  78.131  -7.649   1.447
  260    HE1  HIS  33           HE1      HIS  33  78.238 -11.702   2.623
  261    HE2  HIS  33           HE2      HIS  33  78.265 -10.124   0.635
  262    H    GLY  34           H        GLY  34  75.987  -4.832   4.020
  263    HA2  GLY  34           HA2      GLY  34  75.435  -2.809   5.103
  264    HA3  GLY  34           HA3      GLY  34  75.671  -3.889   6.474
  265    H    LEU  35           H        LEU  35  78.133  -2.691   4.272
  266    HA   LEU  35           HA       LEU  35  80.086  -2.121   6.115
  267    HB2  LEU  35           HB2      LEU  35  80.465  -2.179   3.711
  268    HB3  LEU  35           HB3      LEU  35  79.491  -0.730   3.497
  269    HG   LEU  35           HG       LEU  35  81.245   0.262   5.258
  270   HD11  LEU  35          HD11      LEU  35  83.406  -0.694   5.132
  271   HD12  LEU  35          HD12      LEU  35  82.974  -1.686   3.743
  272   HD13  LEU  35          HD13      LEU  35  82.337  -2.080   5.337
  273   HD21  LEU  35          HD21      LEU  35  80.776   0.976   2.870
  274   HD22  LEU  35          HD22      LEU  35  82.034  -0.150   2.367
  275   HD23  LEU  35          HD23      LEU  35  82.439   1.216   3.405
  276    H    PHE  36           H        PHE  36  77.910   0.298   4.656
  277    HA   PHE  36           HA       PHE  36  78.717   2.495   6.133
  278    HB2  PHE  36           HB2      PHE  36  75.873   1.965   5.254
  279    HB3  PHE  36           HB1      PHE  36  76.644   3.532   5.499
  280    HD1  PHE  36           HD2      PHE  36  76.639   0.479   3.376
  281    HD2  PHE  36           HD1      PHE  36  78.044   4.518   3.814
  282    HE1  PHE  36           HE2      PHE  36  77.456   0.452   1.037
  283    HE2  PHE  36           HE1      PHE  36  78.852   4.489   1.480
  284    HZ   PHE  36           HZ       PHE  36  78.561   2.459   0.085
  285    H    GLY  37           H        GLY  37  79.089   2.064   8.319
  286    HA2  GLY  37           HA2      GLY  37  77.609   2.767  10.307
  287    HA3  GLY  37           HA3      GLY  37  76.739   1.289   9.934
  288    H    ARG  38           H        ARG  38  79.321  -0.102   9.224
  289    HA   ARG  38           HA       ARG  38  79.945  -0.917  11.955
  290    HB2  ARG  38           HB2      ARG  38  80.281  -2.063   9.249
  291    HB3  ARG  38           HB3      ARG  38  81.551  -2.463  10.403
  292    HG2  ARG  38           HG2      ARG  38  79.643  -3.081  12.026
  293    HG3  ARG  38           HG3      ARG  38  78.590  -3.033  10.613
  294    HD2  ARG  38           HD2      ARG  38  81.127  -4.609  10.424
  295    HD3  ARG  38           HD3      ARG  38  79.801  -5.287  11.357
  296    HE   ARG  38           HE       ARG  38  78.456  -4.797   9.190
  297   HH11  ARG  38          HH21      ARG  38  81.799  -5.750   9.352
  298   HH12  ARG  38          HH22      ARG  38  81.777  -6.539   7.811
  299   HH21  ARG  38          HH11      ARG  38  78.444  -5.850   7.192
  300   HH22  ARG  38          HH12      ARG  38  79.886  -6.602   6.599
  301    H    LYS  39           H        LYS  39  81.961  -0.904  12.910
  302    HA   LYS  39           HA       LYS  39  83.650   1.307  12.326
  303    HB2  LYS  39           HB2      LYS  39  83.718  -0.979  14.257
  304    HB3  LYS  39           HB3      LYS  39  85.168   0.000  14.038
  305    HG2  LYS  39           HG2      LYS  39  82.543   1.396  14.459
  306    HG3  LYS  39           HG3      LYS  39  83.346   0.670  15.851
  307    HD2  LYS  39           HD2      LYS  39  85.425   1.937  15.250
  308    HD3  LYS  39           HD3      LYS  39  84.517   2.740  13.969
  309    HE2  LYS  39           HE2      LYS  39  84.197   2.985  16.948
  310    HE3  LYS  39           HE3      LYS  39  84.319   4.261  15.737
  311    HZ1  LYS  39           HZ1      LYS  39  82.133   3.303  14.863
  312    HZ2  LYS  39           HZ2      LYS  39  82.082   4.226  16.290
  313    HZ3  LYS  39           HZ3      LYS  39  82.013   2.529  16.367
  314    H    THR  40           H        THR  40  86.097   0.997  12.133
  315    HA   THR  40           HA       THR  40  86.658  -0.341   9.695
  316    HB   THR  40           HB       THR  40  89.075   0.221  10.327
  317    HG1  THR  40           HG1      THR  40  87.790   1.733  12.333
  318   HG21  THR  40          HG21      THR  40  88.624   2.694  10.062
  319   HG22  THR  40          HG22      THR  40  86.904   2.325  10.196
  320   HG23  THR  40          HG23      THR  40  87.845   1.671   8.855
  321    H    GLY  41           H        GLY  41  87.905  -2.153   9.260
  322    HA2  GLY  41           HA2      GLY  41  88.434  -4.376   9.570
  323    HA3  GLY  41           HA3      GLY  41  89.379  -3.750  10.918
  324    H    GLN  42           H        GLN  42  85.885  -4.073  10.331
  325    HA   GLN  42           HA       GLN  42  85.662  -5.434  12.951
  326    HB2  GLN  42           HB2      GLN  42  84.436  -3.302  12.789
  327    HB3  GLN  42           HB1      GLN  42  83.547  -3.924  11.398
  328    HG2  GLN  42           HG2      GLN  42  82.377  -5.499  12.682
  329    HG3  GLN  42           HG1      GLN  42  83.568  -5.469  13.982
  330   HE21  GLN  42          HE21      GLN  42  81.759  -2.809  12.341
  331   HE22  GLN  42          HE22      GLN  42  81.121  -2.169  13.778
  332    H    ALA  43           H        ALA  43  85.588  -5.993   9.647
  333    HA   ALA  43           HA       ALA  43  83.509  -8.010   9.677
  334    HB1  ALA  43           HB1      ALA  43  83.549  -7.306   7.532
  335    HB2  ALA  43           HB2      ALA  43  84.915  -8.405   7.349
  336    HB3  ALA  43           HB3      ALA  43  85.196  -6.694   7.672
  337    HA   PRO  44           HA       PRO  44  86.571 -11.000  11.108
  338    HB2  PRO  44           HB2      PRO  44  84.856 -12.998  11.720
  339    HB3  PRO  44           HB1      PRO  44  84.984 -11.536  12.720
  340    HG2  PRO  44           HG2      PRO  44  82.938 -12.250  10.671
  341    HG3  PRO  44           HG1      PRO  44  82.728 -11.478  12.253
  342    HD2  PRO  44           HD2      PRO  44  82.785 -10.099   9.858
  343    HD3  PRO  44           HD1      PRO  44  83.195  -9.379  11.433
  344    H    GLY  45           H        GLY  45  86.048 -10.642   8.250
  345    HA2  GLY  45           HA2      GLY  45  85.886 -13.420   7.266
  346    HA3  GLY  45           HA3      GLY  45  85.673 -11.972   6.288
  347    H    PHE  46           H        PHE  46  87.670 -10.504   6.242
  348    HA   PHE  46           HA       PHE  46  89.968 -12.181   5.542
  349    HB2  PHE  46           HB2      PHE  46  88.946 -10.313   4.062
  350    HB3  PHE  46           HB1      PHE  46  89.791  -9.202   5.139
  351    HD1  PHE  46           HD1      PHE  46  92.276  -9.317   5.361
  352    HD2  PHE  46           HD2      PHE  46  90.132 -11.662   2.469
  353    HE1  PHE  46           HE1      PHE  46  94.391  -9.741   4.136
  354    HE2  PHE  46           HE2      PHE  46  92.247 -12.085   1.244
  355    HZ   PHE  46           HZ       PHE  46  94.376 -11.124   2.077
  356    H    THR  47           H        THR  47  92.114 -11.644   6.235
  357    HA   THR  47           HA       THR  47  92.278 -11.025   9.022
  358    HB   THR  47           HB       THR  47  94.604 -11.121   7.105
  359    HG1  THR  47           HG1      THR  47  93.474 -12.959   6.685
  360   HG21  THR  47          HG21      THR  47  95.721 -12.081   9.114
  361   HG22  THR  47          HG22      THR  47  94.233 -11.840  10.025
  362   HG23  THR  47          HG23      THR  47  95.114 -10.451   9.396
  363    H    TYR  48           H        TYR  48  91.349  -8.916   9.098
  364    HA   TYR  48           HA       TYR  48  92.288  -6.681   7.679
  365    HB2  TYR  48           HB2      TYR  48  90.769  -7.082  10.225
  366    HB3  TYR  48           HB3      TYR  48  91.360  -5.469   9.835
  367    HD1  TYR  48           HD1      TYR  48  90.619  -4.307   7.806
  368    HD2  TYR  48           HD2      TYR  48  89.025  -8.137   8.907
  369    HE1  TYR  48           HE1      TYR  48  88.757  -3.984   6.214
  370    HE2  TYR  48           HE2      TYR  48  87.156  -7.816   7.312
  371    HH   TYR  48           HH       TYR  48  86.463  -4.798   5.898
  372    H    THR  49           H        THR  49  93.630  -4.959   8.310
  373    HA   THR  49           HA       THR  49  95.989  -5.811   9.775
  374    HB   THR  49           HB       THR  49  96.979  -3.746   8.982
  375    HG1  THR  49           HG1      THR  49  95.795  -2.110   8.332
  376   HG21  THR  49          HG21      THR  49  96.452  -5.750   7.397
  377   HG22  THR  49          HG22      THR  49  96.962  -4.221   6.684
  378   HG23  THR  49          HG23      THR  49  95.254  -4.663   6.693
  379    H    ASP  50           H        ASP  50  96.905  -4.605  11.531
  380    HA   ASP  50           HA       ASP  50  95.220  -4.105  13.663
  381    HB2  ASP  50           HB2      ASP  50  97.807  -2.604  13.327
  382    HB3  ASP  50           HB1      ASP  50  97.088  -3.247  14.803
  383    H    ALA  51           H        ALA  51  96.433  -1.835  11.235
  384    HA   ALA  51           HA       ALA  51  95.536   0.559  12.364
  385    HB1  ALA  51           HB1      ALA  51  96.960   0.676  10.466
  386    HB2  ALA  51           HB2      ALA  51  95.411   1.336   9.943
  387    HB3  ALA  51           HB3      ALA  51  95.867  -0.306   9.492
  388    H    ASN  52           H        ASN  52  93.819  -1.785  10.332
  389    HA   ASN  52           HA       ASN  52  91.394  -0.198  10.298
  390    HB2  ASN  52           HB2      ASN  52  92.302  -2.793   9.150
  391    HB3  ASN  52           HB1      ASN  52  90.572  -2.597   9.407
  392   HD21  ASN  52          HD21      ASN  52  90.190  -2.497   7.075
  393   HD22  ASN  52          HD22      ASN  52  90.604  -1.110   6.185
  394    H    LYS  53           H        LYS  53  92.782  -2.736  12.215
  395    HA   LYS  53           HA       LYS  53  90.280  -3.412  13.526
  396    HB2  LYS  53           HB2      LYS  53  91.519  -5.324  13.592
  397    HB3  LYS  53           HB3      LYS  53  93.041  -4.458  13.450
  398    HG2  LYS  53           HG2      LYS  53  92.979  -3.879  15.826
  399    HG3  LYS  53           HG3      LYS  53  91.392  -4.633  15.988
  400    HD2  LYS  53           HD2      LYS  53  92.521  -6.779  15.115
  401    HD3  LYS  53           HD3      LYS  53  94.048  -5.960  15.446
  402    HE2  LYS  53           HE2      LYS  53  93.392  -7.321  17.378
  403    HE3  LYS  53           HE3      LYS  53  93.330  -5.609  17.796
  404    HZ1  LYS  53           HZ1      LYS  53  91.352  -7.156  18.378
  405    HZ2  LYS  53           HZ2      LYS  53  90.922  -6.929  16.751
  406    HZ3  LYS  53           HZ3      LYS  53  91.052  -5.594  17.792
  407    H    ASN  54           H        ASN  54  92.605  -1.009  13.723
  408    HA   ASN  54           HA       ASN  54  92.772  -0.574  16.519
  409    HB2  ASN  54           HB2      ASN  54  93.893   1.361  15.964
  410    HB3  ASN  54           HB1      ASN  54  94.108   0.445  14.479
  411   HD21  ASN  54          HD21      ASN  54  91.436   0.795  13.418
  412   HD22  ASN  54          HD22      ASN  54  91.248   2.435  13.026
  413    H    LYS  55           H        LYS  55  90.314  -0.071  14.218
  414    HA   LYS  55           HA       LYS  55  88.218   0.884  14.316
  415    HB2  LYS  55           HB2      LYS  55  88.388   0.859  17.313
  416    HB3  LYS  55           HB3      LYS  55  87.005   0.523  16.272
  417    HG2  LYS  55           HG2      LYS  55  88.599  -1.467  15.443
  418    HG3  LYS  55           HG3      LYS  55  89.264  -1.265  17.065
  419    HD2  LYS  55           HD2      LYS  55  86.812  -1.335  17.876
  420    HD3  LYS  55           HD3      LYS  55  86.438  -1.978  16.277
  421    HE2  LYS  55           HE2      LYS  55  86.807  -3.916  17.564
  422    HE3  LYS  55           HE3      LYS  55  88.353  -3.672  16.751
  423    HZ1  LYS  55           HZ1      LYS  55  89.238  -3.687  18.774
  424    HZ2  LYS  55           HZ2      LYS  55  87.726  -3.561  19.538
  425    HZ3  LYS  55           HZ3      LYS  55  88.536  -2.163  19.013
  426    H    GLY  56           H        GLY  56  89.693   2.815  13.625
  427    HA2  GLY  56           HA2      GLY  56  89.812   4.951  15.612
  428    HA3  GLY  56           HA3      GLY  56  90.432   5.020  13.966
  429    H    ILE  57           H        ILE  57  88.141   4.242  12.557
  430    HA   ILE  57           HA       ILE  57  86.100   6.239  13.295
  431    HB   ILE  57           HB       ILE  57  86.021   7.107  11.032
  432   HG12  ILE  57          HG12      ILE  57  88.124   6.321   9.579
  433   HG13  ILE  57          HG13      ILE  57  87.952   4.857  10.542
  434   HG21  ILE  57          HG21      ILE  57  87.629   8.100  12.647
  435   HG22  ILE  57          HG22      ILE  57  88.182   8.248  10.980
  436   HG23  ILE  57          HG23      ILE  57  88.881   7.020  12.034
  437   HD11  ILE  57          HD11      ILE  57  85.888   4.328   9.614
  438   HD12  ILE  57          HD12      ILE  57  86.648   5.138   8.249
  439   HD13  ILE  57          HD13      ILE  57  85.496   6.009   9.255
  440    H    THR  58           H        THR  58  84.241   6.005  11.519
  441    HA   THR  58           HA       THR  58  83.709   3.108  11.222
  442    HB   THR  58           HB       THR  58  81.815   5.338  11.977
  443    HG1  THR  58           HG1      THR  58  83.172   4.269  13.584
  444   HG21  THR  58          HG21      THR  58  81.308   2.483  11.134
  445   HG22  THR  58          HG22      THR  58  80.599   3.949  10.464
  446   HG23  THR  58          HG23      THR  58  80.145   3.409  12.080
  447    H    TRP  59           H        TRP  59  82.858   2.390   9.326
  448    HA   TRP  59           HA       TRP  59  83.228   3.955   6.997
  449    HB2  TRP  59           HB2      TRP  59  81.421   1.546   7.138
  450    HB3  TRP  59           HB1      TRP  59  82.387   2.119   5.779
  451    HD1  TRP  59           HD1      TRP  59  85.159   2.507   7.179
  452    HE1  TRP  59           HE1      TRP  59  86.510   0.448   7.964
  453    HE3  TRP  59           HE3      TRP  59  81.417  -0.946   7.528
  454    HZ2  TRP  59           HZ2      TRP  59  86.049  -2.282   8.679
  455    HZ3  TRP  59           HZ3      TRP  59  81.901  -3.263   8.254
  456    HH2  TRP  59           HH2      TRP  59  84.211  -3.932   8.829
  457    H    LYS  60           H        LYS  60  81.842   5.130   5.785
  458    HA   LYS  60           HA       LYS  60  78.984   5.109   6.241
  459    HB2  LYS  60           HB2      LYS  60  80.687   7.484   7.023
  460    HB3  LYS  60           HB3      LYS  60  78.957   7.603   6.716
  461    HG2  LYS  60           HG2      LYS  60  78.751   5.651   8.434
  462    HG3  LYS  60           HG3      LYS  60  80.379   6.121   8.920
  463    HD2  LYS  60           HD2      LYS  60  78.105   8.109   8.740
  464    HD3  LYS  60           HD3      LYS  60  78.463   7.211  10.213
  465    HE2  LYS  60           HE2      LYS  60  80.723   8.129  10.275
  466    HE3  LYS  60           HE3      LYS  60  80.458   8.955   8.739
  467    HZ1  LYS  60           HZ1      LYS  60  78.483   9.493  10.785
  468    HZ2  LYS  60           HZ2      LYS  60  79.251  10.557   9.705
  469    HZ3  LYS  60           HZ3      LYS  60  80.040  10.071  11.130
  470    H    GLU  61           H        GLU  61  78.418   7.580   5.013
  471    HA   GLU  61           HA       GLU  61  78.989   6.905   2.274
  472    HB2  GLU  61           HB2      GLU  61  76.816   7.839   2.877
  473    HB3  GLU  61           HB3      GLU  61  77.590   9.302   3.486
  474    HG2  GLU  61           HG2      GLU  61  78.351   9.917   1.299
  475    HG3  GLU  61           HG3      GLU  61  77.914   8.343   0.636
  476    H    GLU  62           H        GLU  62  79.616   9.835   4.228
  477    HA   GLU  62           HA       GLU  62  81.410  10.960   2.327
  478    HB2  GLU  62           HB2      GLU  62  81.121  11.562   5.280
  479    HB3  GLU  62           HB3      GLU  62  81.937  12.578   4.092
  480    HG2  GLU  62           HG2      GLU  62  79.887  12.987   2.909
  481    HG3  GLU  62           HG3      GLU  62  79.034  11.758   3.844
  482    H    THR  63           H        THR  63  81.879   9.075   5.293
  483    HA   THR  63           HA       THR  63  84.662   9.284   5.492
  484    HB   THR  63           HB       THR  63  84.566   7.184   6.750
  485    HG1  THR  63           HG1      THR  63  82.985   6.289   5.199
  486   HG21  THR  63          HG21      THR  63  82.628   7.828   8.296
  487   HG22  THR  63          HG22      THR  63  82.319   9.150   7.169
  488   HG23  THR  63          HG23      THR  63  83.861   9.057   8.017
  489    H    LEU  64           H        LEU  64  82.623   7.219   3.504
  490    HA   LEU  64           HA       LEU  64  84.725   5.563   2.532
  491    HB2  LEU  64           HB2      LEU  64  81.870   5.925   2.010
  492    HB3  LEU  64           HB3      LEU  64  82.785   5.540   0.559
  493    HG   LEU  64           HG       LEU  64  83.018   3.962   3.133
  494   HD11  LEU  64          HD11      LEU  64  81.005   3.878   0.972
  495   HD12  LEU  64          HD12      LEU  64  80.928   3.235   2.610
  496   HD13  LEU  64          HD13      LEU  64  81.741   2.320   1.342
  497   HD21  LEU  64          HD21      LEU  64  83.763   2.282   1.157
  498   HD22  LEU  64          HD22      LEU  64  84.906   3.364   1.948
  499   HD23  LEU  64          HD23      LEU  64  84.206   3.809   0.393
  500    H    MET  65           H        MET  65  83.342   8.642   1.523
  501    HA   MET  65           HA       MET  65  84.436   8.781  -1.060
  502    HB2  MET  65           HB2      MET  65  83.879  11.011   0.904
  503    HB3  MET  65           HB1      MET  65  84.232  11.242  -0.808
  504    HG2  MET  65           HG2      MET  65  82.260  10.027  -1.458
  505    HG3  MET  65           HG1      MET  65  81.972   9.504   0.198
  506    HE1  MET  65           HE1      MET  65  80.390  11.448  -2.259
  507    HE2  MET  65           HE2      MET  65  81.951  12.255  -2.390
  508    HE3  MET  65           HE3      MET  65  80.533  13.170  -1.884
  509    H    GLU  66           H        GLU  66  85.744  10.207   1.948
  510    HA   GLU  66           HA       GLU  66  88.191  11.034   0.824
  511    HB2  GLU  66           HB2      GLU  66  87.372  10.354   3.649
  512    HB3  GLU  66           HB3      GLU  66  88.995  10.917   3.250
  513    HG2  GLU  66           HG2      GLU  66  86.526  12.426   2.386
  514    HG3  GLU  66           HG3      GLU  66  87.295  12.712   3.945
  515    H    TYR  67           H        TYR  67  87.073   7.976   2.064
  516    HA   TYR  67           HA       TYR  67  89.678   6.733   2.143
  517    HB2  TYR  67           HB2      TYR  67  87.993   5.887   3.633
  518    HB3  TYR  67           HB3      TYR  67  86.859   5.662   2.306
  519    HD1  TYR  67           HD2      TYR  67  87.150   3.844   0.676
  520    HD2  TYR  67           HD1      TYR  67  89.816   4.323   4.011
  521    HE1  TYR  67           HE2      TYR  67  88.013   1.547   0.317
  522    HE2  TYR  67           HE1      TYR  67  90.677   2.024   3.652
  523    HH   TYR  67           HH       TYR  67  89.495   0.021   0.948
  524    H    LEU  68           H        LEU  68  87.140   7.201  -0.174
  525    HA   LEU  68           HA       LEU  68  88.045   5.159  -2.001
  526    HB2  LEU  68           HB2      LEU  68  85.865   7.168  -1.892
  527    HB3  LEU  68           HB3      LEU  68  86.412   6.722  -3.502
  528    HG   LEU  68           HG       LEU  68  85.625   4.716  -1.370
  529   HD11  LEU  68          HD11      LEU  68  83.611   4.436  -2.969
  530   HD12  LEU  68          HD12      LEU  68  84.051   6.029  -3.585
  531   HD13  LEU  68          HD13      LEU  68  83.617   5.827  -1.888
  532   HD21  LEU  68          HD21      LEU  68  86.859   3.464  -2.851
  533   HD22  LEU  68          HD22      LEU  68  86.580   4.566  -4.194
  534   HD23  LEU  68          HD23      LEU  68  85.321   3.439  -3.704
  535    H    GLU  69           H        GLU  69  88.779   8.465  -1.355
  536    HA   GLU  69           HA       GLU  69  90.092   8.839  -3.951
  537    HB2  GLU  69           HB2      GLU  69  88.990  10.809  -3.456
  538    HB3  GLU  69           HB3      GLU  69  89.196  10.612  -1.717
  539    HG2  GLU  69           HG2      GLU  69  91.481  11.297  -1.816
  540    HG3  GLU  69           HG3      GLU  69  91.505  11.188  -3.577
  541    H    ASN  70           H        ASN  70  90.761   7.694  -0.867
  542    HA   ASN  70           HA       ASN  70  93.539   7.363  -1.391
  543    HB2  ASN  70           HB2      ASN  70  94.394   8.769   0.466
  544    HB3  ASN  70           HB1      ASN  70  93.678   9.725  -0.830
  545   HD21  ASN  70          HD21      ASN  70  93.202   8.626   2.511
  546   HD22  ASN  70          HD22      ASN  70  91.922   9.686   2.854
  547    HA   PRO  71           HA       PRO  71  91.229   4.482   1.530
  548    HB2  PRO  71           HB2      PRO  71  93.075   2.662   0.042
  549    HB3  PRO  71           HB1      PRO  71  91.374   2.428   0.484
  550    HG2  PRO  71           HG2      PRO  71  92.109   3.032  -2.011
  551    HG3  PRO  71           HG1      PRO  71  90.602   3.639  -1.305
  552    HD2  PRO  71           HD2      PRO  71  93.138   5.101  -1.864
  553    HD3  PRO  71           HD1      PRO  71  91.470   5.711  -1.816
  554    H    LYS  72           H        LYS  72  94.646   4.822   0.675
  555    HA   LYS  72           HA       LYS  72  95.575   3.525   3.084
  556    HB2  LYS  72           HB2      LYS  72  96.822   3.426   0.944
  557    HB3  LYS  72           HB3      LYS  72  97.112   5.160   1.060
  558    HG2  LYS  72           HG2      LYS  72  99.062   4.323   2.023
  559    HG3  LYS  72           HG3      LYS  72  98.058   4.551   3.451
  560    HD2  LYS  72           HD2      LYS  72  98.871   2.368   3.740
  561    HD3  LYS  72           HD3      LYS  72  97.289   2.093   3.016
  562    HE2  LYS  72           HE2      LYS  72  98.572   0.745   1.647
  563    HE3  LYS  72           HE3      LYS  72  98.700   2.258   0.753
  564    HZ1  LYS  72           HZ1      LYS  72 100.636   1.410   2.832
  565    HZ2  LYS  72           HZ2      LYS  72 100.786   2.714   1.755
  566    HZ3  LYS  72           HZ3      LYS  72 100.853   1.118   1.177
  567    H    LYS  73           H        LYS  73  95.595   6.881   1.853
  568    HA   LYS  73           HA       LYS  73  96.870   7.982   4.107
  569    HB2  LYS  73           HB2      LYS  73  96.332   9.005   1.739
  570    HB3  LYS  73           HB3      LYS  73  94.884   9.595   2.552
  571    HG2  LYS  73           HG2      LYS  73  96.569  10.382   4.406
  572    HG3  LYS  73           HG3      LYS  73  97.766  10.241   3.119
  573    HD2  LYS  73           HD2      LYS  73  97.101  12.441   2.807
  574    HD3  LYS  73           HD3      LYS  73  95.958  11.624   1.742
  575    HE2  LYS  73           HE2      LYS  73  94.340  11.542   3.683
  576    HE3  LYS  73           HE3      LYS  73  95.460  12.569   4.577
  577    HZ1  LYS  73           HZ1      LYS  73  93.694  13.816   3.426
  578    HZ2  LYS  73           HZ2      LYS  73  94.295  13.261   1.937
  579    HZ3  LYS  73           HZ3      LYS  73  95.251  14.263   2.922
  580    H    TYR  74           H        TYR  74  93.619   6.910   3.651
  581    HA   TYR  74           HA       TYR  74  92.456   8.552   5.707
  582    HB2  TYR  74           HB2      TYR  74  91.356   7.198   3.684
  583    HB3  TYR  74           HB3      TYR  74  91.205   5.957   4.926
  584    HD1  TYR  74           HD1      TYR  74  90.751   9.680   4.627
  585    HD2  TYR  74           HD2      TYR  74  89.217   5.966   6.148
  586    HE1  TYR  74           HE1      TYR  74  88.796  10.874   5.577
  587    HE2  TYR  74           HE2      TYR  74  87.264   7.161   7.097
  588    HH   TYR  74           HH       TYR  74  86.441   9.212   7.619
  589    H    ILE  75           H        ILE  75  93.184   5.061   5.518
  590    HA   ILE  75           HA       ILE  75  93.645   5.088   8.444
  591    HB   ILE  75           HB       ILE  75  92.326   2.862   6.870
  592   HG12  ILE  75          HG12      ILE  75  91.024   4.582   8.985
  593   HG13  ILE  75          HG13      ILE  75  91.016   5.073   7.293
  594   HG21  ILE  75          HG21      ILE  75  93.056   3.254   9.779
  595   HG22  ILE  75          HG22      ILE  75  93.478   1.907   8.722
  596   HG23  ILE  75          HG23      ILE  75  91.816   2.105   9.279
  597   HD11  ILE  75          HD11      ILE  75  90.051   2.364   8.238
  598   HD12  ILE  75          HD12      ILE  75  89.857   3.069   6.634
  599   HD13  ILE  75          HD13      ILE  75  88.984   3.749   8.007
  600    HA   PRO  76           HA       PRO  76  97.459   3.846   5.978
  601    HB2  PRO  76           HB2      PRO  76  98.440   4.658   8.697
  602    HB3  PRO  76           HB1      PRO  76  99.165   4.955   7.104
  603    HG2  PRO  76           HG2      PRO  76  97.829   6.864   8.393
  604    HG3  PRO  76           HG1      PRO  76  97.742   6.699   6.630
  605    HD2  PRO  76           HD2      PRO  76  95.673   6.077   8.673
  606    HD3  PRO  76           HD1      PRO  76  95.474   6.503   6.960
  607    H    GLY  77           H        GLY  77  98.015   1.754   5.906
  608    HA2  GLY  77           HA2      GLY  77  99.069  -0.121   7.120
  609    HA3  GLY  77           HA3      GLY  77  97.879   0.141   8.391
  610    H    THR  78           H        THR  78  95.752   0.693   6.393
  611    HA   THR  78           HA       THR  78  94.582  -1.831   6.218
  612    HB   THR  78           HB       THR  78  93.378   0.337   5.974
  613    HG1  THR  78           HG1      THR  78  93.143  -1.614   3.938
  614   HG21  THR  78          HG21      THR  78  94.398   0.290   3.132
  615   HG22  THR  78          HG22      THR  78  95.157   1.258   4.396
  616   HG23  THR  78          HG23      THR  78  93.483   1.565   3.934
  617    H    LYS  79           H        LYS  79  94.464  -3.397   4.623
  618    HA   LYS  79           HA       LYS  79  96.666  -3.365   2.696
  619    HB2  LYS  79           HB2      LYS  79  96.029  -5.359   4.188
  620    HB3  LYS  79           HB3      LYS  79  94.671  -5.589   3.092
  621    HG2  LYS  79           HG2      LYS  79  96.247  -6.929   2.047
  622    HG3  LYS  79           HG3      LYS  79  96.571  -5.397   1.236
  623    HD2  LYS  79           HD2      LYS  79  98.383  -4.917   2.830
  624    HD3  LYS  79           HD3      LYS  79  98.044  -6.423   3.683
  625    HE2  LYS  79           HE2      LYS  79  98.439  -7.603   1.441
  626    HE3  LYS  79           HE3      LYS  79  99.117  -6.075   0.880
  627    HZ1  LYS  79           HZ1      LYS  79 100.755  -7.682   1.827
  628    HZ2  LYS  79           HZ2      LYS  79 100.026  -7.450   3.344
  629    HZ3  LYS  79           HZ3      LYS  79 100.772  -6.147   2.547
  630    H    MET  80           H        MET  80  95.966  -1.867   1.154
  631    HA   MET  80           HA       MET  80  94.444  -2.890  -0.988
  632    HB2  MET  80           HB2      MET  80  92.495  -2.500   0.411
  633    HB3  MET  80           HB1      MET  80  93.021  -0.849   0.740
  634    HG2  MET  80           HG2      MET  80  92.707  -0.201  -1.551
  635    HG3  MET  80           HG1      MET  80  92.470  -1.874  -2.055
  636    HE1  MET  80           HE1      MET  80  89.163   0.604  -2.076
  637    HE2  MET  80           HE2      MET  80  90.314  -0.155  -3.172
  638    HE3  MET  80           HE3      MET  80  90.862   1.091  -2.054
  639    H    ILE  81           H        ILE  81  96.129  -2.144  -2.233
  640    HA   ILE  81           HA       ILE  81  96.311   0.793  -2.531
  641    HB   ILE  81           HB       ILE  81  98.625  -1.158  -2.671
  642   HG12  ILE  81          HG12      ILE  81  99.306   0.469  -0.671
  643   HG13  ILE  81          HG13      ILE  81  97.560   0.657  -0.523
  644   HG21  ILE  81          HG21      ILE  81  98.384   1.837  -3.033
  645   HG22  ILE  81          HG22      ILE  81  99.000   0.657  -4.188
  646   HG23  ILE  81          HG23      ILE  81  99.922   1.030  -2.733
  647   HD11  ILE  81          HD11      ILE  81  97.734  -1.203   0.790
  648   HD12  ILE  81          HD12      ILE  81  99.266  -1.690   0.069
  649   HD13  ILE  81          HD13      ILE  81  97.750  -2.059  -0.750
  650    H    PHE  82           H        PHE  82  94.809   0.539  -4.283
  651    HA   PHE  82           HA       PHE  82  95.996  -0.692  -6.704
  652    HB2  PHE  82           HB2      PHE  82  94.016  -1.896  -6.263
  653    HB3  PHE  82           HB1      PHE  82  93.137  -0.448  -5.781
  654    HD1  PHE  82           HD2      PHE  82  95.259  -1.231  -8.783
  655    HD2  PHE  82           HD1      PHE  82  91.396  -0.076  -7.298
  656    HE1  PHE  82           HE2      PHE  82  94.451  -0.946 -11.108
  657    HE2  PHE  82           HE1      PHE  82  90.588   0.206  -9.624
  658    HZ   PHE  82           HZ       PHE  82  92.116  -0.228 -11.529
  659    H    ALA  83           H        ALA  83  93.237   1.495  -6.427
  660    HA   ALA  83           HA       ALA  83  94.730   3.781  -7.392
  661    HB1  ALA  83           HB1      ALA  83  92.703   2.410  -9.175
  662    HB2  ALA  83           HB2      ALA  83  94.430   2.578  -9.488
  663    HB3  ALA  83           HB3      ALA  83  93.395   4.005  -9.474
  664    H    GLY  84           H        GLY  84  93.863   5.496  -6.434
  665    HA2  GLY  84           HA2      GLY  84  91.298   5.340  -5.126
  666    HA3  GLY  84           HA3      GLY  84  92.382   6.728  -5.142
  667    H    ILE  85           H        ILE  85  89.847   7.386  -5.368
  668    HA   ILE  85           HA       ILE  85  89.037   7.495  -8.174
  669    HB   ILE  85           HB       ILE  85  87.761   8.521  -5.633
  670   HG12  ILE  85          HG12      ILE  85  87.924   5.961  -6.332
  671   HG13  ILE  85          HG13      ILE  85  86.424   6.618  -5.686
  672   HG21  ILE  85          HG21      ILE  85  86.927   8.710  -8.526
  673   HG22  ILE  85          HG22      ILE  85  86.987   9.992  -7.316
  674   HG23  ILE  85          HG23      ILE  85  85.741   8.747  -7.223
  675   HD11  ILE  85          HD11      ILE  85  86.951   6.622  -8.653
  676   HD12  ILE  85          HD12      ILE  85  85.408   6.732  -7.807
  677   HD13  ILE  85          HD13      ILE  85  86.284   5.201  -7.848
  678    H    LYS  86           H        LYS  86  88.434   9.599  -9.144
  679    HA   LYS  86           HA       LYS  86  90.404  11.666  -8.403
  680    HB2  LYS  86           HB2      LYS  86  88.966  11.097 -11.000
  681    HB3  LYS  86           HB3      LYS  86  89.993  12.507 -10.732
  682    HG2  LYS  86           HG2      LYS  86  91.817  10.844 -10.018
  683    HG3  LYS  86           HG3      LYS  86  90.792   9.592 -10.722
  684    HD2  LYS  86           HD2      LYS  86  91.759  12.054 -12.205
  685    HD3  LYS  86           HD3      LYS  86  92.496  10.457 -12.330
  686    HE2  LYS  86           HE2      LYS  86  90.148   9.613 -12.968
  687    HE3  LYS  86           HE3      LYS  86  89.737  11.312 -13.206
  688    HZ1  LYS  86           HZ1      LYS  86  90.687   9.883 -15.154
  689    HZ2  LYS  86           HZ2      LYS  86  92.182  10.270 -14.442
  690    HZ3  LYS  86           HZ3      LYS  86  91.144  11.507 -14.972
  691    H    LYS  87           H        LYS  87  87.216  11.741 -10.037
  692    HA   LYS  87           HA       LYS  87  86.662  14.333  -8.873
  693    HB2  LYS  87           HB2      LYS  87  84.958  12.523 -10.597
  694    HB3  LYS  87           HB3      LYS  87  84.548  14.177 -10.146
  695    HG2  LYS  87           HG2      LYS  87  87.028  14.607 -11.135
  696    HG3  LYS  87           HG3      LYS  87  86.591  13.189 -12.084
  697    HD2  LYS  87           HD2      LYS  87  84.839  15.653 -11.843
  698    HD3  LYS  87           HD3      LYS  87  85.973  15.381 -13.164
  699    HE2  LYS  87           HE2      LYS  87  83.850  13.354 -12.447
  700    HE3  LYS  87           HE3      LYS  87  83.542  14.669 -13.580
  701    HZ1  LYS  87           HZ1      LYS  87  84.960  13.814 -15.114
  702    HZ2  LYS  87           HZ2      LYS  87  84.461  12.364 -14.383
  703    HZ3  LYS  87           HZ3      LYS  87  85.953  13.060 -13.965
  704    H    LYS  88           H        LYS  88  84.613  14.793  -7.763
  705    HA   LYS  88           HA       LYS  88  84.282  13.077  -5.500
  706    HB2  LYS  88           HB2      LYS  88  83.989  15.623  -5.577
  707    HB3  LYS  88           HB3      LYS  88  82.410  15.304  -6.294
  708    HG2  LYS  88           HG2      LYS  88  81.897  13.814  -4.326
  709    HG3  LYS  88           HG3      LYS  88  83.406  14.356  -3.592
  710    HD2  LYS  88           HD2      LYS  88  81.938  15.885  -2.653
  711    HD3  LYS  88           HD3      LYS  88  82.399  16.765  -4.110
  712    HE2  LYS  88           HE2      LYS  88  80.401  15.845  -5.271
  713    HE3  LYS  88           HE3      LYS  88  79.928  15.037  -3.776
  714    HZ1  LYS  88           HZ1      LYS  88  79.717  17.816  -4.514
  715    HZ2  LYS  88           HZ2      LYS  88  80.338  17.562  -2.953
  716    HZ3  LYS  88           HZ3      LYS  88  78.823  16.922  -3.383
  717    H    THR  89           H        THR  89  82.121  13.984  -8.199
  718    HA   THR  89           HA       THR  89  79.934  12.418  -7.528
  719    HB   THR  89           HB       THR  89  79.437  12.354  -9.965
  720    HG1  THR  89           HG1      THR  89  81.313  13.979 -10.828
  721   HG21  THR  89          HG21      THR  89  80.376  14.980  -8.784
  722   HG22  THR  89          HG22      THR  89  78.754  14.297  -8.694
  723   HG23  THR  89          HG23      THR  89  79.391  14.851 -10.241
  724    H    GLU  90           H        GLU  90  83.036  11.460  -8.772
  725    HA   GLU  90           HA       GLU  90  82.276   8.878  -9.716
  726    HB2  GLU  90           HB2      GLU  90  84.901  10.099  -8.870
  727    HB3  GLU  90           HB3      GLU  90  84.779   8.400  -9.323
  728    HG2  GLU  90           HG2      GLU  90  84.080   8.929 -11.529
  729    HG3  GLU  90           HG3      GLU  90  83.731  10.603 -11.100
  730    H    ARG  91           H        ARG  91  83.384  10.188  -6.640
  731    HA   ARG  91           HA       ARG  91  83.463   7.650  -5.289
  732    HB2  ARG  91           HB2      ARG  91  83.310  10.450  -4.133
  733    HB3  ARG  91           HB3      ARG  91  83.779   8.988  -3.269
  734    HG2  ARG  91           HG2      ARG  91  85.671   8.709  -4.885
  735    HG3  ARG  91           HG3      ARG  91  85.247  10.272  -5.585
  736    HD2  ARG  91           HD2      ARG  91  85.394  10.612  -2.752
  737    HD3  ARG  91           HD3      ARG  91  86.844   9.753  -3.261
  738    HE   ARG  91           HE       ARG  91  86.595  11.796  -5.078
  739   HH11  ARG  91          HH21      ARG  91  86.712  11.522  -1.627
  740   HH12  ARG  91          HH22      ARG  91  87.451  13.071  -1.393
  741   HH21  ARG  91          HH11      ARG  91  87.565  13.826  -4.775
  742   HH22  ARG  91          HH12      ARG  91  87.934  14.374  -3.174
  743    H    GLU  92           H        GLU  92  81.258  10.458  -5.220
  744    HA   GLU  92           HA       GLU  92  79.363   9.411  -3.454
  745    HB2  GLU  92           HB2      GLU  92  79.588  11.782  -4.605
  746    HB3  GLU  92           HB3      GLU  92  78.469  11.086  -5.775
  747    HG2  GLU  92           HG2      GLU  92  78.055  11.411  -2.794
  748    HG3  GLU  92           HG3      GLU  92  77.130  12.156  -4.095
  749    H    ASP  93           H        ASP  93  79.338   9.347  -7.031
  750    HA   ASP  93           HA       ASP  93  77.036   7.772  -7.331
  751    HB2  ASP  93           HB2      ASP  93  79.501   7.918  -9.085
  752    HB3  ASP  93           HB1      ASP  93  77.963   7.200  -9.562
  753    H    LEU  94           H        LEU  94  80.461   6.808  -7.228
  754    HA   LEU  94           HA       LEU  94  80.125   4.045  -7.448
  755    HB2  LEU  94           HB2      LEU  94  82.331   5.082  -7.573
  756    HB3  LEU  94           HB3      LEU  94  82.198   5.605  -5.897
  757    HG   LEU  94           HG       LEU  94  82.158   3.304  -5.121
  758   HD11  LEU  94          HD11      LEU  94  81.028   2.067  -6.747
  759   HD12  LEU  94          HD12      LEU  94  82.696   1.553  -6.997
  760   HD13  LEU  94          HD13      LEU  94  81.974   2.752  -8.068
  761   HD21  LEU  94          HD21      LEU  94  84.362   3.639  -7.175
  762   HD22  LEU  94          HD22      LEU  94  84.421   2.670  -5.704
  763   HD23  LEU  94          HD23      LEU  94  84.355   4.428  -5.597
  764    H    ILE  95           H        ILE  95  79.941   6.169  -4.651
  765    HA   ILE  95           HA       ILE  95  79.716   4.045  -2.764
  766    HB   ILE  95           HB       ILE  95  79.366   7.021  -2.642
  767   HG12  ILE  95          HG12      ILE  95  81.062   5.450  -0.764
  768   HG13  ILE  95          HG13      ILE  95  81.543   5.392  -2.453
  769   HG21  ILE  95          HG21      ILE  95  78.410   4.956  -0.681
  770   HG22  ILE  95          HG22      ILE  95  77.688   6.507  -1.106
  771   HG23  ILE  95          HG23      ILE  95  79.106   6.452  -0.060
  772   HD11  ILE  95          HD11      ILE  95  82.209   7.565  -2.475
  773   HD12  ILE  95          HD12      ILE  95  82.320   7.349  -0.733
  774   HD13  ILE  95          HD13      ILE  95  80.889   8.097  -1.436
  775    H    ALA  96           H        ALA  96  77.491   5.916  -4.690
  776    HA   ALA  96           HA       ALA  96  75.104   5.315  -3.305
  777    HB1  ALA  96           HB1      ALA  96  75.346   5.597  -6.301
  778    HB2  ALA  96           HB2      ALA  96  75.428   6.983  -5.214
  779    HB3  ALA  96           HB3      ALA  96  73.966   6.000  -5.280
  780    H    TYR  97           H        TYR  97  77.015   3.591  -5.701
  781    HA   TYR  97           HA       TYR  97  75.126   1.461  -6.058
  782    HB2  TYR  97           HB2      TYR  97  76.732   1.936  -7.821
  783    HB3  TYR  97           HB3      TYR  97  78.076   1.647  -6.714
  784    HD1  TYR  97           HD1      TYR  97  75.097   0.009  -8.264
  785    HD2  TYR  97           HD2      TYR  97  78.910  -0.541  -6.369
  786    HE1  TYR  97           HE1      TYR  97  75.004  -2.413  -8.783
  787    HE2  TYR  97           HE2      TYR  97  78.817  -2.965  -6.887
  788    HH   TYR  97           HH       TYR  97  76.065  -4.354  -8.682
  789    H    LEU  98           H        LEU  98  78.264   1.733  -4.365
  790    HA   LEU  98           HA       LEU  98  78.415  -0.771  -3.235
  791    HB2  LEU  98           HB2      LEU  98  79.278   1.941  -2.280
  792    HB3  LEU  98           HB3      LEU  98  79.499   0.540  -1.239
  793    HG   LEU  98           HG       LEU  98  80.419   0.391  -4.100
  794   HD11  LEU  98          HD11      LEU  98  81.320   2.513  -2.851
  795   HD12  LEU  98          HD12      LEU  98  82.454   1.461  -3.690
  796   HD13  LEU  98          HD13      LEU  98  82.275   1.345  -1.941
  797   HD21  LEU  98          HD21      LEU  98  81.935  -1.242  -3.207
  798   HD22  LEU  98          HD22      LEU  98  80.367  -1.570  -2.471
  799   HD23  LEU  98          HD23      LEU  98  81.611  -0.723  -1.554
  800    H    LYS  99           H        LYS  99  76.179   1.777  -2.531
  801    HA   LYS  99           HA       LYS  99  75.401   0.755   0.060
  802    HB2  LYS  99           HB2      LYS  99  74.442   2.952  -1.744
  803    HB3  LYS  99           HB3      LYS  99  73.420   2.411  -0.413
  804    HG2  LYS  99           HG2      LYS  99  75.469   2.720   1.096
  805    HG3  LYS  99           HG3      LYS  99  76.210   3.574  -0.256
  806    HD2  LYS  99           HD2      LYS  99  73.505   4.314   0.892
  807    HD3  LYS  99           HD3      LYS  99  75.014   5.055   1.421
  808    HE2  LYS  99           HE2      LYS  99  75.450   5.628  -1.022
  809    HE3  LYS  99           HE3      LYS  99  73.783   5.146  -1.341
  810    HZ1  LYS  99           HZ1      LYS  99  74.300   7.030   0.841
  811    HZ2  LYS  99           HZ2      LYS  99  72.948   6.899  -0.179
  812    HZ3  LYS  99           HZ3      LYS  99  74.381   7.607  -0.752
  813    H    LYS 100           H        LYS 100  73.896   0.857  -3.178
  814    HA   LYS 100           HA       LYS 100  71.654  -0.745  -2.366
  815    HB2  LYS 100           HB2      LYS 100  72.712   0.193  -5.028
  816    HB3  LYS 100           HB3      LYS 100  71.372  -0.946  -4.933
  817    HG2  LYS 100           HG2      LYS 100  70.237   1.088  -4.978
  818    HG3  LYS 100           HG3      LYS 100  70.368   0.815  -3.242
  819    HD2  LYS 100           HD2      LYS 100  72.431   2.206  -3.207
  820    HD3  LYS 100           HD3      LYS 100  72.217   2.529  -4.927
  821    HE2  LYS 100           HE2      LYS 100  70.692   3.583  -2.597
  822    HE3  LYS 100           HE3      LYS 100  71.105   4.372  -4.118
  823    HZ1  LYS 100           HZ1      LYS 100  68.754   3.953  -4.026
  824    HZ2  LYS 100           HZ2      LYS 100  69.012   2.304  -3.714
  825    HZ3  LYS 100           HZ3      LYS 100  69.444   2.965  -5.218
  826    H    ALA 101           H        ALA 101  74.865  -1.426  -3.398
  827    HA   ALA 101           HA       ALA 101  74.271  -4.139  -4.262
  828    HB1  ALA 101           HB1      ALA 101  76.923  -2.736  -3.855
  829    HB2  ALA 101           HB2      ALA 101  76.046  -2.851  -5.381
  830    HB3  ALA 101           HB3      ALA 101  76.693  -4.307  -4.623
  831    H    THR 102           H        THR 102  75.478  -2.468  -1.428
  832    HA   THR 102           HA       THR 102  76.247  -4.964  -0.119
  833    HB   THR 102           HB       THR 102  76.856  -3.468   1.773
  834    HG1  THR 102           HG1      THR 102  75.479  -1.696   0.154
  835   HG21  THR 102          HG21      THR 102  77.876  -2.953  -1.011
  836   HG22  THR 102          HG22      THR 102  78.642  -3.845   0.302
  837   HG23  THR 102          HG23      THR 102  78.557  -2.085   0.365
  838    H    ASN 103           H        ASN 103  73.444  -3.323  -0.687
  839    HA   ASN 103           HA       ASN 103  72.190  -3.938   1.894
  840    HB2  ASN 103           HB2      ASN 103  71.433  -2.307  -0.508
  841    HB3  ASN 103           HB1      ASN 103  70.194  -2.837   0.621
  842   HD21  ASN 103          HD21      ASN 103  73.435  -2.192   1.802
  843   HD22  ASN 103          HD22      ASN 103  73.049  -0.755   2.616
  844    H    GLU 104           H        GLU 104  72.419  -5.067  -1.371
  845    HA   GLU 104           HA       GLU 104  70.027  -6.642  -1.389
  846    HB2  GLU 104           HB2      GLU 104  72.528  -6.625  -3.077
  847    HB3  GLU 104           HB3      GLU 104  71.237  -7.801  -3.329
  848    HG2  GLU 104           HG2      GLU 104  70.682  -4.835  -3.217
  849    HG3  GLU 104           HG3      GLU 104  71.129  -5.638  -4.721
  850    HHA  HEC 201           HA       HEC 105  89.314  -3.407   3.238
  851    HHB  HEC 201           HB       HEC 105  85.579   0.138  -0.431
  852    HHC  HEC 201           HC       HEC 105  88.805  -1.770  -5.533
  853    HHD  HEC 201           HD       HEC 105  92.148  -5.737  -1.916
  854   HMA1  HEC 201          HMA1      HEC 105  84.646  -0.056   1.576
  855   HMA2  HEC 201          HMA2      HEC 105  85.805   0.998   2.387
  856   HMA3  HEC 201          HMA3      HEC 105  85.085  -0.359   3.253
  857   HAA1  HEC 201          HAA1      HEC 105  86.833  -0.861   4.509
  858   HAA2  HEC 201          HAA2      HEC 105  88.377  -1.691   4.485
  859   HBA1  HEC 201          HBA1      HEC 105  87.335  -3.831   4.449
  860   HBA2  HEC 201          HBA2      HEC 105  85.753  -3.133   4.120
  861   HMB1  HEC 201          HMB1      HEC 105  84.839   1.241  -3.973
  862   HMB2  HEC 201          HMB2      HEC 105  85.177   1.631  -2.290
  863   HMB3  HEC 201          HMB3      HEC 105  84.154   0.253  -2.691
  864    HAB  HEC 201           HAB      HEC 105  87.303  -0.574  -6.203
  865   HBB1  HEC 201          HBB1      HEC 105  87.973   1.641  -5.998
  866   HBB2  HEC 201          HBB2      HEC 105  86.323   1.841  -6.579
  867   HBB3  HEC 201          HBB3      HEC 105  86.686   2.037  -4.866
  868   HMC1  HEC 201          HMC1      HEC 105  91.306  -4.287  -6.844
  869   HMC2  HEC 201          HMC2      HEC 105  91.197  -2.541  -6.628
  870   HMC3  HEC 201          HMC3      HEC 105  89.734  -3.493  -6.865
  871    HAC  HEC 201           HAC      HEC 105  92.615  -6.166  -3.834
  872   HBC1  HEC 201          HBC1      HEC 105  93.480  -3.931  -5.306
  873   HBC2  HEC 201          HBC2      HEC 105  93.365  -5.236  -6.485
  874   HBC3  HEC 201          HBC3      HEC 105  94.370  -5.431  -5.051
  875   HMD1  HEC 201          HMD1      HEC 105  93.187  -6.516   1.606
  876   HMD2  HEC 201          HMD2      HEC 105  93.370  -6.265  -0.125
  877   HMD3  HEC 201          HMD3      HEC 105  92.210  -7.450   0.476
  878   HAD1  HEC 201          HAD1      HEC 105  91.847  -6.208   3.260
  879   HAD2  HEC 201          HAD2      HEC 105  90.348  -5.442   3.744
  880   HBD1  HEC 201          HBD1      HEC 105  91.484  -3.302   4.022
  881   HBD2  HEC 201          HBD2      HEC 105  92.992  -4.004   3.447
  882    H1   HOH 301           H2       HOH 200  83.088   2.726  -0.802
  883    H2   HOH 301           H1       HOH 200  82.562   4.137  -0.953
  884    H1   HOH 302           H2       HOH 201  85.234   5.189   5.533
  885    H2   HOH 302           H1       HOH 201  86.373   6.187   5.567
  886    H1   HOH 303           H2       HOH 202  84.005  -6.512   5.527
  887    H2   HOH 303           H1       HOH 202  82.519  -6.560   5.806
  888    H1   HOH 304           H2       HOH 203  83.819 -10.341   0.950
  889    H2   HOH 304           H1       HOH 203  82.698 -10.786   0.035
  Start of MODEL   18
    1    H1   GLY   1           H1       GLY   1  72.960  11.118  -6.778
    2    H2   GLY   1           H2       GLY   1  74.395  11.458  -7.620
    3    H3   GLY   1           H3       GLY   1  74.358  11.558  -5.925
    4    HA2  GLY   1           HA2      GLY   1  75.466   9.529  -6.712
    5    HA3  GLY   1           HA3      GLY   1  74.043   9.201  -5.723
    6    H    ASP   2           H        ASP   2  75.555   8.595  -8.672
    7    HA   ASP   2           HA       ASP   2  73.043   7.721  -9.961
    8    HB2  ASP   2           HB2      ASP   2  75.789   8.251 -11.107
    9    HB3  ASP   2           HB1      ASP   2  74.436   7.590 -12.024
   10    H    VAL   3           H        VAL   3  72.858   5.812  -8.708
   11    HA   VAL   3           HA       VAL   3  74.732   3.861  -8.234
   12    HB   VAL   3           HB       VAL   3  72.505   3.675  -7.330
   13   HG11  VAL   3          HG11      VAL   3  70.599   3.085  -8.872
   14   HG12  VAL   3          HG12      VAL   3  71.660   3.452 -10.232
   15   HG13  VAL   3          HG13      VAL   3  71.221   4.721  -9.089
   16   HG21  VAL   3          HG21      VAL   3  73.839   1.571  -7.944
   17   HG22  VAL   3          HG22      VAL   3  72.758   1.417  -9.328
   18   HG23  VAL   3          HG23      VAL   3  72.109   1.351  -7.690
   19    H    GLU   4           H        GLU   4  73.470   4.887 -11.260
   20    HA   GLU   4           HA       GLU   4  73.934   2.454 -12.711
   21    HB2  GLU   4           HB2      GLU   4  73.576   5.319 -13.611
   22    HB3  GLU   4           HB3      GLU   4  73.728   3.954 -14.719
   23    HG2  GLU   4           HG2      GLU   4  71.641   4.103 -12.529
   24    HG3  GLU   4           HG3      GLU   4  71.344   4.607 -14.192
   25    H    LYS   5           H        LYS   5  75.652   5.594 -12.743
   26    HA   LYS   5           HA       LYS   5  77.910   4.489 -14.123
   27    HB2  LYS   5           HB2      LYS   5  77.264   7.120 -12.833
   28    HB3  LYS   5           HB3      LYS   5  78.945   6.753 -13.217
   29    HG2  LYS   5           HG2      LYS   5  78.548   6.665 -15.514
   30    HG3  LYS   5           HG3      LYS   5  76.834   6.304 -15.310
   31    HD2  LYS   5           HD2      LYS   5  77.884   8.939 -14.321
   32    HD3  LYS   5           HD3      LYS   5  77.609   8.727 -16.049
   33    HE2  LYS   5           HE2      LYS   5  75.304   8.391 -15.775
   34    HE3  LYS   5           HE3      LYS   5  75.472   7.940 -14.079
   35    HZ1  LYS   5           HZ1      LYS   5  74.654  10.090 -13.997
   36    HZ2  LYS   5           HZ2      LYS   5  75.607  10.623 -15.298
   37    HZ3  LYS   5           HZ3      LYS   5  76.322  10.319 -13.787
   38    H    GLY   6           H        GLY   6  76.877   4.602 -10.865
   39    HA2  GLY   6           HA2      GLY   6  79.459   4.382  -9.624
   40    HA3  GLY   6           HA3      GLY   6  77.904   4.014  -8.872
   41    H    LYS   7           H        LYS   7  77.068   2.234 -10.981
   42    HA   LYS   7           HA       LYS   7  78.150  -0.214 -10.001
   43    HB2  LYS   7           HB2      LYS   7  75.814   0.144 -10.930
   44    HB3  LYS   7           HB3      LYS   7  76.545   0.178 -12.533
   45    HG2  LYS   7           HG2      LYS   7  77.674  -2.088 -11.649
   46    HG3  LYS   7           HG3      LYS   7  76.232  -2.113 -10.638
   47    HD2  LYS   7           HD2      LYS   7  75.458  -3.234 -12.527
   48    HD3  LYS   7           HD3      LYS   7  74.994  -1.578 -12.913
   49    HE2  LYS   7           HE2      LYS   7  77.301  -1.393 -14.061
   50    HE3  LYS   7           HE3      LYS   7  77.350  -3.153 -13.958
   51    HZ1  LYS   7           HZ1      LYS   7  75.796  -3.372 -15.535
   52    HZ2  LYS   7           HZ2      LYS   7  76.220  -1.784 -15.965
   53    HZ3  LYS   7           HZ3      LYS   7  74.872  -2.066 -14.971
   54    H    LYS   8           H        LYS   8  78.523   1.640 -13.019
   55    HA   LYS   8           HA       LYS   8  80.171  -0.199 -14.372
   56    HB2  LYS   8           HB2      LYS   8  79.165   1.667 -15.542
   57    HB3  LYS   8           HB3      LYS   8  80.050   2.820 -14.546
   58    HG2  LYS   8           HG2      LYS   8  81.748   0.807 -15.905
   59    HG3  LYS   8           HG3      LYS   8  80.914   1.914 -16.991
   60    HD2  LYS   8           HD2      LYS   8  82.351   3.006 -14.580
   61    HD3  LYS   8           HD3      LYS   8  83.265   2.581 -16.026
   62    HE2  LYS   8           HE2      LYS   8  80.895   4.472 -15.952
   63    HE3  LYS   8           HE3      LYS   8  82.585   4.959 -16.065
   64    HZ1  LYS   8           HZ1      LYS   8  82.216   4.850 -18.254
   65    HZ2  LYS   8           HZ2      LYS   8  80.838   3.872 -18.091
   66    HZ3  LYS   8           HZ3      LYS   8  82.387   3.174 -18.057
   67    H    ILE   9           H        ILE   9  80.977   2.498 -12.211
   68    HA   ILE   9           HA       ILE   9  83.796   2.211 -12.423
   69    HB   ILE   9           HB       ILE   9  82.117   3.446 -10.230
   70   HG12  ILE   9          HG12      ILE   9  83.616   4.857 -12.446
   71   HG13  ILE   9          HG13      ILE   9  81.946   4.328 -12.656
   72   HG21  ILE   9          HG21      ILE   9  85.071   3.576 -10.881
   73   HG22  ILE   9          HG22      ILE   9  84.326   3.022  -9.382
   74   HG23  ILE   9          HG23      ILE   9  84.264   4.729  -9.818
   75   HD11  ILE   9          HD11      ILE   9  81.286   5.625 -10.654
   76   HD12  ILE   9          HD12      ILE   9  82.016   6.663 -11.880
   77   HD13  ILE   9          HD13      ILE   9  82.953   6.173 -10.469
   78    H    PHE  10           H        PHE  10  81.371   0.550 -10.598
   79    HA   PHE  10           HA       PHE  10  83.206  -0.469  -8.607
   80    HB2  PHE  10           HB2      PHE  10  81.062  -0.316  -7.733
   81    HB3  PHE  10           HB1      PHE  10  80.300  -0.854  -9.230
   82    HD1  PHE  10           HD1      PHE  10  80.243  -3.229  -9.838
   83    HD2  PHE  10           HD2      PHE  10  81.979  -1.917  -6.141
   84    HE1  PHE  10           HE1      PHE  10  80.239  -5.565  -9.015
   85    HE2  PHE  10           HE2      PHE  10  81.979  -4.256  -5.313
   86    HZ   PHE  10           HZ       PHE  10  81.110  -6.081  -6.755
   87    H    VAL  11           H        VAL  11  81.363  -1.940 -11.296
   88    HA   VAL  11           HA       VAL  11  82.349  -4.531 -11.073
   89    HB   VAL  11           HB       VAL  11  81.779  -4.779 -13.471
   90   HG11  VAL  11          HG11      VAL  11  79.442  -4.424 -13.187
   91   HG12  VAL  11          HG12      VAL  11  79.707  -3.092 -12.065
   92   HG13  VAL  11          HG13      VAL  11  80.070  -4.745 -11.572
   93   HG21  VAL  11          HG21      VAL  11  80.834  -2.772 -14.625
   94   HG22  VAL  11          HG22      VAL  11  82.557  -2.612 -14.278
   95   HG23  VAL  11          HG23      VAL  11  81.371  -1.784 -13.269
   96    H    GLN  12           H        GLN  12  83.809  -1.694 -12.506
   97    HA   GLN  12           HA       GLN  12  85.985  -3.315 -13.623
   98    HB2  GLN  12           HB2      GLN  12  86.663  -1.342 -14.785
   99    HB3  GLN  12           HB1      GLN  12  84.911  -1.475 -14.934
  100    HG2  GLN  12           HG2      GLN  12  84.739   0.063 -12.912
  101    HG3  GLN  12           HG1      GLN  12  86.472   0.346 -13.090
  102   HE21  GLN  12          HE21      GLN  12  85.591  -0.175 -16.182
  103   HE22  GLN  12          HE22      GLN  12  85.186   1.400 -16.658
  104    H    LYS  13           H        LYS  13  85.377  -1.171 -10.918
  105    HA   LYS  13           HA       LYS  13  88.268  -1.010 -10.394
  106    HB2  LYS  13           HB2      LYS  13  86.683   1.022 -10.384
  107    HB3  LYS  13           HB3      LYS  13  86.177   0.434  -8.800
  108    HG2  LYS  13           HG2      LYS  13  88.416   0.601  -7.936
  109    HG3  LYS  13           HG3      LYS  13  89.080   0.898  -9.541
  110    HD2  LYS  13           HD2      LYS  13  86.972   2.770  -8.524
  111    HD3  LYS  13           HD3      LYS  13  88.600   2.912  -7.863
  112    HE2  LYS  13           HE2      LYS  13  89.538   3.235 -10.071
  113    HE3  LYS  13           HE3      LYS  13  87.986   2.885 -10.831
  114    HZ1  LYS  13           HZ1      LYS  13  87.986   5.009  -8.850
  115    HZ2  LYS  13           HZ2      LYS  13  87.185   4.913 -10.346
  116    HZ3  LYS  13           HZ3      LYS  13  88.828   5.343 -10.284
  117    H    CYS  14           H        CYS  14  85.397  -1.434  -8.255
  118    HA   CYS  14           HA       CYS  14  87.083  -2.695  -6.280
  119    HB2  CYS  14           HB2      CYS  14  84.108  -2.640  -6.068
  120    HB3  CYS  14           HB1      CYS  14  85.315  -2.490  -4.796
  121    H    ALA  15           H        ALA  15  84.582  -3.891  -8.493
  122    HA   ALA  15           HA       ALA  15  84.093  -6.368  -7.418
  123    HB1  ALA  15           HB1      ALA  15  84.315  -5.423 -10.254
  124    HB2  ALA  15           HB2      ALA  15  82.882  -5.917  -9.354
  125    HB3  ALA  15           HB3      ALA  15  84.029  -7.131  -9.918
  126    H    GLN  16           H        GLN  16  87.030  -5.223  -8.887
  127    HA   GLN  16           HA       GLN  16  88.339  -7.508  -9.656
  128    HB2  GLN  16           HB2      GLN  16  89.346  -5.035  -8.267
  129    HB3  GLN  16           HB1      GLN  16  90.440  -6.323  -8.769
  130    HG2  GLN  16           HG2      GLN  16  89.701  -6.107 -11.080
  131    HG3  GLN  16           HG1      GLN  16  88.495  -4.909 -10.615
  132   HE21  GLN  16          HE21      GLN  16  90.668  -4.411 -12.510
  133   HE22  GLN  16          HE22      GLN  16  91.652  -3.206 -11.829
  134    H    CYS  17           H        CYS  17  88.567  -6.129  -6.344
  135    HA   CYS  17           HA       CYS  17  89.001  -8.890  -5.359
  136    HB2  CYS  17           HB2      CYS  17  90.209  -6.711  -3.772
  137    HB3  CYS  17           HB1      CYS  17  90.857  -8.291  -4.194
  138    H    HIS  18           H        HSD  18  86.439  -8.069  -5.393
  139    HA   HIS  18           HA       HSD  18  85.823  -7.929  -2.560
  140    HB2  HIS  18           HB2      HSD  18  85.245  -5.643  -4.417
  141    HB3  HIS  18           HB1      HSD  18  84.142  -5.993  -3.090
  142    HD1  HIS  18           HD1      HSD  18  85.058  -5.707  -0.656
  143    HD2  HIS  18           HD2      HSD  18  87.758  -4.609  -3.632
  144    HE1  HIS  18           HE1      HSD  18  86.901  -4.407   0.496
  145    H    THR  19           H        THR  19  83.225  -7.603  -2.463
  146    HA   THR  19           HA       THR  19  81.971  -9.263  -4.547
  147    HB   THR  19           HB       THR  19  81.092  -9.900  -1.811
  148    HG1  THR  19           HG1      THR  19  83.347 -11.270  -2.256
  149   HG21  THR  19          HG21      THR  19  80.586 -11.061  -4.068
  150   HG22  THR  19          HG22      THR  19  80.959 -12.083  -2.679
  151   HG23  THR  19          HG23      THR  19  82.193 -11.767  -3.901
  152    H    VAL  20           H        VAL  20  81.540  -7.273  -1.657
  153    HA   VAL  20           HA       VAL  20  79.791  -5.982  -0.920
  154    HB   VAL  20           HB       VAL  20  79.224  -4.211  -2.425
  155   HG11  VAL  20          HG11      VAL  20  81.608  -4.442  -1.618
  156   HG12  VAL  20          HG12      VAL  20  81.428  -3.503  -3.097
  157   HG13  VAL  20          HG13      VAL  20  81.996  -5.168  -3.174
  158   HG21  VAL  20          HG21      VAL  20  79.502  -4.326  -4.791
  159   HG22  VAL  20          HG22      VAL  20  78.680  -5.819  -4.345
  160   HG23  VAL  20          HG23      VAL  20  80.409  -5.830  -4.681
  161    H    GLU  21           H        GLU  21  79.043  -8.708  -2.104
  162    HA   GLU  21           HA       GLU  21  76.225  -8.076  -2.746
  163    HB2  GLU  21           HB2      GLU  21  76.084 -10.076  -3.964
  164    HB3  GLU  21           HB3      GLU  21  77.684  -9.458  -4.368
  165    HG2  GLU  21           HG2      GLU  21  78.536 -10.900  -2.408
  166    HG3  GLU  21           HG3      GLU  21  76.963 -11.696  -2.482
  167    H    LYS  22           H        LYS  22  74.901  -8.241  -1.083
  168    HA   LYS  22           HA       LYS  22  75.500  -9.318   1.410
  169    HB2  LYS  22           HB2      LYS  22  73.173  -8.221   0.068
  170    HB3  LYS  22           HB3      LYS  22  72.708  -9.557   1.118
  171    HG2  LYS  22           HG2      LYS  22  74.542  -7.346   2.069
  172    HG3  LYS  22           HG3      LYS  22  72.789  -7.213   2.180
  173    HD2  LYS  22           HD2      LYS  22  72.856  -9.494   3.372
  174    HD3  LYS  22           HD3      LYS  22  74.592  -9.226   3.530
  175    HE2  LYS  22           HE2      LYS  22  74.148  -7.078   4.676
  176    HE3  LYS  22           HE3      LYS  22  72.415  -7.374   4.542
  177    HZ1  LYS  22           HZ1      LYS  22  73.218  -9.649   5.653
  178    HZ2  LYS  22           HZ2      LYS  22  72.720  -8.297   6.554
  179    HZ3  LYS  22           HZ3      LYS  22  74.374  -8.592   6.305
  180    H    GLY  23           H        GLY  23  75.529 -11.306   2.248
  181    HA2  GLY  23           HA2      GLY  23  75.138 -13.566   2.521
  182    HA3  GLY  23           HA3      GLY  23  73.904 -13.459   1.272
  183    H    GLY  24           H        GLY  24  77.186 -12.379   0.706
  184    HA2  GLY  24           HA2      GLY  24  77.515 -14.572  -1.250
  185    HA3  GLY  24           HA3      GLY  24  78.318 -13.008  -1.327
  186    H    LYS  25           H        LYS  25  80.406 -13.694  -1.357
  187    HA   LYS  25           HA       LYS  25  81.467 -14.709   1.172
  188    HB2  LYS  25           HB2      LYS  25  82.901 -16.360  -0.111
  189    HB3  LYS  25           HB3      LYS  25  81.195 -16.781   0.020
  190    HG2  LYS  25           HG2      LYS  25  81.961 -15.143  -2.349
  191    HG3  LYS  25           HG3      LYS  25  82.537 -16.807  -2.335
  192    HD2  LYS  25           HD2      LYS  25  80.295 -17.661  -2.102
  193    HD3  LYS  25           HD3      LYS  25  79.648 -16.042  -1.837
  194    HE2  LYS  25           HE2      LYS  25  79.204 -16.654  -4.138
  195    HE3  LYS  25           HE3      LYS  25  80.461 -15.418  -4.136
  196    HZ1  LYS  25           HZ1      LYS  25  82.117 -17.208  -4.268
  197    HZ2  LYS  25           HZ2      LYS  25  81.075 -17.193  -5.609
  198    HZ3  LYS  25           HZ3      LYS  25  80.868 -18.349  -4.381
  199    H    HIS  26           H        HIS  26  83.362 -13.779   1.678
  200    HA   HIS  26           HA       HIS  26  84.350 -11.609   0.162
  201    HB2  HIS  26           HB2      HIS  26  86.438 -12.154   1.807
  202    HB3  HIS  26           HB1      HIS  26  84.988 -11.299   2.331
  203    HD1  HIS  26           HD1      HIS  26  86.384 -14.839   2.218
  204    HD2  HIS  26           HD2      HIS  26  83.551 -12.608   4.311
  205    HE1  HIS  26           HE1      HIS  26  85.531 -16.329   4.081
  206    HE2  HIS  26           HE2      HIS  26  83.803 -14.982   5.366
  207    H    LYS  27           H        LYS  27  85.783 -11.488  -1.439
  208    HA   LYS  27           HA       LYS  27  87.443 -13.866  -2.051
  209    HB2  LYS  27           HB2      LYS  27  85.580 -13.650  -3.659
  210    HB3  LYS  27           HB3      LYS  27  86.100 -12.006  -4.029
  211    HG2  LYS  27           HG2      LYS  27  88.205 -12.792  -4.909
  212    HG3  LYS  27           HG3      LYS  27  87.881 -14.434  -4.354
  213    HD2  LYS  27           HD2      LYS  27  87.429 -14.206  -6.774
  214    HD3  LYS  27           HD3      LYS  27  85.956 -14.583  -5.882
  215    HE2  LYS  27           HE2      LYS  27  85.123 -12.394  -6.080
  216    HE3  LYS  27           HE3      LYS  27  86.715 -11.718  -6.425
  217    HZ1  LYS  27           HZ1      LYS  27  86.360 -12.002  -8.574
  218    HZ2  LYS  27           HZ2      LYS  27  84.793 -12.573  -8.244
  219    HZ3  LYS  27           HZ3      LYS  27  86.092 -13.663  -8.356
  220    H    THR  28           H        THR  28  89.548 -13.424  -1.950
  221    HA   THR  28           HA       THR  28  91.488 -12.187  -1.713
  222    HB   THR  28           HB       THR  28  90.511 -10.595  -4.072
  223    HG1  THR  28           HG1      THR  28  91.342 -13.304  -4.019
  224   HG21  THR  28          HG21      THR  28  92.748 -10.105  -3.223
  225   HG22  THR  28          HG22      THR  28  92.879 -10.934  -4.773
  226   HG23  THR  28          HG23      THR  28  93.169 -11.816  -3.274
  227    H    GLY  29           H        GLY  29  89.066 -11.176  -0.345
  228    HA2  GLY  29           HA2      GLY  29  90.033  -8.908   0.875
  229    HA3  GLY  29           HA3      GLY  29  89.063  -8.315  -0.470
  230    HA   PRO  30           HA       PRO  30  86.423  -9.716   3.272
  231    HB2  PRO  30           HB2      PRO  30  86.027  -7.321   4.535
  232    HB3  PRO  30           HB1      PRO  30  87.357  -8.423   4.940
  233    HG2  PRO  30           HG2      PRO  30  87.387  -5.962   3.261
  234    HG3  PRO  30           HG1      PRO  30  88.577  -6.539   4.440
  235    HD2  PRO  30           HD2      PRO  30  88.902  -6.839   1.737
  236    HD3  PRO  30           HD1      PRO  30  89.584  -7.972   2.925
  237    H    ASN  31           H        ASN  31  84.145  -9.192   3.561
  238    HA   ASN  31           HA       ASN  31  82.948  -8.139   1.136
  239    HB2  ASN  31           HB2      ASN  31  80.906  -9.025   1.959
  240    HB3  ASN  31           HB1      ASN  31  82.138 -10.184   2.454
  241   HD21  ASN  31          HD21      ASN  31  82.616 -10.374   4.731
  242   HD22  ASN  31          HD22      ASN  31  81.679  -9.600   5.915
  243    H    LEU  32           H        LEU  32  81.255  -6.478   1.203
  244    HA   LEU  32           HA       LEU  32  81.751  -4.472   3.325
  245    HB2  LEU  32           HB2      LEU  32  80.806  -3.886   0.514
  246    HB3  LEU  32           HB3      LEU  32  81.335  -2.729   1.728
  247    HG   LEU  32           HG       LEU  32  83.020  -4.727   0.203
  248   HD11  LEU  32          HD11      LEU  32  82.689  -2.619  -0.936
  249   HD12  LEU  32          HD12      LEU  32  84.319  -2.609  -0.269
  250   HD13  LEU  32          HD13      LEU  32  83.032  -1.712   0.535
  251   HD21  LEU  32          HD21      LEU  32  83.539  -3.373   2.827
  252   HD22  LEU  32          HD22      LEU  32  84.870  -3.508   1.686
  253   HD23  LEU  32          HD23      LEU  32  84.060  -4.956   2.266
  254    H    HIS  33           H        HIS  33  79.825  -6.591   3.523
  255    HA   HIS  33           HA       HIS  33  77.210  -5.719   2.830
  256    HB2  HIS  33           HB2      HIS  33  78.055  -7.570   5.074
  257    HB3  HIS  33           HB1      HIS  33  76.438  -7.441   4.381
  258    HD1  HIS  33           HD1      HIS  33  78.347 -10.033   4.301
  259    HD2  HIS  33           HD2      HIS  33  77.667  -7.365   1.170
  260    HE1  HIS  33           HE1      HIS  33  78.864 -11.289   2.164
  261    HE2  HIS  33           HE2      HIS  33  78.453  -9.678   0.246
  262    H    GLY  34           H        GLY  34  75.726  -4.488   3.942
  263    HA2  GLY  34           HA2      GLY  34  75.156  -2.677   5.296
  264    HA3  GLY  34           HA3      GLY  34  75.500  -3.849   6.568
  265    H    LEU  35           H        LEU  35  77.969  -2.807   4.382
  266    HA   LEU  35           HA       LEU  35  79.950  -2.227   6.136
  267    HB2  LEU  35           HB2      LEU  35  80.325  -2.251   3.753
  268    HB3  LEU  35           HB3      LEU  35  79.283  -0.852   3.527
  269    HG   LEU  35           HG       LEU  35  81.016   0.259   5.239
  270   HD11  LEU  35          HD11      LEU  35  82.199  -2.092   5.256
  271   HD12  LEU  35          HD12      LEU  35  83.173  -0.623   5.207
  272   HD13  LEU  35          HD13      LEU  35  82.884  -1.534   3.730
  273   HD21  LEU  35          HD21      LEU  35  81.758  -0.181   2.338
  274   HD22  LEU  35          HD22      LEU  35  82.158   1.211   3.344
  275   HD23  LEU  35          HD23      LEU  35  80.487   0.925   2.858
  276    H    PHE  36           H        PHE  36  77.785   0.242   4.772
  277    HA   PHE  36           HA       PHE  36  78.670   2.400   6.285
  278    HB2  PHE  36           HB2      PHE  36  75.805   2.002   5.414
  279    HB3  PHE  36           HB1      PHE  36  76.672   3.522   5.627
  280    HD1  PHE  36           HD2      PHE  36  76.540   0.410   3.573
  281    HD2  PHE  36           HD1      PHE  36  78.011   4.439   3.869
  282    HE1  PHE  36           HE2      PHE  36  77.328   0.299   1.228
  283    HE2  PHE  36           HE1      PHE  36  78.786   4.326   1.526
  284    HZ   PHE  36           HZ       PHE  36  78.447   2.258   0.201
  285    H    GLY  37           H        GLY  37  79.032   1.774   8.452
  286    HA2  GLY  37           HA2      GLY  37  77.509   2.498  10.449
  287    HA3  GLY  37           HA3      GLY  37  76.664   1.017  10.030
  288    H    ARG  38           H        ARG  38  79.348  -0.242   9.296
  289    HA   ARG  38           HA       ARG  38  79.915  -1.187  11.998
  290    HB2  ARG  38           HB2      ARG  38  80.339  -2.182   9.256
  291    HB3  ARG  38           HB3      ARG  38  81.625  -2.581  10.394
  292    HG2  ARG  38           HG2      ARG  38  79.831  -3.429  11.971
  293    HG3  ARG  38           HG3      ARG  38  78.682  -3.240  10.644
  294    HD2  ARG  38           HD2      ARG  38  81.217  -4.896  10.501
  295    HD3  ARG  38           HD3      ARG  38  79.612  -5.556  10.802
  296    HE   ARG  38           HE       ARG  38  79.390  -4.078   8.468
  297   HH11  ARG  38          HH21      ARG  38  81.258  -6.746   9.645
  298   HH12  ARG  38          HH22      ARG  38  81.432  -7.484   8.087
  299   HH21  ARG  38          HH11      ARG  38  79.620  -5.043   6.430
  300   HH22  ARG  38          HH12      ARG  38  80.498  -6.527   6.272
  301    H    LYS  39           H        LYS  39  82.061  -1.426  12.822
  302    HA   LYS  39           HA       LYS  39  83.679   0.944  12.417
  303    HB2  LYS  39           HB2      LYS  39  83.194   0.081  14.679
  304    HB3  LYS  39           HB3      LYS  39  84.035  -1.411  14.284
  305    HG2  LYS  39           HG2      LYS  39  85.682  -0.186  15.414
  306    HG3  LYS  39           HG3      LYS  39  86.060   0.146  13.733
  307    HD2  LYS  39           HD2      LYS  39  86.118   2.236  14.970
  308    HD3  LYS  39           HD3      LYS  39  84.724   2.260  13.894
  309    HE2  LYS  39           HE2      LYS  39  84.231   1.145  16.606
  310    HE3  LYS  39           HE3      LYS  39  84.569   2.873  16.534
  311    HZ1  LYS  39           HZ1      LYS  39  82.598   3.272  15.627
  312    HZ2  LYS  39           HZ2      LYS  39  82.172   1.675  16.021
  313    HZ3  LYS  39           HZ3      LYS  39  82.775   2.040  14.476
  314    H    THR  40           H        THR  40  85.894   0.947  11.877
  315    HA   THR  40           HA       THR  40  86.696  -0.509   9.690
  316    HB   THR  40           HB       THR  40  89.040   0.161  10.364
  317    HG1  THR  40           HG1      THR  40  87.753   1.579  12.422
  318   HG21  THR  40          HG21      THR  40  86.722   2.070  10.193
  319   HG22  THR  40          HG22      THR  40  87.944   1.701   8.975
  320   HG23  THR  40          HG23      THR  40  88.366   2.680  10.380
  321    H    GLY  41           H        GLY  41  87.818  -2.344   9.280
  322    HA2  GLY  41           HA2      GLY  41  88.422  -4.537   9.608
  323    HA3  GLY  41           HA3      GLY  41  89.374  -3.886  10.937
  324    H    GLN  42           H        GLN  42  85.874  -4.303  10.402
  325    HA   GLN  42           HA       GLN  42  85.743  -5.684  13.023
  326    HB2  GLN  42           HB2      GLN  42  84.500  -3.572  12.980
  327    HB3  GLN  42           HB1      GLN  42  83.586  -4.129  11.577
  328    HG2  GLN  42           HG2      GLN  42  82.458  -5.785  12.809
  329    HG3  GLN  42           HG1      GLN  42  83.655  -5.770  14.102
  330   HE21  GLN  42          HE21      GLN  42  81.694  -3.169  12.537
  331   HE22  GLN  42          HE22      GLN  42  81.090  -2.555  14.000
  332    H    ALA  43           H        ALA  43  85.198  -6.003   9.638
  333    HA   ALA  43           HA       ALA  43  83.220  -8.037   9.721
  334    HB1  ALA  43           HB1      ALA  43  83.264  -7.633   7.518
  335    HB2  ALA  43           HB2      ALA  43  84.863  -8.362   7.411
  336    HB3  ALA  43           HB3      ALA  43  84.700  -6.634   7.728
  337    HA   PRO  44           HA       PRO  44  86.105 -11.206  11.104
  338    HB2  PRO  44           HB2      PRO  44  84.306 -13.185  11.516
  339    HB3  PRO  44           HB1      PRO  44  84.431 -11.788  12.605
  340    HG2  PRO  44           HG2      PRO  44  82.458 -12.322  10.435
  341    HG3  PRO  44           HG1      PRO  44  82.203 -11.622  12.043
  342    HD2  PRO  44           HD2      PRO  44  82.411 -10.127   9.726
  343    HD3  PRO  44           HD1      PRO  44  82.772  -9.502  11.352
  344    H    GLY  45           H        GLY  45  87.369 -11.881   9.415
  345    HA2  GLY  45           HA2      GLY  45  86.910 -14.230   8.037
  346    HA3  GLY  45           HA3      GLY  45  86.327 -12.952   6.977
  347    H    PHE  46           H        PHE  46  87.839 -11.280   6.328
  348    HA   PHE  46           HA       PHE  46  90.390 -12.352   5.622
  349    HB2  PHE  46           HB2      PHE  46  89.047 -10.690   4.268
  350    HB3  PHE  46           HB1      PHE  46  89.527  -9.461   5.440
  351    HD1  PHE  46           HD2      PHE  46  90.749 -11.822   2.863
  352    HD2  PHE  46           HD1      PHE  46  91.786  -8.618   5.529
  353    HE1  PHE  46           HE2      PHE  46  92.921 -11.555   1.696
  354    HE2  PHE  46           HE1      PHE  46  93.958  -8.351   4.362
  355    HZ   PHE  46           HZ       PHE  46  94.525  -9.819   2.446
  356    H    THR  47           H        THR  47  92.458 -11.610   6.239
  357    HA   THR  47           HA       THR  47  92.707 -11.009   9.031
  358    HB   THR  47           HB       THR  47  94.864 -10.997   6.913
  359    HG1  THR  47           HG1      THR  47  93.334 -12.965   7.629
  360   HG21  THR  47          HG21      THR  47  96.321 -11.519   8.839
  361   HG22  THR  47          HG22      THR  47  94.930 -11.404   9.916
  362   HG23  THR  47          HG23      THR  47  95.500  -9.973   9.056
  363    H    TYR  48           H        TYR  48  91.587  -8.978   9.148
  364    HA   TYR  48           HA       TYR  48  92.248  -6.670   7.707
  365    HB2  TYR  48           HB2      TYR  48  90.920  -7.242  10.307
  366    HB3  TYR  48           HB3      TYR  48  91.463  -5.589  10.038
  367    HD1  TYR  48           HD2      TYR  48  90.902  -4.588   7.671
  368    HD2  TYR  48           HD1      TYR  48  88.823  -7.877   9.485
  369    HE1  TYR  48           HE2      TYR  48  88.946  -4.150   6.218
  370    HE2  TYR  48           HE1      TYR  48  86.865  -7.437   8.034
  371    HH   TYR  48           HH       TYR  48  86.392  -4.618   6.393
  372    H    THR  49           H        THR  49  93.524  -4.865   8.237
  373    HA   THR  49           HA       THR  49  96.049  -5.565   9.488
  374    HB   THR  49           HB       THR  49  96.843  -3.460   8.631
  375    HG1  THR  49           HG1      THR  49  95.279  -2.027   9.015
  376   HG21  THR  49          HG21      THR  49  96.170  -3.664   6.231
  377   HG22  THR  49          HG22      THR  49  94.913  -4.800   6.717
  378   HG23  THR  49          HG23      THR  49  96.612  -5.207   6.957
  379    H    ASP  50           H        ASP  50  96.993  -4.443  11.243
  380    HA   ASP  50           HA       ASP  50  95.422  -4.030  13.473
  381    HB2  ASP  50           HB2      ASP  50  98.011  -2.571  12.937
  382    HB3  ASP  50           HB1      ASP  50  97.331  -3.007  14.504
  383    H    ALA  51           H        ALA  51  96.417  -1.683  11.023
  384    HA   ALA  51           HA       ALA  51  95.529   0.657  12.296
  385    HB1  ALA  51           HB1      ALA  51  96.914   0.695  10.275
  386    HB2  ALA  51           HB2      ALA  51  95.435   1.627  10.038
  387    HB3  ALA  51           HB3      ALA  51  95.583   0.013   9.341
  388    H    ASN  52           H        ASN  52  93.800  -1.708  10.321
  389    HA   ASN  52           HA       ASN  52  91.340  -0.182  10.356
  390    HB2  ASN  52           HB2      ASN  52  92.245  -2.800   9.240
  391    HB3  ASN  52           HB1      ASN  52  90.520  -2.580   9.514
  392   HD21  ASN  52          HD21      ASN  52  90.173  -2.567   7.153
  393   HD22  ASN  52          HD22      ASN  52  90.560  -1.184   6.242
  394    H    LYS  53           H        LYS  53  92.863  -2.659  12.248
  395    HA   LYS  53           HA       LYS  53  90.435  -3.377  13.672
  396    HB2  LYS  53           HB2      LYS  53  91.720  -5.257  13.702
  397    HB3  LYS  53           HB3      LYS  53  93.213  -4.355  13.486
  398    HG2  LYS  53           HG2      LYS  53  93.237  -3.750  15.856
  399    HG3  LYS  53           HG3      LYS  53  91.680  -4.546  16.095
  400    HD2  LYS  53           HD2      LYS  53  92.873  -6.659  15.149
  401    HD3  LYS  53           HD3      LYS  53  94.364  -5.787  15.509
  402    HE2  LYS  53           HE2      LYS  53  92.220  -6.705  17.420
  403    HE3  LYS  53           HE3      LYS  53  93.953  -7.026  17.476
  404    HZ1  LYS  53           HZ1      LYS  53  93.513  -5.381  19.086
  405    HZ2  LYS  53           HZ2      LYS  53  92.562  -4.466  18.015
  406    HZ3  LYS  53           HZ3      LYS  53  94.243  -4.573  17.785
  407    H    ASN  54           H        ASN  54  92.801  -0.967  13.790
  408    HA   ASN  54           HA       ASN  54  92.995  -0.513  16.581
  409    HB2  ASN  54           HB2      ASN  54  94.181   1.362  16.006
  410    HB3  ASN  54           HB1      ASN  54  94.314   0.475  14.494
  411   HD21  ASN  54          HD21      ASN  54  91.619   0.949  13.536
  412   HD22  ASN  54          HD22      ASN  54  91.482   2.604  13.189
  413    H    LYS  55           H        LYS  55  90.531   0.020  14.297
  414    HA   LYS  55           HA       LYS  55  88.399   0.881  14.478
  415    HB2  LYS  55           HB2      LYS  55  88.861   1.263  17.430
  416    HB3  LYS  55           HB3      LYS  55  87.356   0.902  16.585
  417    HG2  LYS  55           HG2      LYS  55  88.580  -1.294  15.859
  418    HG3  LYS  55           HG3      LYS  55  89.657  -0.935  17.209
  419    HD2  LYS  55           HD2      LYS  55  87.714  -0.839  18.732
  420    HD3  LYS  55           HD3      LYS  55  86.643  -1.217  17.383
  421    HE2  LYS  55           HE2      LYS  55  88.072  -3.317  17.035
  422    HE3  LYS  55           HE3      LYS  55  88.768  -2.976  18.619
  423    HZ1  LYS  55           HZ1      LYS  55  86.727  -4.500  18.475
  424    HZ2  LYS  55           HZ2      LYS  55  85.844  -3.065  18.252
  425    HZ3  LYS  55           HZ3      LYS  55  86.750  -3.296  19.670
  426    H    GLY  56           H        GLY  56  89.815   2.675  13.395
  427    HA2  GLY  56           HA2      GLY  56  90.223   5.059  14.972
  428    HA3  GLY  56           HA3      GLY  56  90.453   4.904  13.235
  429    H    ILE  57           H        ILE  57  87.988   4.091  12.367
  430    HA   ILE  57           HA       ILE  57  85.986   5.933  13.439
  431    HB   ILE  57           HB       ILE  57  85.590   6.982  11.247
  432   HG12  ILE  57          HG12      ILE  57  87.595   6.687   9.592
  433   HG13  ILE  57          HG13      ILE  57  87.899   5.193  10.474
  434   HG21  ILE  57          HG21      ILE  57  87.201   7.927  12.977
  435   HG22  ILE  57          HG22      ILE  57  87.448   8.490  11.324
  436   HG23  ILE  57          HG23      ILE  57  88.507   7.254  12.002
  437   HD11  ILE  57          HD11      ILE  57  86.223   5.374   8.334
  438   HD12  ILE  57          HD12      ILE  57  85.078   5.609   9.651
  439   HD13  ILE  57          HD13      ILE  57  86.069   4.153   9.592
  440    H    THR  58           H        THR  58  83.988   5.784  11.798
  441    HA   THR  58           HA       THR  58  83.528   2.895  11.352
  442    HB   THR  58           HB       THR  58  81.719   5.115  12.283
  443    HG1  THR  58           HG1      THR  58  81.414   3.719  13.958
  444   HG21  THR  58          HG21      THR  58  81.014   2.611  10.796
  445   HG22  THR  58          HG22      THR  58  80.255   4.199  10.732
  446   HG23  THR  58          HG23      THR  58  79.964   3.137  12.109
  447    H    TRP  59           H        TRP  59  82.731   2.208   9.415
  448    HA   TRP  59           HA       TRP  59  83.107   3.826   7.127
  449    HB2  TRP  59           HB2      TRP  59  81.319   1.401   7.180
  450    HB3  TRP  59           HB1      TRP  59  82.329   2.000   5.861
  451    HD1  TRP  59           HD1      TRP  59  85.029   2.413   7.414
  452    HE1  TRP  59           HE1      TRP  59  86.378   0.366   8.214
  453    HE3  TRP  59           HE3      TRP  59  81.352  -1.121   7.465
  454    HZ2  TRP  59           HZ2      TRP  59  85.940  -2.402   8.832
  455    HZ3  TRP  59           HZ3      TRP  59  81.841  -3.448   8.154
  456    HH2  TRP  59           HH2      TRP  59  84.131  -4.091   8.838
  457    H    LYS  60           H        LYS  60  81.777   5.099   5.998
  458    HA   LYS  60           HA       LYS  60  78.893   5.051   6.412
  459    HB2  LYS  60           HB2      LYS  60  80.580   7.486   7.055
  460    HB3  LYS  60           HB3      LYS  60  78.823   7.491   6.915
  461    HG2  LYS  60           HG2      LYS  60  78.861   5.609   8.684
  462    HG3  LYS  60           HG3      LYS  60  80.531   6.094   8.977
  463    HD2  LYS  60           HD2      LYS  60  78.245   8.077   9.026
  464    HD3  LYS  60           HD3      LYS  60  78.759   7.194  10.463
  465    HE2  LYS  60           HE2      LYS  60  81.061   8.078  10.159
  466    HE3  LYS  60           HE3      LYS  60  80.501   9.009   8.771
  467    HZ1  LYS  60           HZ1      LYS  60  80.506  10.378  10.736
  468    HZ2  LYS  60           HZ2      LYS  60  79.525   9.265  11.563
  469    HZ3  LYS  60           HZ3      LYS  60  78.907  10.122  10.233
  470    H    GLU  61           H        GLU  61  78.335   7.496   5.141
  471    HA   GLU  61           HA       GLU  61  78.899   6.773   2.411
  472    HB2  GLU  61           HB2      GLU  61  76.728   7.701   2.957
  473    HB3  GLU  61           HB3      GLU  61  77.474   9.158   3.614
  474    HG2  GLU  61           HG2      GLU  61  78.211   9.879   1.476
  475    HG3  GLU  61           HG3      GLU  61  77.938   8.291   0.758
  476    H    GLU  62           H        GLU  62  79.525   9.742   4.306
  477    HA   GLU  62           HA       GLU  62  81.305  10.849   2.387
  478    HB2  GLU  62           HB2      GLU  62  80.996  11.443   5.340
  479    HB3  GLU  62           HB3      GLU  62  81.906  12.431   4.196
  480    HG2  GLU  62           HG2      GLU  62  79.848  12.759   2.858
  481    HG3  GLU  62           HG3      GLU  62  78.943  11.802   4.031
  482    H    THR  63           H        THR  63  81.835   9.052   5.408
  483    HA   THR  63           HA       THR  63  84.605   9.209   5.558
  484    HB   THR  63           HB       THR  63  84.508   7.083   6.789
  485    HG1  THR  63           HG1      THR  63  82.523   6.616   5.171
  486   HG21  THR  63          HG21      THR  63  82.298   9.076   7.277
  487   HG22  THR  63          HG22      THR  63  83.868   8.974   8.074
  488   HG23  THR  63          HG23      THR  63  82.636   7.752   8.390
  489    H    LEU  64           H        LEU  64  82.544   7.149   3.589
  490    HA   LEU  64           HA       LEU  64  84.635   5.502   2.574
  491    HB2  LEU  64           HB2      LEU  64  81.773   5.839   2.149
  492    HB3  LEU  64           HB3      LEU  64  82.627   5.532   0.645
  493    HG   LEU  64           HG       LEU  64  82.963   3.845   3.136
  494   HD11  LEU  64          HD11      LEU  64  80.856   3.152   2.607
  495   HD12  LEU  64          HD12      LEU  64  81.673   2.253   1.329
  496   HD13  LEU  64          HD13      LEU  64  80.935   3.813   0.976
  497   HD21  LEU  64          HD21      LEU  64  83.701   2.270   1.073
  498   HD22  LEU  64          HD22      LEU  64  84.840   3.338   1.889
  499   HD23  LEU  64          HD23      LEU  64  84.101   3.837   0.370
  500    H    MET  65           H        MET  65  83.236   8.590   1.609
  501    HA   MET  65           HA       MET  65  84.313   8.724  -0.994
  502    HB2  MET  65           HB2      MET  65  83.681  10.955   0.947
  503    HB3  MET  65           HB1      MET  65  84.035  11.180  -0.766
  504    HG2  MET  65           HG2      MET  65  82.103   9.925  -1.421
  505    HG3  MET  65           HG1      MET  65  81.829   9.370   0.229
  506    HE1  MET  65           HE1      MET  65  80.200  11.452  -2.237
  507    HE2  MET  65           HE2      MET  65  81.837  12.099  -2.303
  508    HE3  MET  65           HE3      MET  65  80.505  13.142  -1.810
  509    H    GLU  66           H        GLU  66  85.566  10.229   2.002
  510    HA   GLU  66           HA       GLU  66  87.991  11.115   0.885
  511    HB2  GLU  66           HB2      GLU  66  87.388  10.307   3.743
  512    HB3  GLU  66           HB3      GLU  66  88.785  11.249   3.221
  513    HG2  GLU  66           HG2      GLU  66  87.094  12.878   2.183
  514    HG3  GLU  66           HG3      GLU  66  85.870  12.032   3.126
  515    H    TYR  67           H        TYR  67  86.955   8.033   2.125
  516    HA   TYR  67           HA       TYR  67  89.593   6.863   2.220
  517    HB2  TYR  67           HB2      TYR  67  87.941   5.971   3.710
  518    HB3  TYR  67           HB3      TYR  67  86.800   5.730   2.394
  519    HD1  TYR  67           HD2      TYR  67  87.059   3.893   0.805
  520    HD2  TYR  67           HD1      TYR  67  89.843   4.464   4.024
  521    HE1  TYR  67           HE2      TYR  67  87.953   1.608   0.438
  522    HE2  TYR  67           HE1      TYR  67  90.738   2.181   3.659
  523    HH   TYR  67           HH       TYR  67  89.482   0.117   1.034
  524    H    LEU  68           H        LEU  68  87.026   7.217  -0.099
  525    HA   LEU  68           HA       LEU  68  87.993   5.196  -1.909
  526    HB2  LEU  68           HB2      LEU  68  85.778   7.173  -1.847
  527    HB3  LEU  68           HB3      LEU  68  86.335   6.686  -3.441
  528    HG   LEU  68           HG       LEU  68  85.538   4.748  -1.250
  529   HD11  LEU  68          HD11      LEU  68  83.515   5.750  -1.848
  530   HD12  LEU  68          HD12      LEU  68  83.587   4.381  -2.951
  531   HD13  LEU  68          HD13      LEU  68  84.004   5.997  -3.522
  532   HD21  LEU  68          HD21      LEU  68  86.809   3.430  -2.634
  533   HD22  LEU  68          HD22      LEU  68  86.593   4.485  -4.027
  534   HD23  LEU  68          HD23      LEU  68  85.310   3.377  -3.553
  535    H    GLU  69           H        GLU  69  88.694   8.523  -1.306
  536    HA   GLU  69           HA       GLU  69  89.929   8.897  -3.939
  537    HB2  GLU  69           HB2      GLU  69  89.851  11.152  -3.530
  538    HB3  GLU  69           HB3      GLU  69  88.562  10.647  -2.443
  539    HG2  GLU  69           HG2      GLU  69  90.398  10.427  -0.649
  540    HG3  GLU  69           HG3      GLU  69  91.415  11.350  -1.754
  541    H    ASN  70           H        ASN  70  90.756   7.777  -0.870
  542    HA   ASN  70           HA       ASN  70  93.492   7.400  -1.557
  543    HB2  ASN  70           HB2      ASN  70  93.196   9.930  -0.857
  544    HB3  ASN  70           HB1      ASN  70  93.214   9.265   0.772
  545   HD21  ASN  70          HD21      ASN  70  95.099   7.162   0.447
  546   HD22  ASN  70          HD22      ASN  70  96.608   7.834   0.059
  547    HA   PRO  71           HA       PRO  71  91.256   4.619   1.551
  548    HB2  PRO  71           HB2      PRO  71  93.005   2.763  -0.013
  549    HB3  PRO  71           HB1      PRO  71  91.338   2.537   0.547
  550    HG2  PRO  71           HG2      PRO  71  91.904   3.107  -2.000
  551    HG3  PRO  71           HG1      PRO  71  90.445   3.718  -1.203
  552    HD2  PRO  71           HD2      PRO  71  92.913   5.184  -1.980
  553    HD3  PRO  71           HD1      PRO  71  91.257   5.793  -1.770
  554    H    LYS  72           H        LYS  72  94.642   4.793   0.509
  555    HA   LYS  72           HA       LYS  72  95.685   3.488   2.836
  556    HB2  LYS  72           HB2      LYS  72  96.824   3.566   0.613
  557    HB3  LYS  72           HB3      LYS  72  97.136   5.278   0.883
  558    HG2  LYS  72           HG2      LYS  72  98.954   4.772   2.116
  559    HG3  LYS  72           HG3      LYS  72  97.946   3.870   3.244
  560    HD2  LYS  72           HD2      LYS  72  98.932   2.689   0.633
  561    HD3  LYS  72           HD3      LYS  72  99.831   2.548   2.144
  562    HE2  LYS  72           HE2      LYS  72  97.013   1.544   1.629
  563    HE3  LYS  72           HE3      LYS  72  98.457   0.555   1.844
  564    HZ1  LYS  72           HZ1      LYS  72  97.080   2.240   3.846
  565    HZ2  LYS  72           HZ2      LYS  72  98.675   1.701   4.072
  566    HZ3  LYS  72           HZ3      LYS  72  97.409   0.579   3.917
  567    H    LYS  73           H        LYS  73  95.587   6.892   1.787
  568    HA   LYS  73           HA       LYS  73  96.943   7.934   4.015
  569    HB2  LYS  73           HB2      LYS  73  96.619   9.189   1.923
  570    HB3  LYS  73           HB3      LYS  73  94.892   9.297   2.264
  571    HG2  LYS  73           HG2      LYS  73  95.322  10.564   4.299
  572    HG3  LYS  73           HG3      LYS  73  97.062  10.372   4.086
  573    HD2  LYS  73           HD2      LYS  73  97.150  11.871   2.309
  574    HD3  LYS  73           HD3      LYS  73  95.466  11.598   1.858
  575    HE2  LYS  73           HE2      LYS  73  94.665  12.912   3.685
  576    HE3  LYS  73           HE3      LYS  73  96.252  12.944   4.451
  577    HZ1  LYS  73           HZ1      LYS  73  96.858  14.673   3.222
  578    HZ2  LYS  73           HZ2      LYS  73  95.236  14.816   2.735
  579    HZ3  LYS  73           HZ3      LYS  73  96.339  13.942   1.782
  580    H    TYR  74           H        TYR  74  93.529   7.187   3.516
  581    HA   TYR  74           HA       TYR  74  92.540   8.621   5.749
  582    HB2  TYR  74           HB2      TYR  74  91.356   7.325   3.703
  583    HB3  TYR  74           HB3      TYR  74  91.163   6.108   4.962
  584    HD1  TYR  74           HD1      TYR  74  90.899   9.845   4.627
  585    HD2  TYR  74           HD2      TYR  74  89.203   6.232   6.223
  586    HE1  TYR  74           HE1      TYR  74  89.025  11.150   5.594
  587    HE2  TYR  74           HE2      TYR  74  87.332   7.540   7.189
  588    HH   TYR  74           HH       TYR  74  86.869   9.845   7.890
  589    H    ILE  75           H        ILE  75  93.165   5.121   5.400
  590    HA   ILE  75           HA       ILE  75  93.741   5.026   8.303
  591    HB   ILE  75           HB       ILE  75  92.347   2.836   6.751
  592   HG12  ILE  75          HG12      ILE  75  91.071   4.697   8.767
  593   HG13  ILE  75          HG13      ILE  75  91.036   5.038   7.036
  594   HG21  ILE  75          HG21      ILE  75  93.556   2.035   8.700
  595   HG22  ILE  75          HG22      ILE  75  91.836   2.052   9.087
  596   HG23  ILE  75          HG23      ILE  75  92.890   3.329   9.695
  597   HD11  ILE  75          HD11      ILE  75  90.108   2.402   8.188
  598   HD12  ILE  75          HD12      ILE  75  89.822   3.036   6.567
  599   HD13  ILE  75          HD13      ILE  75  89.021   3.770   7.955
  600    HA   PRO  76           HA       PRO  76  97.399   3.757   5.598
  601    HB2  PRO  76           HB2      PRO  76  98.494   4.425   8.315
  602    HB3  PRO  76           HB1      PRO  76  99.194   4.740   6.713
  603    HG2  PRO  76           HG2      PRO  76  97.970   6.664   8.095
  604    HG3  PRO  76           HG1      PRO  76  97.843   6.560   6.331
  605    HD2  PRO  76           HD2      PRO  76  95.779   5.993   8.386
  606    HD3  PRO  76           HD1      PRO  76  95.574   6.432   6.677
  607    H    GLY  77           H        GLY  77  98.762   1.890   5.844
  608    HA2  GLY  77           HA2      GLY  77  99.452  -0.136   6.794
  609    HA3  GLY  77           HA3      GLY  77  98.352   0.143   8.141
  610    H    THR  78           H        THR  78  96.129   0.766   6.237
  611    HA   THR  78           HA       THR  78  94.878  -1.724   6.148
  612    HB   THR  78           HB       THR  78  93.684   0.429   5.942
  613    HG1  THR  78           HG1      THR  78  92.280  -0.291   4.285
  614   HG21  THR  78          HG21      THR  78  95.408   1.434   4.408
  615   HG22  THR  78          HG22      THR  78  93.741   1.677   3.887
  616   HG23  THR  78          HG23      THR  78  94.738   0.448   3.110
  617    H    LYS  79           H        LYS  79  94.687  -3.327   4.602
  618    HA   LYS  79           HA       LYS  79  96.802  -3.335   2.580
  619    HB2  LYS  79           HB2      LYS  79  96.032  -5.283   4.220
  620    HB3  LYS  79           HB3      LYS  79  94.913  -5.627   2.904
  621    HG2  LYS  79           HG2      LYS  79  96.750  -6.890   2.241
  622    HG3  LYS  79           HG3      LYS  79  97.080  -5.374   1.403
  623    HD2  LYS  79           HD2      LYS  79  98.577  -4.663   3.202
  624    HD3  LYS  79           HD3      LYS  79  98.191  -6.115   4.127
  625    HE2  LYS  79           HE2      LYS  79 100.316  -6.438   2.970
  626    HE3  LYS  79           HE3      LYS  79  99.099  -7.501   2.266
  627    HZ1  LYS  79           HZ1      LYS  79 100.596  -6.060   0.740
  628    HZ2  LYS  79           HZ2      LYS  79  99.503  -4.820   1.133
  629    HZ3  LYS  79           HZ3      LYS  79  98.949  -6.237   0.376
  630    H    MET  80           H        MET  80  96.060  -1.912   1.009
  631    HA   MET  80           HA       MET  80  94.441  -3.024  -1.022
  632    HB2  MET  80           HB2      MET  80  92.565  -2.470   0.444
  633    HB3  MET  80           HB1      MET  80  93.137  -0.807   0.579
  634    HG2  MET  80           HG2      MET  80  92.760  -0.403  -1.767
  635    HG3  MET  80           HG1      MET  80  92.446  -2.110  -2.068
  636    HE1  MET  80           HE1      MET  80  90.945   1.016  -2.162
  637    HE2  MET  80           HE2      MET  80  89.253   0.531  -2.219
  638    HE3  MET  80           HE3      MET  80  90.427  -0.270  -3.260
  639    H    ILE  81           H        ILE  81  96.099  -2.419  -2.359
  640    HA   ILE  81           HA       ILE  81  96.440   0.490  -2.794
  641    HB   ILE  81           HB       ILE  81  98.504  -1.720  -2.899
  642   HG12  ILE  81          HG12      ILE  81  99.697  -0.027  -1.394
  643   HG13  ILE  81          HG13      ILE  81  98.166   0.838  -1.307
  644   HG21  ILE  81          HG21      ILE  81  98.535   1.074  -4.047
  645   HG22  ILE  81          HG22      ILE  81  98.966  -0.440  -4.842
  646   HG23  ILE  81          HG23      ILE  81 100.024   0.239  -3.605
  647   HD11  ILE  81          HD11      ILE  81  97.825  -2.020  -0.781
  648   HD12  ILE  81          HD12      ILE  81  97.325  -0.634   0.186
  649   HD13  ILE  81          HD13      ILE  81  98.960  -1.270   0.339
  650    H    PHE  82           H        PHE  82  95.257   0.879  -4.577
  651    HA   PHE  82           HA       PHE  82  95.929  -0.627  -7.013
  652    HB2  PHE  82           HB2      PHE  82  93.894  -1.688  -6.221
  653    HB3  PHE  82           HB1      PHE  82  93.114  -0.119  -6.020
  654    HD1  PHE  82           HD2      PHE  82  94.558  -2.456  -8.528
  655    HD2  PHE  82           HD1      PHE  82  92.122   1.021  -7.868
  656    HE1  PHE  82           HE2      PHE  82  93.832  -2.514 -10.899
  657    HE2  PHE  82           HE1      PHE  82  91.397   0.962 -10.239
  658    HZ   PHE  82           HZ       PHE  82  92.252  -0.806 -11.754
  659    H    ALA  83           H        ALA  83  93.415   1.780  -6.289
  660    HA   ALA  83           HA       ALA  83  94.847   4.021  -7.277
  661    HB1  ALA  83           HB1      ALA  83  92.866   2.798  -9.211
  662    HB2  ALA  83           HB2      ALA  83  94.616   2.808  -9.421
  663    HB3  ALA  83           HB3      ALA  83  93.719   4.325  -9.425
  664    H    GLY  84           H        GLY  84  93.929   5.642  -6.209
  665    HA2  GLY  84           HA2      GLY  84  91.323   5.427  -5.038
  666    HA3  GLY  84           HA3      GLY  84  92.371   6.841  -4.997
  667    H    ILE  85           H        ILE  85  89.751   7.318  -5.295
  668    HA   ILE  85           HA       ILE  85  89.006   7.478  -8.094
  669    HB   ILE  85           HB       ILE  85  87.721   8.531  -5.570
  670   HG12  ILE  85          HG12      ILE  85  87.877   5.967  -6.240
  671   HG13  ILE  85          HG13      ILE  85  86.372   6.635  -5.618
  672   HG21  ILE  85          HG21      ILE  85  86.902   8.705  -8.468
  673   HG22  ILE  85          HG22      ILE  85  86.963   9.993  -7.265
  674   HG23  ILE  85          HG23      ILE  85  85.710   8.756  -7.172
  675   HD11  ILE  85          HD11      ILE  85  86.900   6.646  -8.579
  676   HD12  ILE  85          HD12      ILE  85  85.358   6.680  -7.725
  677   HD13  ILE  85          HD13      ILE  85  86.298   5.190  -7.788
  678    H    LYS  86           H        LYS  86  88.457   9.548  -9.125
  679    HA   LYS  86           HA       LYS  86  90.413  11.624  -8.386
  680    HB2  LYS  86           HB2      LYS  86  90.345  10.528 -10.716
  681    HB3  LYS  86           HB3      LYS  86  88.894  11.495 -10.982
  682    HG2  LYS  86           HG2      LYS  86  90.141  13.550 -10.488
  683    HG3  LYS  86           HG3      LYS  86  91.589  12.606 -10.142
  684    HD2  LYS  86           HD2      LYS  86  91.972  13.226 -12.358
  685    HD3  LYS  86           HD3      LYS  86  91.208  11.652 -12.569
  686    HE2  LYS  86           HE2      LYS  86  89.037  12.728 -12.941
  687    HE3  LYS  86           HE3      LYS  86  89.754  14.313 -12.656
  688    HZ1  LYS  86           HZ1      LYS  86  89.534  13.728 -15.033
  689    HZ2  LYS  86           HZ2      LYS  86  90.629  12.451 -14.794
  690    HZ3  LYS  86           HZ3      LYS  86  91.132  14.058 -14.567
  691    H    LYS  87           H        LYS  87  87.181  11.621  -9.942
  692    HA   LYS  87           HA       LYS  87  86.641  14.247  -8.812
  693    HB2  LYS  87           HB2      LYS  87  84.676  12.570 -10.357
  694    HB3  LYS  87           HB3      LYS  87  84.789  14.327 -10.255
  695    HG2  LYS  87           HG2      LYS  87  87.066  14.127 -11.375
  696    HG3  LYS  87           HG3      LYS  87  86.666  12.439 -11.692
  697    HD2  LYS  87           HD2      LYS  87  84.579  13.204 -12.849
  698    HD3  LYS  87           HD3      LYS  87  85.122  14.869 -12.639
  699    HE2  LYS  87           HE2      LYS  87  86.822  12.774 -14.004
  700    HE3  LYS  87           HE3      LYS  87  85.682  13.789 -14.888
  701    HZ1  LYS  87           HZ1      LYS  87  86.817  15.742 -13.983
  702    HZ2  LYS  87           HZ2      LYS  87  87.863  14.778 -14.910
  703    HZ3  LYS  87           HZ3      LYS  87  87.944  14.735 -13.213
  704    H    LYS  88           H        LYS  88  84.585  14.696  -7.707
  705    HA   LYS  88           HA       LYS  88  84.240  12.957  -5.464
  706    HB2  LYS  88           HB2      LYS  88  83.941  15.516  -5.548
  707    HB3  LYS  88           HB3      LYS  88  82.346  15.176  -6.223
  708    HG2  LYS  88           HG2      LYS  88  81.791  13.798  -4.262
  709    HG3  LYS  88           HG3      LYS  88  83.395  14.090  -3.591
  710    HD2  LYS  88           HD2      LYS  88  82.232  15.756  -2.488
  711    HD3  LYS  88           HD3      LYS  88  82.671  16.644  -3.947
  712    HE2  LYS  88           HE2      LYS  88  80.492  16.047  -4.957
  713    HE3  LYS  88           HE3      LYS  88  80.053  15.187  -3.482
  714    HZ1  LYS  88           HZ1      LYS  88  80.672  17.469  -2.402
  715    HZ2  LYS  88           HZ2      LYS  88  79.133  17.215  -3.073
  716    HZ3  LYS  88           HZ3      LYS  88  80.313  18.068  -3.948
  717    H    THR  89           H        THR  89  82.073  13.908  -8.144
  718    HA   THR  89           HA       THR  89  79.888  12.336  -7.513
  719    HB   THR  89           HB       THR  89  79.400  12.292  -9.945
  720    HG1  THR  89           HG1      THR  89  81.249  13.846 -10.882
  721   HG21  THR  89          HG21      THR  89  80.344  14.865  -8.672
  722   HG22  THR  89          HG22      THR  89  78.695  14.249  -8.779
  723   HG23  THR  89          HG23      THR  89  79.515  14.831 -10.228
  724    H    GLU  90           H        GLU  90  82.997  11.372  -8.746
  725    HA   GLU  90           HA       GLU  90  82.233   8.793  -9.693
  726    HB2  GLU  90           HB2      GLU  90  84.847  10.032  -8.857
  727    HB3  GLU  90           HB3      GLU  90  84.746   8.314  -9.233
  728    HG2  GLU  90           HG2      GLU  90  83.902   8.806 -11.459
  729    HG3  GLU  90           HG3      GLU  90  83.840  10.528 -11.091
  730    H    ARG  91           H        ARG  91  83.305  10.104  -6.606
  731    HA   ARG  91           HA       ARG  91  83.359   7.566  -5.250
  732    HB2  ARG  91           HB2      ARG  91  83.163  10.341  -4.050
  733    HB3  ARG  91           HB3      ARG  91  83.705   8.872  -3.242
  734    HG2  ARG  91           HG2      ARG  91  85.577   8.714  -4.884
  735    HG3  ARG  91           HG3      ARG  91  85.075  10.268  -5.551
  736    HD2  ARG  91           HD2      ARG  91  85.211  10.723  -2.795
  737    HD3  ARG  91           HD3      ARG  91  86.611   9.709  -3.134
  738    HE   ARG  91           HE       ARG  91  86.702  11.601  -5.103
  739   HH11  ARG  91          HH21      ARG  91  86.444  11.657  -1.649
  740   HH12  ARG  91          HH22      ARG  91  87.249  13.181  -1.478
  741   HH21  ARG  91          HH11      ARG  91  87.759  13.598  -4.882
  742   HH22  ARG  91          HH12      ARG  91  87.992  14.278  -3.306
  743    H    GLU  92           H        GLU  92  81.161  10.378  -5.233
  744    HA   GLU  92           HA       GLU  92  79.236   9.365  -3.480
  745    HB2  GLU  92           HB2      GLU  92  79.359  11.716  -4.389
  746    HB3  GLU  92           HB3      GLU  92  78.664  11.102  -5.890
  747    HG2  GLU  92           HG2      GLU  92  76.709  10.257  -4.627
  748    HG3  GLU  92           HG3      GLU  92  77.396  10.915  -3.142
  749    H    ASP  93           H        ASP  93  79.257   9.244  -7.056
  750    HA   ASP  93           HA       ASP  93  76.955   7.659  -7.345
  751    HB2  ASP  93           HB2      ASP  93  79.413   7.803  -9.108
  752    HB3  ASP  93           HB1      ASP  93  77.869   7.094  -9.576
  753    H    LEU  94           H        LEU  94  80.387   6.729  -7.194
  754    HA   LEU  94           HA       LEU  94  80.069   3.959  -7.428
  755    HB2  LEU  94           HB2      LEU  94  82.270   4.997  -7.550
  756    HB3  LEU  94           HB3      LEU  94  82.127   5.543  -5.881
  757    HG   LEU  94           HG       LEU  94  82.086   3.248  -5.077
  758   HD11  LEU  94          HD11      LEU  94  81.946   2.662  -8.022
  759   HD12  LEU  94          HD12      LEU  94  80.987   1.985  -6.705
  760   HD13  LEU  94          HD13      LEU  94  82.661   1.479  -6.925
  761   HD21  LEU  94          HD21      LEU  94  84.320   3.545  -7.103
  762   HD22  LEU  94          HD22      LEU  94  84.364   2.646  -5.588
  763   HD23  LEU  94          HD23      LEU  94  84.279   4.406  -5.564
  764    H    ILE  95           H        ILE  95  79.836   6.094  -4.650
  765    HA   ILE  95           HA       ILE  95  79.623   3.973  -2.753
  766    HB   ILE  95           HB       ILE  95  79.279   6.950  -2.638
  767   HG12  ILE  95          HG12      ILE  95  80.995   5.358  -0.790
  768   HG13  ILE  95          HG13      ILE  95  81.460   5.345  -2.485
  769   HG21  ILE  95          HG21      ILE  95  78.345   4.893  -0.657
  770   HG22  ILE  95          HG22      ILE  95  77.617   6.441  -1.082
  771   HG23  ILE  95          HG23      ILE  95  79.048   6.393  -0.053
  772   HD11  ILE  95          HD11      ILE  95  80.791   8.018  -1.409
  773   HD12  ILE  95          HD12      ILE  95  82.117   7.517  -2.454
  774   HD13  ILE  95          HD13      ILE  95  82.227   7.271  -0.716
  775    H    ALA  96           H        ALA  96  77.401   5.835  -4.686
  776    HA   ALA  96           HA       ALA  96  75.017   5.243  -3.287
  777    HB1  ALA  96           HB1      ALA  96  75.240   5.532  -6.285
  778    HB2  ALA  96           HB2      ALA  96  75.349   6.916  -5.196
  779    HB3  ALA  96           HB3      ALA  96  73.874   5.950  -5.249
  780    H    TYR  97           H        TYR  97  76.952   3.494  -5.635
  781    HA   TYR  97           HA       TYR  97  75.031   1.375  -5.995
  782    HB2  TYR  97           HB2      TYR  97  76.529   1.775  -7.822
  783    HB3  TYR  97           HB3      TYR  97  77.940   1.665  -6.770
  784    HD1  TYR  97           HD1      TYR  97  75.110  -0.288  -8.209
  785    HD2  TYR  97           HD2      TYR  97  78.913  -0.442  -6.220
  786    HE1  TYR  97           HE1      TYR  97  75.207  -2.736  -8.586
  787    HE2  TYR  97           HE2      TYR  97  79.010  -2.891  -6.596
  788    HH   TYR  97           HH       TYR  97  76.319  -4.706  -7.579
  789    H    LEU  98           H        LEU  98  78.087   1.796  -4.199
  790    HA   LEU  98           HA       LEU  98  78.301  -0.778  -3.153
  791    HB2  LEU  98           HB2      LEU  98  79.203   1.924  -2.206
  792    HB3  LEU  98           HB3      LEU  98  79.427   0.522  -1.169
  793    HG   LEU  98           HG       LEU  98  80.298   0.368  -4.046
  794   HD11  LEU  98          HD11      LEU  98  81.255   2.470  -2.815
  795   HD12  LEU  98          HD12      LEU  98  82.362   1.395  -3.663
  796   HD13  LEU  98          HD13      LEU  98  82.200   1.288  -1.912
  797   HD21  LEU  98          HD21      LEU  98  81.426  -0.792  -1.487
  798   HD22  LEU  98          HD22      LEU  98  81.871  -1.241  -3.134
  799   HD23  LEU  98          HD23      LEU  98  80.264  -1.624  -2.518
  800    H    LYS  99           H        LYS  99  76.104   1.787  -2.385
  801    HA   LYS  99           HA       LYS  99  75.347   0.764   0.209
  802    HB2  LYS  99           HB2      LYS  99  74.260   2.911  -1.604
  803    HB3  LYS  99           HB3      LYS  99  73.406   2.422  -0.141
  804    HG2  LYS  99           HG2      LYS  99  75.370   2.946   1.221
  805    HG3  LYS  99           HG3      LYS  99  76.289   3.350  -0.227
  806    HD2  LYS  99           HD2      LYS  99  75.522   5.430   0.697
  807    HD3  LYS  99           HD3      LYS  99  74.537   5.112  -0.731
  808    HE2  LYS  99           HE2      LYS  99  72.657   4.510   0.544
  809    HE3  LYS  99           HE3      LYS  99  73.618   4.189   1.987
  810    HZ1  LYS  99           HZ1      LYS  99  74.158   6.780   1.489
  811    HZ2  LYS  99           HZ2      LYS  99  72.991   6.227   2.592
  812    HZ3  LYS  99           HZ3      LYS  99  72.532   6.674   1.018
  813    H    LYS 100           H        LYS 100  73.686   0.990  -2.946
  814    HA   LYS 100           HA       LYS 100  71.542  -0.727  -2.110
  815    HB2  LYS 100           HB2      LYS 100  72.347   0.062  -4.919
  816    HB3  LYS 100           HB3      LYS 100  70.781  -0.566  -4.405
  817    HG2  LYS 100           HG2      LYS 100  70.596   1.428  -2.856
  818    HG3  LYS 100           HG3      LYS 100  72.039   2.079  -3.632
  819    HD2  LYS 100           HD2      LYS 100  70.403   3.078  -4.937
  820    HD3  LYS 100           HD3      LYS 100  70.654   1.593  -5.852
  821    HE2  LYS 100           HE2      LYS 100  68.310   1.708  -5.626
  822    HE3  LYS 100           HE3      LYS 100  68.789   0.600  -4.341
  823    HZ1  LYS 100           HZ1      LYS 100  68.938   3.254  -3.407
  824    HZ2  LYS 100           HZ2      LYS 100  67.963   1.981  -2.844
  825    HZ3  LYS 100           HZ3      LYS 100  67.407   2.995  -4.089
  826    H    ALA 101           H        ALA 101  74.709  -1.244  -3.241
  827    HA   ALA 101           HA       ALA 101  74.185  -3.871  -4.377
  828    HB1  ALA 101           HB1      ALA 101  76.818  -2.491  -3.803
  829    HB2  ALA 101           HB2      ALA 101  75.942  -2.400  -5.331
  830    HB3  ALA 101           HB3      ALA 101  76.590  -3.944  -4.776
  831    H    THR 102           H        THR 102  75.330  -2.434  -1.401
  832    HA   THR 102           HA       THR 102  76.123  -5.028  -0.300
  833    HB   THR 102           HB       THR 102  76.730  -3.670   1.703
  834    HG1  THR 102           HG1      THR 102  76.524  -1.457   1.568
  835   HG21  THR 102          HG21      THR 102  78.462  -2.229   0.398
  836   HG22  THR 102          HG22      THR 102  77.776  -2.992  -1.038
  837   HG23  THR 102          HG23      THR 102  78.520  -3.982   0.218
  838    H    ASN 103           H        ASN 103  73.318  -3.372  -0.751
  839    HA   ASN 103           HA       ASN 103  72.071  -4.177   1.786
  840    HB2  ASN 103           HB2      ASN 103  71.266  -2.373  -0.483
  841    HB3  ASN 103           HB1      ASN 103  70.083  -2.949   0.682
  842   HD21  ASN 103          HD21      ASN 103  73.437  -2.320   1.608
  843   HD22  ASN 103          HD22      ASN 103  73.093  -0.962   2.564
  844    H    GLU 104           H        GLU 104  72.296  -5.034  -1.559
  845    HA   GLU 104           HA       GLU 104  70.259  -7.148  -1.152
  846    HB2  GLU 104           HB2      GLU 104  69.568  -6.937  -3.430
  847    HB3  GLU 104           HB3      GLU 104  69.581  -5.308  -2.755
  848    HG2  GLU 104           HG2      GLU 104  70.720  -4.959  -4.754
  849    HG3  GLU 104           HG3      GLU 104  72.064  -5.275  -3.658
  850    HHA  HEC 201           HA       HEC 105  89.475  -3.524   3.140
  851    HHB  HEC 201           HB       HEC 105  85.600  -0.037  -0.439
  852    HHC  HEC 201           HC       HEC 105  88.862  -1.738  -5.589
  853    HHD  HEC 201           HD       HEC 105  92.281  -5.739  -2.077
  854   HMA1  HEC 201          HMA1      HEC 105  85.818   0.826   2.257
  855   HMA2  HEC 201          HMA2      HEC 105  85.259  -0.489   3.291
  856   HMA3  HEC 201          HMA3      HEC 105  84.666  -0.357   1.637
  857   HAA1  HEC 201          HAA1      HEC 105  87.186  -0.881   4.452
  858   HAA2  HEC 201          HAA2      HEC 105  88.544  -1.985   4.394
  859   HBA1  HEC 201          HBA1      HEC 105  87.244  -3.825   4.804
  860   HBA2  HEC 201          HBA2      HEC 105  85.851  -3.170   3.954
  861   HMB1  HEC 201          HMB1      HEC 105  84.841   1.157  -3.950
  862   HMB2  HEC 201          HMB2      HEC 105  85.140   1.473  -2.245
  863   HMB3  HEC 201          HMB3      HEC 105  84.154   0.093  -2.730
  864    HAB  HEC 201           HAB      HEC 105  87.361  -0.532  -6.225
  865   HBB1  HEC 201          HBB1      HEC 105  86.687   2.004  -4.782
  866   HBB2  HEC 201          HBB2      HEC 105  87.966   1.690  -5.949
  867   HBB3  HEC 201          HBB3      HEC 105  86.302   1.879  -6.496
  868   HMC1  HEC 201          HMC1      HEC 105  89.821  -3.255  -6.945
  869   HMC2  HEC 201          HMC2      HEC 105  91.251  -4.277  -6.992
  870   HMC3  HEC 201          HMC3      HEC 105  91.416  -2.546  -6.713
  871    HAC  HEC 201           HAC      HEC 105  92.742  -6.121  -4.004
  872   HBC1  HEC 201          HBC1      HEC 105  93.343  -5.163  -6.699
  873   HBC2  HEC 201          HBC2      HEC 105  94.432  -5.418  -5.338
  874   HBC3  HEC 201          HBC3      HEC 105  93.554  -3.897  -5.491
  875   HMD1  HEC 201          HMD1      HEC 105  93.528  -6.270  -0.319
  876   HMD2  HEC 201          HMD2      HEC 105  92.415  -7.479   0.321
  877   HMD3  HEC 201          HMD3      HEC 105  93.400  -6.514   1.418
  878   HAD1  HEC 201          HAD1      HEC 105  92.086  -6.260   3.094
  879   HAD2  HEC 201          HAD2      HEC 105  90.540  -5.601   3.587
  880   HBD1  HEC 201          HBD1      HEC 105  91.728  -3.315   3.637
  881   HBD2  HEC 201          HBD2      HEC 105  93.225  -4.239   3.572
  882    H1   HOH 301           H2       HOH 200  81.262   3.398  -0.928
  883    H2   HOH 301           H1       HOH 200  82.591   3.321  -1.655
  884    H1   HOH 302           H2       HOH 201  86.957   5.357   5.559
  885    H2   HOH 302           H1       HOH 201  85.504   5.198   5.953
  886    H1   HOH 303           H2       HOH 202  82.313  -5.634   5.175
  887    H2   HOH 303           H1       HOH 202  82.411  -5.729   6.683
  888    H1   HOH 304           H2       HOH 203  82.389 -11.099   0.554
  889    H2   HOH 304           H1       HOH 203  81.327 -10.110   0.125
  Start of MODEL   19
    1    H1   GLY   1           H1       GLY   1  76.207   9.577  -7.031
    2    H2   GLY   1           H2       GLY   1  75.225   8.243  -6.653
    3    H3   GLY   1           H3       GLY   1  75.486   9.464  -5.500
    4    HA2  GLY   1           HA2      GLY   1  73.421  10.054  -6.242
    5    HA3  GLY   1           HA3      GLY   1  74.456  10.997  -7.314
    6    H    ASP   2           H        ASP   2  75.215   8.096  -8.330
    7    HA   ASP   2           HA       ASP   2  72.827   7.568  -9.962
    8    HB2  ASP   2           HB2      ASP   2  75.570   7.947 -11.173
    9    HB3  ASP   2           HB1      ASP   2  74.066   7.603 -12.026
   10    H    VAL   3           H        VAL   3  72.638   5.659  -8.751
   11    HA   VAL   3           HA       VAL   3  74.549   3.753  -8.203
   12    HB   VAL   3           HB       VAL   3  72.293   3.544  -7.358
   13   HG11  VAL   3          HG11      VAL   3  71.534   3.181 -10.272
   14   HG12  VAL   3          HG12      VAL   3  71.074   4.523  -9.225
   15   HG13  VAL   3          HG13      VAL   3  70.441   2.908  -8.916
   16   HG21  VAL   3          HG21      VAL   3  71.952   1.198  -7.703
   17   HG22  VAL   3          HG22      VAL   3  73.689   1.464  -7.849
   18   HG23  VAL   3          HG23      VAL   3  72.706   1.255  -9.297
   19    H    GLU   4           H        GLU   4  73.356   4.744 -11.263
   20    HA   GLU   4           HA       GLU   4  73.894   2.306 -12.683
   21    HB2  GLU   4           HB2      GLU   4  73.502   5.154 -13.619
   22    HB3  GLU   4           HB3      GLU   4  73.696   3.778 -14.707
   23    HG2  GLU   4           HG2      GLU   4  71.711   2.714 -13.808
   24    HG3  GLU   4           HG3      GLU   4  71.559   3.957 -12.567
   25    H    LYS   5           H        LYS   5  75.547   5.480 -12.705
   26    HA   LYS   5           HA       LYS   5  77.853   4.424 -14.035
   27    HB2  LYS   5           HB2      LYS   5  77.151   7.035 -12.726
   28    HB3  LYS   5           HB3      LYS   5  78.835   6.696 -13.127
   29    HG2  LYS   5           HG2      LYS   5  78.411   6.599 -15.426
   30    HG3  LYS   5           HG3      LYS   5  76.698   6.250 -15.199
   31    HD2  LYS   5           HD2      LYS   5  77.773   8.873 -14.208
   32    HD3  LYS   5           HD3      LYS   5  77.490   8.672 -15.937
   33    HE2  LYS   5           HE2      LYS   5  75.179   8.270 -15.633
   34    HE3  LYS   5           HE3      LYS   5  75.375   7.946 -13.912
   35    HZ1  LYS   5           HZ1      LYS   5  75.789  10.203 -13.474
   36    HZ2  LYS   5           HZ2      LYS   5  74.450  10.187 -14.519
   37    HZ3  LYS   5           HZ3      LYS   5  75.991  10.578 -15.116
   38    H    GLY   6           H        GLY   6  76.760   4.515 -10.791
   39    HA2  GLY   6           HA2      GLY   6  79.310   4.354  -9.493
   40    HA3  GLY   6           HA3      GLY   6  77.752   3.912  -8.788
   41    H    LYS   7           H        LYS   7  76.990   2.101 -10.848
   42    HA   LYS   7           HA       LYS   7  78.185  -0.297  -9.900
   43    HB2  LYS   7           HB2      LYS   7  75.840  -0.036 -10.831
   44    HB3  LYS   7           HB3      LYS   7  76.571   0.039 -12.433
   45    HG2  LYS   7           HG2      LYS   7  77.774  -2.172 -11.706
   46    HG3  LYS   7           HG3      LYS   7  76.496  -2.264 -10.500
   47    HD2  LYS   7           HD2      LYS   7  75.523  -3.430 -12.268
   48    HD3  LYS   7           HD3      LYS   7  74.911  -1.802 -12.556
   49    HE2  LYS   7           HE2      LYS   7  76.618  -1.388 -14.226
   50    HE3  LYS   7           HE3      LYS   7  77.426  -2.907 -13.842
   51    HZ1  LYS   7           HZ1      LYS   7  74.630  -3.166 -14.515
   52    HZ2  LYS   7           HZ2      LYS   7  75.965  -4.081 -15.033
   53    HZ3  LYS   7           HZ3      LYS   7  75.602  -2.601 -15.785
   54    H    LYS   8           H        LYS   8  78.510   1.602 -12.892
   55    HA   LYS   8           HA       LYS   8  80.200  -0.143 -14.294
   56    HB2  LYS   8           HB2      LYS   8  79.176   1.757 -15.385
   57    HB3  LYS   8           HB3      LYS   8  80.041   2.876 -14.334
   58    HG2  LYS   8           HG2      LYS   8  81.785   0.961 -15.763
   59    HG3  LYS   8           HG3      LYS   8  80.924   2.081 -16.817
   60    HD2  LYS   8           HD2      LYS   8  82.350   3.101 -14.365
   61    HD3  LYS   8           HD3      LYS   8  83.243   2.800 -15.853
   62    HE2  LYS   8           HE2      LYS   8  80.715   4.440 -15.895
   63    HE3  LYS   8           HE3      LYS   8  82.261   5.177 -15.474
   64    HZ1  LYS   8           HZ1      LYS   8  81.272   4.522 -18.019
   65    HZ2  LYS   8           HZ2      LYS   8  82.668   3.596 -17.729
   66    HZ3  LYS   8           HZ3      LYS   8  82.731   5.291 -17.617
   67    H    ILE   9           H        ILE   9  81.030   2.570 -12.143
   68    HA   ILE   9           HA       ILE   9  83.836   2.245 -12.326
   69    HB   ILE   9           HB       ILE   9  82.177   3.468 -10.113
   70   HG12  ILE   9          HG12      ILE   9  83.587   4.843 -12.413
   71   HG13  ILE   9          HG13      ILE   9  81.887   4.378 -12.481
   72   HG21  ILE   9          HG21      ILE   9  84.318   4.766  -9.739
   73   HG22  ILE   9          HG22      ILE   9  85.114   3.631 -10.830
   74   HG23  ILE   9          HG23      ILE   9  84.410   3.056  -9.319
   75   HD11  ILE   9          HD11      ILE   9  82.328   6.765 -11.720
   76   HD12  ILE   9          HD12      ILE   9  83.033   6.079 -10.256
   77   HD13  ILE   9          HD13      ILE   9  81.332   5.798 -10.631
   78    H    PHE  10           H        PHE  10  81.404   0.577 -10.520
   79    HA   PHE  10           HA       PHE  10  83.217  -0.437  -8.510
   80    HB2  PHE  10           HB2      PHE  10  81.061  -0.316  -7.669
   81    HB3  PHE  10           HB1      PHE  10  80.329  -0.843  -9.184
   82    HD1  PHE  10           HD1      PHE  10  80.271  -3.213  -9.807
   83    HD2  PHE  10           HD2      PHE  10  81.988  -1.927  -6.089
   84    HE1  PHE  10           HE1      PHE  10  80.265  -5.556  -8.997
   85    HE2  PHE  10           HE2      PHE  10  81.985  -4.271  -5.277
   86    HZ   PHE  10           HZ       PHE  10  81.124  -6.087  -6.735
   87    H    VAL  11           H        VAL  11  81.438  -1.928 -11.235
   88    HA   VAL  11           HA       VAL  11  82.428  -4.507 -10.992
   89    HB   VAL  11           HB       VAL  11  81.961  -4.747 -13.418
   90   HG11  VAL  11          HG11      VAL  11  79.611  -4.431 -13.208
   91   HG12  VAL  11          HG12      VAL  11  79.819  -3.099 -12.074
   92   HG13  VAL  11          HG13      VAL  11  80.189  -4.747 -11.572
   93   HG21  VAL  11          HG21      VAL  11  81.371  -1.780 -13.242
   94   HG22  VAL  11          HG22      VAL  11  81.128  -2.803 -14.657
   95   HG23  VAL  11          HG23      VAL  11  82.760  -2.480 -14.072
   96    H    GLN  12           H        GLN  12  83.942  -1.669 -12.358
   97    HA   GLN  12           HA       GLN  12  86.172  -3.301 -13.356
   98    HB2  GLN  12           HB2      GLN  12  86.943  -1.255 -14.438
   99    HB3  GLN  12           HB1      GLN  12  85.263  -1.595 -14.846
  100    HG2  GLN  12           HG2      GLN  12  84.772  -0.055 -12.741
  101    HG3  GLN  12           HG1      GLN  12  86.388   0.557 -13.086
  102   HE21  GLN  12          HE21      GLN  12  83.796  -0.522 -15.336
  103   HE22  GLN  12          HE22      GLN  12  83.729   0.942 -16.182
  104    H    LYS  13           H        LYS  13  85.435  -1.139 -10.704
  105    HA   LYS  13           HA       LYS  13  88.305  -0.899 -10.106
  106    HB2  LYS  13           HB2      LYS  13  86.695   1.101 -10.147
  107    HB3  LYS  13           HB3      LYS  13  86.132   0.504  -8.584
  108    HG2  LYS  13           HG2      LYS  13  88.336   0.696  -7.634
  109    HG3  LYS  13           HG3      LYS  13  89.054   1.019  -9.209
  110    HD2  LYS  13           HD2      LYS  13  86.876   2.846  -8.271
  111    HD3  LYS  13           HD3      LYS  13  88.468   3.008  -7.529
  112    HE2  LYS  13           HE2      LYS  13  88.132   2.906 -10.528
  113    HE3  LYS  13           HE3      LYS  13  88.007   4.422  -9.636
  114    HZ1  LYS  13           HZ1      LYS  13  90.332   2.595  -9.794
  115    HZ2  LYS  13           HZ2      LYS  13  90.216   3.837  -8.640
  116    HZ3  LYS  13           HZ3      LYS  13  90.243   4.211 -10.298
  117    H    CYS  14           H        CYS  14  85.384  -1.424  -8.049
  118    HA   CYS  14           HA       CYS  14  87.090  -2.661  -6.053
  119    HB2  CYS  14           HB2      CYS  14  84.113  -2.592  -5.828
  120    HB3  CYS  14           HB1      CYS  14  85.328  -2.450  -4.563
  121    H    ALA  15           H        ALA  15  84.611  -3.813  -8.300
  122    HA   ALA  15           HA       ALA  15  84.056  -6.291  -7.258
  123    HB1  ALA  15           HB1      ALA  15  84.361  -5.310 -10.071
  124    HB2  ALA  15           HB2      ALA  15  82.903  -5.818  -9.218
  125    HB3  ALA  15           HB3      ALA  15  84.064  -7.022  -9.775
  126    H    GLN  16           H        GLN  16  87.036  -5.176  -8.651
  127    HA   GLN  16           HA       GLN  16  88.325  -7.483  -9.402
  128    HB2  GLN  16           HB2      GLN  16  89.458  -5.126  -7.891
  129    HB3  GLN  16           HB1      GLN  16  90.424  -6.345  -8.719
  130    HG2  GLN  16           HG2      GLN  16  88.274  -5.173 -10.377
  131    HG3  GLN  16           HG1      GLN  16  89.513  -4.023  -9.887
  132   HE21  GLN  16          HE21      GLN  16  91.839  -4.703 -10.384
  133   HE22  GLN  16          HE22      GLN  16  92.110  -5.661 -11.759
  134    H    CYS  17           H        CYS  17  88.586  -6.068  -6.111
  135    HA   CYS  17           HA       CYS  17  89.005  -8.824  -5.100
  136    HB2  CYS  17           HB2      CYS  17  90.113  -6.591  -3.505
  137    HB3  CYS  17           HB1      CYS  17  90.797  -8.173  -3.858
  138    H    HIS  18           H        HSD  18  86.412  -7.946  -5.231
  139    HA   HIS  18           HA       HSD  18  85.706  -7.918  -2.414
  140    HB2  HIS  18           HB2      HSD  18  85.170  -5.555  -4.195
  141    HB3  HIS  18           HB1      HSD  18  84.078  -5.942  -2.869
  142    HD1  HIS  18           HD1      HSD  18  85.110  -5.888  -0.422
  143    HD2  HIS  18           HD2      HSD  18  87.612  -4.432  -3.416
  144    HE1  HIS  18           HE1      HSD  18  86.968  -4.622   0.750
  145    H    THR  19           H        THR  19  83.111  -7.550  -2.386
  146    HA   THR  19           HA       THR  19  81.884  -9.061  -4.589
  147    HB   THR  19           HB       THR  19  80.917  -9.944  -1.974
  148    HG1  THR  19           HG1      THR  19  83.426 -10.963  -2.580
  149   HG21  THR  19          HG21      THR  19  80.575 -10.959  -4.302
  150   HG22  THR  19          HG22      THR  19  80.998 -12.079  -3.007
  151   HG23  THR  19          HG23      THR  19  82.227 -11.559  -4.160
  152    H    VAL  20           H        VAL  20  81.542  -7.124  -1.679
  153    HA   VAL  20           HA       VAL  20  79.825  -5.837  -0.861
  154    HB   VAL  20           HB       VAL  20  79.103  -4.126  -2.399
  155   HG11  VAL  20          HG11      VAL  20  81.462  -4.118  -1.633
  156   HG12  VAL  20          HG12      VAL  20  81.296  -3.410  -3.236
  157   HG13  VAL  20          HG13      VAL  20  81.918  -5.049  -3.056
  158   HG21  VAL  20          HG21      VAL  20  79.330  -4.297  -4.762
  159   HG22  VAL  20          HG22      VAL  20  78.603  -5.820  -4.266
  160   HG23  VAL  20          HG23      VAL  20  80.322  -5.744  -4.640
  161    H    GLU  21           H        GLU  21  78.954  -8.533  -1.449
  162    HA   GLU  21           HA       GLU  21  76.089  -7.949  -1.817
  163    HB2  GLU  21           HB2      GLU  21  75.860 -10.074  -3.125
  164    HB3  GLU  21           HB3      GLU  21  76.762  -8.814  -3.966
  165    HG2  GLU  21           HG2      GLU  21  78.881  -9.875  -3.091
  166    HG3  GLU  21           HG3      GLU  21  77.893 -11.210  -2.509
  167    H    LYS  22           H        LYS  22  74.969  -8.683  -0.147
  168    HA   LYS  22           HA       LYS  22  76.166 -10.246   1.908
  169    HB2  LYS  22           HB2      LYS  22  74.374  -8.568   2.293
  170    HB3  LYS  22           HB3      LYS  22  73.235  -9.633   1.473
  171    HG2  LYS  22           HG2      LYS  22  74.808 -10.933   3.624
  172    HG3  LYS  22           HG3      LYS  22  73.708  -9.674   4.178
  173    HD2  LYS  22           HD2      LYS  22  72.726 -11.754   2.236
  174    HD3  LYS  22           HD3      LYS  22  72.834 -12.142   3.952
  175    HE2  LYS  22           HE2      LYS  22  71.384 -10.277   4.521
  176    HE3  LYS  22           HE3      LYS  22  71.366  -9.731   2.844
  177    HZ1  LYS  22           HZ1      LYS  22  70.370 -11.898   2.252
  178    HZ2  LYS  22           HZ2      LYS  22  69.384 -10.962   3.271
  179    HZ3  LYS  22           HZ3      LYS  22  70.260 -12.274   3.902
  180    H    GLY  23           H        GLY  23  76.168 -12.375   2.275
  181    HA2  GLY  23           HA2      GLY  23  75.537 -14.605   2.159
  182    HA3  GLY  23           HA3      GLY  23  74.220 -14.152   1.083
  183    H    GLY  24           H        GLY  24  77.372 -12.998   0.293
  184    HA2  GLY  24           HA2      GLY  24  77.460 -14.867  -1.993
  185    HA3  GLY  24           HA3      GLY  24  78.244 -13.295  -1.927
  186    H    LYS  25           H        LYS  25  80.365 -13.656  -2.081
  187    HA   LYS  25           HA       LYS  25  81.672 -15.247  -0.015
  188    HB2  LYS  25           HB2      LYS  25  83.019 -16.499  -1.693
  189    HB3  LYS  25           HB3      LYS  25  81.306 -16.917  -1.744
  190    HG2  LYS  25           HG2      LYS  25  81.128 -15.069  -3.564
  191    HG3  LYS  25           HG3      LYS  25  82.882 -15.208  -3.668
  192    HD2  LYS  25           HD2      LYS  25  82.748 -17.524  -4.282
  193    HD3  LYS  25           HD3      LYS  25  81.025 -17.587  -3.906
  194    HE2  LYS  25           HE2      LYS  25  82.066 -15.661  -5.977
  195    HE3  LYS  25           HE3      LYS  25  81.734 -17.339  -6.399
  196    HZ1  LYS  25           HZ1      LYS  25  79.489 -17.107  -5.778
  197    HZ2  LYS  25           HZ2      LYS  25  79.848 -15.740  -6.719
  198    HZ3  LYS  25           HZ3      LYS  25  79.758 -15.610  -5.028
  199    H    HIS  26           H        HIS  26  83.281 -14.034   0.736
  200    HA   HIS  26           HA       HIS  26  84.216 -11.708  -0.643
  201    HB2  HIS  26           HB2      HIS  26  86.075 -12.219   1.368
  202    HB3  HIS  26           HB1      HIS  26  84.633 -11.219   1.523
  203    HD1  HIS  26           HD1      HIS  26  82.392 -12.593   2.276
  204    HD2  HIS  26           HD2      HIS  26  86.047 -14.471   2.982
  205    HE1  HIS  26           HE1      HIS  26  81.943 -14.421   3.970
  206    HE2  HIS  26           HE2      HIS  26  84.162 -15.574   4.412
  207    H    LYS  27           H        LYS  27  85.753 -11.568  -2.138
  208    HA   LYS  27           HA       LYS  27  87.699 -13.791  -2.387
  209    HB2  LYS  27           HB2      LYS  27  85.987 -12.436  -4.359
  210    HB3  LYS  27           HB3      LYS  27  87.674 -12.558  -4.854
  211    HG2  LYS  27           HG2      LYS  27  87.621 -14.995  -4.366
  212    HG3  LYS  27           HG3      LYS  27  85.913 -14.858  -3.948
  213    HD2  LYS  27           HD2      LYS  27  86.881 -13.857  -6.618
  214    HD3  LYS  27           HD3      LYS  27  86.590 -15.579  -6.382
  215    HE2  LYS  27           HE2      LYS  27  84.285 -15.048  -5.592
  216    HE3  LYS  27           HE3      LYS  27  84.583 -13.348  -5.949
  217    HZ1  LYS  27           HZ1      LYS  27  84.024 -15.535  -7.741
  218    HZ2  LYS  27           HZ2      LYS  27  85.321 -14.556  -8.236
  219    HZ3  LYS  27           HZ3      LYS  27  83.792 -13.869  -7.957
  220    H    THR  28           H        THR  28  89.799 -13.300  -2.313
  221    HA   THR  28           HA       THR  28  91.627 -11.992  -1.716
  222    HB   THR  28           HB       THR  28  90.770 -10.479  -4.187
  223    HG1  THR  28           HG1      THR  28  92.147 -12.237  -5.139
  224   HG21  THR  28          HG21      THR  28  93.382 -10.732  -4.470
  225   HG22  THR  28          HG22      THR  28  93.350 -10.955  -2.723
  226   HG23  THR  28          HG23      THR  28  92.728  -9.466  -3.434
  227    H    GLY  29           H        GLY  29  89.036 -11.075  -0.594
  228    HA2  GLY  29           HA2      GLY  29  89.881  -8.732   0.666
  229    HA3  GLY  29           HA3      GLY  29  88.844  -8.256  -0.675
  230    HA   PRO  30           HA       PRO  30  86.356  -9.834   3.076
  231    HB2  PRO  30           HB2      PRO  30  85.848  -7.535   4.433
  232    HB3  PRO  30           HB1      PRO  30  87.292  -8.522   4.737
  233    HG2  PRO  30           HG2      PRO  30  87.016  -6.022   3.132
  234    HG3  PRO  30           HG1      PRO  30  88.307  -6.511   4.245
  235    HD2  PRO  30           HD2      PRO  30  88.518  -6.728   1.513
  236    HD3  PRO  30           HD1      PRO  30  89.386  -7.784   2.650
  237    H    ASN  31           H        ASN  31  84.064  -9.310   3.539
  238    HA   ASN  31           HA       ASN  31  82.741  -8.283   1.146
  239    HB2  ASN  31           HB2      ASN  31  80.786  -9.354   1.968
  240    HB3  ASN  31           HB1      ASN  31  82.114 -10.455   2.323
  241   HD21  ASN  31          HD21      ASN  31  82.336 -11.102   4.479
  242   HD22  ASN  31          HD22      ASN  31  81.549 -10.362   5.788
  243    H    LEU  32           H        LEU  32  81.813  -6.327   1.019
  244    HA   LEU  32           HA       LEU  32  81.906  -4.543   3.308
  245    HB2  LEU  32           HB2      LEU  32  80.790  -3.961   0.560
  246    HB3  LEU  32           HB3      LEU  32  81.315  -2.799   1.769
  247    HG   LEU  32           HG       LEU  32  82.989  -4.605   0.032
  248   HD11  LEU  32          HD11      LEU  32  82.704  -2.410  -0.857
  249   HD12  LEU  32          HD12      LEU  32  84.295  -2.395  -0.102
  250   HD13  LEU  32          HD13      LEU  32  82.922  -1.657   0.720
  251   HD21  LEU  32          HD21      LEU  32  84.941  -3.846   1.490
  252   HD22  LEU  32          HD22      LEU  32  83.899  -5.077   2.198
  253   HD23  LEU  32          HD23      LEU  32  83.745  -3.394   2.699
  254    H    HIS  33           H        HIS  33  80.113  -6.761   3.560
  255    HA   HIS  33           HA       HIS  33  77.434  -6.196   2.979
  256    HB2  HIS  33           HB2      HIS  33  78.614  -7.666   5.347
  257    HB3  HIS  33           HB1      HIS  33  76.908  -7.686   4.904
  258    HD1  HIS  33           HD1      HIS  33  78.417 -10.331   4.866
  259    HD2  HIS  33           HD2      HIS  33  78.141  -7.845   1.530
  260    HE1  HIS  33           HE1      HIS  33  78.815 -11.800   2.843
  261    HE2  HIS  33           HE2      HIS  33  78.646 -10.301   0.802
  262    H    GLY  34           H        GLY  34  76.260  -4.480   3.540
  263    HA2  GLY  34           HA2      GLY  34  75.554  -2.597   4.682
  264    HA3  GLY  34           HA3      GLY  34  75.597  -3.674   6.077
  265    H    LEU  35           H        LEU  35  78.233  -2.395   4.070
  266    HA   LEU  35           HA       LEU  35  80.073  -1.972   6.089
  267    HB2  LEU  35           HB2      LEU  35  80.523  -1.837   3.638
  268    HB3  LEU  35           HB3      LEU  35  79.722  -0.269   3.612
  269    HG   LEU  35           HG       LEU  35  81.431   0.279   5.561
  270   HD11  LEU  35          HD11      LEU  35  83.054  -1.696   3.963
  271   HD12  LEU  35          HD12      LEU  35  82.249  -2.163   5.458
  272   HD13  LEU  35          HD13      LEU  35  83.483  -0.905   5.477
  273   HD21  LEU  35          HD21      LEU  35  83.162   0.727   3.567
  274   HD22  LEU  35          HD22      LEU  35  81.681   1.659   3.751
  275   HD23  LEU  35          HD23      LEU  35  81.744   0.329   2.596
  276    H    PHE  36           H        PHE  36  77.972   0.499   4.631
  277    HA   PHE  36           HA       PHE  36  78.583   2.656   6.215
  278    HB2  PHE  36           HB2      PHE  36  75.762   2.000   5.355
  279    HB3  PHE  36           HB1      PHE  36  76.487   3.594   5.572
  280    HD1  PHE  36           HD2      PHE  36  76.499   0.537   3.466
  281    HD2  PHE  36           HD1      PHE  36  77.870   4.590   3.868
  282    HE1  PHE  36           HE2      PHE  36  77.286   0.505   1.117
  283    HE2  PHE  36           HE1      PHE  36  78.649   4.558   1.524
  284    HZ   PHE  36           HZ       PHE  36  78.358   2.519   0.141
  285    H    GLY  37           H        GLY  37  78.998   2.124   8.349
  286    HA2  GLY  37           HA2      GLY  37  77.618   2.603  10.440
  287    HA3  GLY  37           HA3      GLY  37  76.711   1.170   9.967
  288    H    ARG  38           H        ARG  38  79.185  -0.130   8.944
  289    HA   ARG  38           HA       ARG  38  79.963  -1.419  11.394
  290    HB2  ARG  38           HB2      ARG  38  80.274  -1.867   8.516
  291    HB3  ARG  38           HB3      ARG  38  81.729  -2.278   9.419
  292    HG2  ARG  38           HG2      ARG  38  80.272  -3.632  10.980
  293    HG3  ARG  38           HG3      ARG  38  78.933  -3.356   9.864
  294    HD2  ARG  38           HD2      ARG  38  81.556  -4.736   9.234
  295    HD3  ARG  38           HD3      ARG  38  79.971  -5.494   9.335
  296    HE   ARG  38           HE       ARG  38  79.791  -3.468   7.418
  297   HH11  ARG  38          HH21      ARG  38  81.492  -6.425   7.990
  298   HH12  ARG  38          HH22      ARG  38  81.693  -6.797   6.310
  299   HH21  ARG  38          HH11      ARG  38  80.054  -3.948   5.210
  300   HH22  ARG  38          HH12      ARG  38  80.879  -5.397   4.740
  301    H    LYS  39           H        LYS  39  81.877  -1.262  12.507
  302    HA   LYS  39           HA       LYS  39  83.375   1.146  12.275
  303    HB2  LYS  39           HB2      LYS  39  83.235  -1.117  14.083
  304    HB3  LYS  39           HB3      LYS  39  84.914  -0.695  13.760
  305    HG2  LYS  39           HG2      LYS  39  82.873   1.418  14.469
  306    HG3  LYS  39           HG3      LYS  39  83.718   0.507  15.719
  307    HD2  LYS  39           HD2      LYS  39  85.895   1.196  14.593
  308    HD3  LYS  39           HD3      LYS  39  84.936   2.303  13.611
  309    HE2  LYS  39           HE2      LYS  39  85.330   2.327  16.603
  310    HE3  LYS  39           HE3      LYS  39  85.666   3.616  15.447
  311    HZ1  LYS  39           HZ1      LYS  39  83.661   4.200  16.472
  312    HZ2  LYS  39           HZ2      LYS  39  83.035   2.624  16.369
  313    HZ3  LYS  39           HZ3      LYS  39  83.201   3.569  14.967
  314    H    THR  40           H        THR  40  85.949   0.856  12.244
  315    HA   THR  40           HA       THR  40  86.527  -0.210   9.609
  316    HB   THR  40           HB       THR  40  88.843   0.728  10.144
  317    HG1  THR  40           HG1      THR  40  87.450   1.990  12.247
  318   HG21  THR  40          HG21      THR  40  87.803   3.160  10.201
  319   HG22  THR  40          HG22      THR  40  86.292   2.287   9.947
  320   HG23  THR  40          HG23      THR  40  87.606   2.137   8.780
  321    H    GLY  41           H        GLY  41  87.654  -1.989   9.120
  322    HA2  GLY  41           HA2      GLY  41  88.643  -4.042   9.355
  323    HA3  GLY  41           HA3      GLY  41  89.606  -3.275  10.605
  324    H    GLN  42           H        GLN  42  86.142  -4.194  10.408
  325    HA   GLN  42           HA       GLN  42  86.579  -5.916  12.773
  326    HB2  GLN  42           HB2      GLN  42  84.196  -5.138  13.446
  327    HB3  GLN  42           HB1      GLN  42  85.557  -4.068  13.780
  328    HG2  GLN  42           HG2      GLN  42  83.683  -2.837  12.754
  329    HG3  GLN  42           HG1      GLN  42  85.106  -2.826  11.714
  330   HE21  GLN  42          HE21      GLN  42  84.819  -3.592   9.613
  331   HE22  GLN  42          HE22      GLN  42  83.453  -4.442   9.075
  332    H    ALA  43           H        ALA  43  85.810  -5.913   9.633
  333    HA   ALA  43           HA       ALA  43  83.397  -7.433   9.581
  334    HB1  ALA  43           HB1      ALA  43  84.841  -8.018   7.244
  335    HB2  ALA  43           HB2      ALA  43  85.300  -6.372   7.676
  336    HB3  ALA  43           HB3      ALA  43  83.603  -6.777   7.438
  337    HA   PRO  44           HA       PRO  44  85.347 -11.294  10.738
  338    HB2  PRO  44           HB2      PRO  44  83.202 -12.929  10.477
  339    HB3  PRO  44           HB1      PRO  44  83.333 -11.748  11.798
  340    HG2  PRO  44           HG2      PRO  44  81.783 -11.577   9.256
  341    HG3  PRO  44           HG1      PRO  44  81.322 -11.082  10.893
  342    HD2  PRO  44           HD2      PRO  44  82.227  -9.324   8.968
  343    HD3  PRO  44           HD1      PRO  44  82.379  -9.040  10.718
  344    H    GLY  45           H        GLY  45  86.807 -11.971   9.213
  345    HA2  GLY  45           HA2      GLY  45  86.370 -14.009   7.457
  346    HA3  GLY  45           HA3      GLY  45  86.031 -12.573   6.499
  347    H    PHE  46           H        PHE  46  87.714 -11.121   6.014
  348    HA   PHE  46           HA       PHE  46  90.280 -12.330   5.696
  349    HB2  PHE  46           HB2      PHE  46  89.334 -10.690   4.096
  350    HB3  PHE  46           HB1      PHE  46  89.476  -9.436   5.327
  351    HD1  PHE  46           HD1      PHE  46  91.479 -11.980   3.456
  352    HD2  PHE  46           HD2      PHE  46  91.501  -8.262   5.607
  353    HE1  PHE  46           HE1      PHE  46  93.847 -11.623   2.815
  354    HE2  PHE  46           HE2      PHE  46  93.870  -7.905   4.966
  355    HZ   PHE  46           HZ       PHE  46  95.043  -9.585   3.569
  356    H    THR  47           H        THR  47  92.288 -11.618   6.553
  357    HA   THR  47           HA       THR  47  92.142 -10.911   9.357
  358    HB   THR  47           HB       THR  47  94.556 -11.390   7.595
  359    HG1  THR  47           HG1      THR  47  94.272 -13.439   8.014
  360   HG21  THR  47          HG21      THR  47  95.613 -11.878   9.842
  361   HG22  THR  47          HG22      THR  47  94.169 -11.193  10.589
  362   HG23  THR  47          HG23      THR  47  95.200 -10.185   9.572
  363    H    TYR  48           H        TYR  48  91.320  -8.771   9.221
  364    HA   TYR  48           HA       TYR  48  92.407  -6.666   7.735
  365    HB2  TYR  48           HB2      TYR  48  90.905  -6.795  10.339
  366    HB3  TYR  48           HB3      TYR  48  91.481  -5.254   9.705
  367    HD1  TYR  48           HD1      TYR  48  90.707  -4.446   7.485
  368    HD2  TYR  48           HD2      TYR  48  89.057  -7.954   9.326
  369    HE1  TYR  48           HE1      TYR  48  88.772  -4.341   5.942
  370    HE2  TYR  48           HE2      TYR  48  87.119  -7.851   7.783
  371    HH   TYR  48           HH       TYR  48  86.243  -5.232   6.119
  372    H    THR  49           H        THR  49  93.821  -4.950   8.334
  373    HA   THR  49           HA       THR  49  96.113  -5.853   9.865
  374    HB   THR  49           HB       THR  49  97.144  -3.752   9.130
  375    HG1  THR  49           HG1      THR  49  95.970  -2.158   8.407
  376   HG21  THR  49          HG21      THR  49  96.807  -5.816   7.592
  377   HG22  THR  49          HG22      THR  49  97.282  -4.292   6.842
  378   HG23  THR  49          HG23      THR  49  95.601  -4.822   6.775
  379    H    ASP  50           H        ASP  50  97.030  -4.663  11.641
  380    HA   ASP  50           HA       ASP  50  95.318  -4.120  13.740
  381    HB2  ASP  50           HB2      ASP  50  97.697  -4.488  14.079
  382    HB3  ASP  50           HB1      ASP  50  98.076  -2.986  13.237
  383    H    ALA  51           H        ALA  51  96.683  -1.840  11.392
  384    HA   ALA  51           HA       ALA  51  95.813   0.556  12.502
  385    HB1  ALA  51           HB1      ALA  51  95.697   1.320  10.055
  386    HB2  ALA  51           HB2      ALA  51  96.188  -0.324   9.646
  387    HB3  ALA  51           HB3      ALA  51  97.245   0.694  10.627
  388    H    ASN  52           H        ASN  52  94.099  -1.475  10.117
  389    HA   ASN  52           HA       ASN  52  91.721   0.117  10.249
  390    HB2  ASN  52           HB2      ASN  52  92.707  -1.677   8.449
  391    HB3  ASN  52           HB1      ASN  52  91.498  -2.666   9.262
  392   HD21  ASN  52          HD21      ASN  52  90.322  -2.561   7.115
  393   HD22  ASN  52          HD22      ASN  52  89.374  -1.193   6.776
  394    H    LYS  53           H        LYS  53  92.963  -2.581  12.022
  395    HA   LYS  53           HA       LYS  53  90.389  -3.315  13.150
  396    HB2  LYS  53           HB2      LYS  53  91.644  -5.230  13.094
  397    HB3  LYS  53           HB3      LYS  53  93.167  -4.360  13.214
  398    HG2  LYS  53           HG2      LYS  53  92.865  -4.039  15.599
  399    HG3  LYS  53           HG3      LYS  53  91.242  -4.726  15.525
  400    HD2  LYS  53           HD2      LYS  53  93.766  -6.233  14.779
  401    HD3  LYS  53           HD3      LYS  53  92.979  -6.342  16.352
  402    HE2  LYS  53           HE2      LYS  53  90.838  -6.874  14.846
  403    HE3  LYS  53           HE3      LYS  53  92.076  -7.403  13.705
  404    HZ1  LYS  53           HZ1      LYS  53  92.955  -8.899  15.310
  405    HZ2  LYS  53           HZ2      LYS  53  91.278  -9.161  15.235
  406    HZ3  LYS  53           HZ3      LYS  53  91.947  -8.292  16.532
  407    H    ASN  54           H        ASN  54  92.702  -0.955  13.601
  408    HA   ASN  54           HA       ASN  54  92.768  -0.682  16.418
  409    HB2  ASN  54           HB2      ASN  54  93.900   1.283  16.014
  410    HB3  ASN  54           HB1      ASN  54  94.166   0.458  14.486
  411   HD21  ASN  54          HD21      ASN  54  91.517   0.870  13.374
  412   HD22  ASN  54          HD22      ASN  54  91.341   2.530  13.071
  413    H    LYS  55           H        LYS  55  90.384  -0.075  14.074
  414    HA   LYS  55           HA       LYS  55  88.269   0.835  14.154
  415    HB2  LYS  55           HB2      LYS  55  88.735   0.189  17.063
  416    HB3  LYS  55           HB3      LYS  55  87.209   0.850  16.476
  417    HG2  LYS  55           HG2      LYS  55  86.934  -1.029  14.945
  418    HG3  LYS  55           HG3      LYS  55  88.510  -1.673  15.403
  419    HD2  LYS  55           HD2      LYS  55  86.578  -1.168  17.622
  420    HD3  LYS  55           HD3      LYS  55  86.210  -2.514  16.545
  421    HE2  LYS  55           HE2      LYS  55  87.574  -3.285  18.439
  422    HE3  LYS  55           HE3      LYS  55  88.476  -3.435  16.931
  423    HZ1  LYS  55           HZ1      LYS  55  88.686  -1.035  18.644
  424    HZ2  LYS  55           HZ2      LYS  55  89.742  -1.553  17.417
  425    HZ3  LYS  55           HZ3      LYS  55  89.668  -2.395  18.892
  426    H    GLY  56           H        GLY  56  89.726   2.809  13.563
  427    HA2  GLY  56           HA2      GLY  56  89.865   4.865  15.601
  428    HA3  GLY  56           HA3      GLY  56  90.361   5.025  13.920
  429    H    ILE  57           H        ILE  57  87.980   4.261  12.646
  430    HA   ILE  57           HA       ILE  57  85.891   6.037  13.677
  431    HB   ILE  57           HB       ILE  57  85.720   7.316  11.631
  432   HG12  ILE  57          HG12      ILE  57  87.690   6.993   9.951
  433   HG13  ILE  57          HG13      ILE  57  87.870   5.409  10.699
  434   HG21  ILE  57          HG21      ILE  57  88.634   7.235  12.446
  435   HG22  ILE  57          HG22      ILE  57  87.372   7.989  13.421
  436   HG23  ILE  57          HG23      ILE  57  87.737   8.616  11.814
  437   HD11  ILE  57          HD11      ILE  57  86.155   6.014   8.610
  438   HD12  ILE  57          HD12      ILE  57  85.081   6.025  10.004
  439   HD13  ILE  57          HD13      ILE  57  86.041   4.592   9.641
  440    H    THR  58           H        THR  58  83.909   5.911  12.219
  441    HA   THR  58           HA       THR  58  83.553   3.094  11.434
  442    HB   THR  58           HB       THR  58  81.594   5.216  12.305
  443    HG1  THR  58           HG1      THR  58  81.629   4.146  14.118
  444   HG21  THR  58          HG21      THR  58  80.422   4.024  10.625
  445   HG22  THR  58          HG22      THR  58  79.953   3.245  12.136
  446   HG23  THR  58          HG23      THR  58  81.155   2.489  11.091
  447    H    TRP  59           H        TRP  59  82.793   2.495   9.469
  448    HA   TRP  59           HA       TRP  59  83.198   4.211   7.248
  449    HB2  TRP  59           HB2      TRP  59  81.667   1.605   7.440
  450    HB3  TRP  59           HB1      TRP  59  82.133   2.400   5.938
  451    HD1  TRP  59           HD1      TRP  59  83.276  -0.196   8.185
  452    HE1  TRP  59           HE1      TRP  59  85.784  -0.691   7.868
  453    HE3  TRP  59           HE3      TRP  59  84.651   3.906   5.470
  454    HZ2  TRP  59           HZ2      TRP  59  88.072   0.494   6.631
  455    HZ3  TRP  59           HZ3      TRP  59  86.998   4.196   4.738
  456    HH2  TRP  59           HH2      TRP  59  88.710   2.498   5.313
  457    H    LYS  60           H        LYS  60  81.768   5.307   5.963
  458    HA   LYS  60           HA       LYS  60  78.911   5.201   6.439
  459    HB2  LYS  60           HB2      LYS  60  80.529   7.674   7.108
  460    HB3  LYS  60           HB3      LYS  60  78.778   7.666   6.905
  461    HG2  LYS  60           HG2      LYS  60  78.725   5.819   8.676
  462    HG3  LYS  60           HG3      LYS  60  80.409   6.224   9.004
  463    HD2  LYS  60           HD2      LYS  60  78.264   8.349   8.999
  464    HD3  LYS  60           HD3      LYS  60  78.604   7.391  10.439
  465    HE2  LYS  60           HE2      LYS  60  81.003   8.068  10.273
  466    HE3  LYS  60           HE3      LYS  60  80.579   9.118   8.922
  467    HZ1  LYS  60           HZ1      LYS  60  80.136  10.654  10.443
  468    HZ2  LYS  60           HZ2      LYS  60  80.229   9.540  11.722
  469    HZ3  LYS  60           HZ3      LYS  60  78.772   9.743  10.872
  470    H    GLU  61           H        GLU  61  78.304   7.669   5.179
  471    HA   GLU  61           HA       GLU  61  78.807   6.936   2.446
  472    HB2  GLU  61           HB2      GLU  61  76.681   8.012   3.355
  473    HB3  GLU  61           HB3      GLU  61  77.587   9.523   3.412
  474    HG2  GLU  61           HG2      GLU  61  78.108   9.275   0.994
  475    HG3  GLU  61           HG3      GLU  61  77.125   7.812   0.952
  476    H    GLU  62           H        GLU  62  79.520   9.893   4.328
  477    HA   GLU  62           HA       GLU  62  81.270  10.970   2.357
  478    HB2  GLU  62           HB2      GLU  62  81.076  11.611   5.311
  479    HB3  GLU  62           HB3      GLU  62  81.869  12.603   4.086
  480    HG2  GLU  62           HG2      GLU  62  79.795  13.032   2.964
  481    HG3  GLU  62           HG3      GLU  62  78.954  11.814   3.920
  482    H    THR  63           H        THR  63  81.870   9.289   5.444
  483    HA   THR  63           HA       THR  63  84.634   9.420   5.521
  484    HB   THR  63           HB       THR  63  84.561   7.311   6.794
  485    HG1  THR  63           HG1      THR  63  82.710   6.137   6.872
  486   HG21  THR  63          HG21      THR  63  82.371   9.321   7.314
  487   HG22  THR  63          HG22      THR  63  83.979   9.260   8.036
  488   HG23  THR  63          HG23      THR  63  82.779   8.036   8.451
  489    H    LEU  64           H        LEU  64  82.538   7.333   3.633
  490    HA   LEU  64           HA       LEU  64  84.598   5.647   2.625
  491    HB2  LEU  64           HB2      LEU  64  81.731   6.052   2.158
  492    HB3  LEU  64           HB3      LEU  64  82.611   5.598   0.707
  493    HG   LEU  64           HG       LEU  64  82.825   4.103   3.333
  494   HD11  LEU  64          HD11      LEU  64  80.710   3.425   2.806
  495   HD12  LEU  64          HD12      LEU  64  81.531   2.407   1.623
  496   HD13  LEU  64          HD13      LEU  64  80.846   3.954   1.132
  497   HD21  LEU  64          HD21      LEU  64  84.703   3.406   2.199
  498   HD22  LEU  64          HD22      LEU  64  84.052   3.851   0.623
  499   HD23  LEU  64          HD23      LEU  64  83.543   2.350   1.396
  500    H    MET  65           H        MET  65  83.161   8.698   1.562
  501    HA   MET  65           HA       MET  65  84.251   8.804  -1.024
  502    HB2  MET  65           HB2      MET  65  83.742  11.093   0.890
  503    HB3  MET  65           HB1      MET  65  84.010  11.252  -0.845
  504    HG2  MET  65           HG2      MET  65  82.012   9.991  -1.339
  505    HG3  MET  65           HG1      MET  65  81.794   9.585   0.360
  506    HE1  MET  65           HE1      MET  65  80.346  13.152  -1.906
  507    HE2  MET  65           HE2      MET  65  80.229  11.422  -2.220
  508    HE3  MET  65           HE3      MET  65  81.786  12.234  -2.369
  509    H    GLU  66           H        GLU  66  85.567  10.302   1.945
  510    HA   GLU  66           HA       GLU  66  87.995  11.132   0.789
  511    HB2  GLU  66           HB2      GLU  66  87.542  10.344   3.677
  512    HB3  GLU  66           HB3      GLU  66  88.788  11.426   3.055
  513    HG2  GLU  66           HG2      GLU  66  86.886  12.866   2.139
  514    HG3  GLU  66           HG3      GLU  66  85.801  11.885   3.124
  515    H    TYR  67           H        TYR  67  86.926   8.076   2.057
  516    HA   TYR  67           HA       TYR  67  89.557   6.894   2.178
  517    HB2  TYR  67           HB2      TYR  67  87.907   6.034   3.680
  518    HB3  TYR  67           HB3      TYR  67  86.761   5.776   2.369
  519    HD1  TYR  67           HD1      TYR  67  89.848   4.548   3.970
  520    HD2  TYR  67           HD2      TYR  67  86.969   3.890   0.849
  521    HE1  TYR  67           HE1      TYR  67  90.742   2.260   3.627
  522    HE2  TYR  67           HE2      TYR  67  87.865   1.605   0.505
  523    HH   TYR  67           HH       TYR  67  89.388   0.119   1.113
  524    H    LEU  68           H        LEU  68  87.027   7.244  -0.180
  525    HA   LEU  68           HA       LEU  68  87.938   5.148  -1.914
  526    HB2  LEU  68           HB2      LEU  68  85.898   7.334  -2.079
  527    HB3  LEU  68           HB3      LEU  68  86.396   6.522  -3.558
  528    HG   LEU  68           HG       LEU  68  85.319   5.143  -1.081
  529   HD11  LEU  68          HD11      LEU  68  83.391   4.639  -2.583
  530   HD12  LEU  68          HD12      LEU  68  84.095   5.712  -3.792
  531   HD13  LEU  68          HD13      LEU  68  83.572   6.358  -2.240
  532   HD21  LEU  68          HD21      LEU  68  85.114   3.375  -3.149
  533   HD22  LEU  68          HD22      LEU  68  86.442   3.392  -1.992
  534   HD23  LEU  68          HD23      LEU  68  86.623   4.184  -3.556
  535    H    GLU  69           H        GLU  69  88.788   8.493  -1.472
  536    HA   GLU  69           HA       GLU  69  90.147   8.574  -4.079
  537    HB2  GLU  69           HB2      GLU  69  90.407  10.913  -3.740
  538    HB3  GLU  69           HB3      GLU  69  88.770  10.519  -3.227
  539    HG2  GLU  69           HG2      GLU  69  89.384  11.721  -1.372
  540    HG3  GLU  69           HG3      GLU  69  90.046  10.166  -0.879
  541    H    ASN  70           H        ASN  70  90.770   7.679  -0.932
  542    HA   ASN  70           HA       ASN  70  93.555   7.285  -1.433
  543    HB2  ASN  70           HB2      ASN  70  94.455   8.731   0.307
  544    HB3  ASN  70           HB1      ASN  70  93.597   9.697  -0.888
  545   HD21  ASN  70          HD21      ASN  70  93.471   8.506   2.451
  546   HD22  ASN  70          HD22      ASN  70  92.195   9.512   2.939
  547    HA   PRO  71           HA       PRO  71  91.167   4.453   1.458
  548    HB2  PRO  71           HB2      PRO  71  93.008   2.601   0.004
  549    HB3  PRO  71           HB1      PRO  71  91.298   2.391   0.427
  550    HG2  PRO  71           HG2      PRO  71  92.058   2.976  -2.061
  551    HG3  PRO  71           HG1      PRO  71  90.563   3.627  -1.365
  552    HD2  PRO  71           HD2      PRO  71  93.151   5.015  -1.895
  553    HD3  PRO  71           HD1      PRO  71  91.497   5.667  -1.890
  554    H    LYS  72           H        LYS  72  94.630   4.354   0.597
  555    HA   LYS  72           HA       LYS  72  95.414   3.210   3.106
  556    HB2  LYS  72           HB2      LYS  72  96.682   2.851   1.025
  557    HB3  LYS  72           HB3      LYS  72  97.089   4.564   0.986
  558    HG2  LYS  72           HG2      LYS  72  98.977   3.651   2.024
  559    HG3  LYS  72           HG3      LYS  72  98.008   4.137   3.411
  560    HD2  LYS  72           HD2      LYS  72  98.586   1.949   3.988
  561    HD3  LYS  72           HD3      LYS  72  97.016   1.706   3.227
  562    HE2  LYS  72           HE2      LYS  72  98.354   0.084   2.189
  563    HE3  LYS  72           HE3      LYS  72  98.388   1.411   1.029
  564    HZ1  LYS  72           HZ1      LYS  72 100.426   1.160   3.154
  565    HZ2  LYS  72           HZ2      LYS  72 100.506   2.050   1.710
  566    HZ3  LYS  72           HZ3      LYS  72 100.593   0.354   1.671
  567    H    LYS  73           H        LYS  73  95.738   6.479   1.697
  568    HA   LYS  73           HA       LYS  73  97.114   7.608   3.857
  569    HB2  LYS  73           HB2      LYS  73  96.447   8.531   1.437
  570    HB3  LYS  73           HB3      LYS  73  95.187   9.330   2.378
  571    HG2  LYS  73           HG2      LYS  73  96.966  10.191   3.924
  572    HG3  LYS  73           HG3      LYS  73  98.177   9.501   2.846
  573    HD2  LYS  73           HD2      LYS  73  98.071  11.661   2.005
  574    HD3  LYS  73           HD3      LYS  73  96.851  10.879   1.002
  575    HE2  LYS  73           HE2      LYS  73  95.724  12.789   1.755
  576    HE3  LYS  73           HE3      LYS  73  95.203  11.572   2.920
  577    HZ1  LYS  73           HZ1      LYS  73  97.452  12.449   4.055
  578    HZ2  LYS  73           HZ2      LYS  73  95.913  13.084   4.397
  579    HZ3  LYS  73           HZ3      LYS  73  96.932  13.869   3.287
  580    H    TYR  74           H        TYR  74  93.776   6.729   3.577
  581    HA   TYR  74           HA       TYR  74  92.806   8.529   5.597
  582    HB2  TYR  74           HB2      TYR  74  91.531   7.131   3.713
  583    HB3  TYR  74           HB3      TYR  74  91.387   5.964   5.024
  584    HD1  TYR  74           HD1      TYR  74  91.094   9.686   4.546
  585    HD2  TYR  74           HD2      TYR  74  89.475   6.138   6.354
  586    HE1  TYR  74           HE1      TYR  74  89.253  11.024   5.526
  587    HE2  TYR  74           HE2      TYR  74  87.636   7.480   7.334
  588    HH   TYR  74           HH       TYR  74  87.671  10.642   7.725
  589    H    ILE  75           H        ILE  75  93.346   4.999   5.574
  590    HA   ILE  75           HA       ILE  75  93.929   5.157   8.475
  591    HB   ILE  75           HB       ILE  75  92.493   2.920   7.018
  592   HG12  ILE  75          HG12      ILE  75  91.403   4.724   9.188
  593   HG13  ILE  75          HG13      ILE  75  91.249   5.135   7.481
  594   HG21  ILE  75          HG21      ILE  75  93.524   3.283   9.828
  595   HG22  ILE  75          HG22      ILE  75  93.660   1.877   8.774
  596   HG23  ILE  75          HG23      ILE  75  92.116   2.267   9.525
  597   HD11  ILE  75          HD11      ILE  75  90.181   2.653   8.858
  598   HD12  ILE  75          HD12      ILE  75  90.169   2.889   7.110
  599   HD13  ILE  75          HD13      ILE  75  89.236   3.963   8.151
  600    HA   PRO  76           HA       PRO  76  97.660   3.765   5.957
  601    HB2  PRO  76           HB2      PRO  76  98.714   4.625   8.634
  602    HB3  PRO  76           HB1      PRO  76  99.415   4.863   7.020
  603    HG2  PRO  76           HG2      PRO  76  98.138   6.832   8.288
  604    HG3  PRO  76           HG1      PRO  76  98.028   6.630   6.531
  605    HD2  PRO  76           HD2      PRO  76  95.963   6.120   8.602
  606    HD3  PRO  76           HD1      PRO  76  95.762   6.479   6.874
  607    H    GLY  77           H        GLY  77  98.253   1.683   5.933
  608    HA2  GLY  77           HA2      GLY  77  99.295  -0.170   7.190
  609    HA3  GLY  77           HA3      GLY  77  98.089   0.111   8.442
  610    H    THR  78           H        THR  78  95.924   0.584   6.529
  611    HA   THR  78           HA       THR  78  94.852  -1.981   6.323
  612    HB   THR  78           HB       THR  78  93.527   0.110   6.181
  613    HG1  THR  78           HG1      THR  78  93.367  -1.742   4.047
  614   HG21  THR  78          HG21      THR  78  94.503   0.267   3.331
  615   HG22  THR  78          HG22      THR  78  95.232   1.204   4.636
  616   HG23  THR  78          HG23      THR  78  93.537   1.449   4.214
  617    H    LYS  79           H        LYS  79  94.690  -3.478   4.648
  618    HA   LYS  79           HA       LYS  79  96.840  -3.290   2.659
  619    HB2  LYS  79           HB2      LYS  79  96.206  -5.351   4.214
  620    HB3  LYS  79           HB3      LYS  79  95.089  -5.704   2.899
  621    HG2  LYS  79           HG2      LYS  79  98.091  -5.341   2.671
  622    HG3  LYS  79           HG3      LYS  79  97.195  -6.845   2.465
  623    HD2  LYS  79           HD2      LYS  79  95.924  -5.662   0.584
  624    HD3  LYS  79           HD3      LYS  79  97.153  -4.401   0.684
  625    HE2  LYS  79           HE2      LYS  79  98.367  -5.671  -0.748
  626    HE3  LYS  79           HE3      LYS  79  98.648  -6.751   0.617
  627    HZ1  LYS  79           HZ1      LYS  79  97.618  -7.675  -1.545
  628    HZ2  LYS  79           HZ2      LYS  79  96.176  -6.991  -0.962
  629    HZ3  LYS  79           HZ3      LYS  79  96.988  -8.174  -0.051
  630    H    MET  80           H        MET  80  95.981  -1.845   1.153
  631    HA   MET  80           HA       MET  80  94.314  -3.001  -0.852
  632    HB2  MET  80           HB2      MET  80  92.504  -2.450   0.668
  633    HB3  MET  80           HB1      MET  80  93.112  -0.804   0.850
  634    HG2  MET  80           HG2      MET  80  92.607  -0.262  -1.420
  635    HG3  MET  80           HG1      MET  80  92.334  -1.953  -1.838
  636    HE1  MET  80           HE1      MET  80  89.054   0.593  -1.671
  637    HE2  MET  80           HE2      MET  80  90.241  -0.046  -2.805
  638    HE3  MET  80           HE3      MET  80  90.733   1.143  -1.602
  639    H    ILE  81           H        ILE  81  95.916  -2.407  -2.270
  640    HA   ILE  81           HA       ILE  81  96.197   0.498  -2.766
  641    HB   ILE  81           HB       ILE  81  98.340  -1.640  -2.864
  642   HG12  ILE  81          HG12      ILE  81  99.471   0.121  -1.367
  643   HG13  ILE  81          HG13      ILE  81  97.884   0.875  -1.237
  644   HG21  ILE  81          HG21      ILE  81  99.779   0.366  -3.577
  645   HG22  ILE  81          HG22      ILE  81  98.260   1.171  -3.974
  646   HG23  ILE  81          HG23      ILE  81  98.714  -0.317  -4.806
  647   HD11  ILE  81          HD11      ILE  81  97.224  -0.640   0.291
  648   HD12  ILE  81          HD12      ILE  81  98.878  -1.244   0.323
  649   HD13  ILE  81          HD13      ILE  81  97.691  -1.985  -0.749
  650    H    PHE  82           H        PHE  82  95.503   1.048  -4.729
  651    HA   PHE  82           HA       PHE  82  96.053  -0.587  -7.045
  652    HB2  PHE  82           HB2      PHE  82  94.072  -1.745  -6.249
  653    HB3  PHE  82           HB1      PHE  82  93.200  -0.221  -6.097
  654    HD1  PHE  82           HD1      PHE  82  95.066  -2.275  -8.615
  655    HD2  PHE  82           HD2      PHE  82  91.919   0.559  -7.900
  656    HE1  PHE  82           HE1      PHE  82  94.381  -2.435 -10.994
  657    HE2  PHE  82           HE2      PHE  82  91.234   0.399 -10.278
  658    HZ   PHE  82           HZ       PHE  82  92.465  -1.099 -11.825
  659    H    ALA  83           H        ALA  83  93.389   1.683  -6.419
  660    HA   ALA  83           HA       ALA  83  94.735   3.955  -7.504
  661    HB1  ALA  83           HB1      ALA  83  92.702   2.603  -9.295
  662    HB2  ALA  83           HB2      ALA  83  94.440   2.664  -9.591
  663    HB3  ALA  83           HB3      ALA  83  93.490   4.150  -9.602
  664    H    GLY  84           H        GLY  84  93.830   5.566  -6.410
  665    HA2  GLY  84           HA2      GLY  84  91.245   5.319  -5.177
  666    HA3  GLY  84           HA3      GLY  84  92.295   6.732  -5.130
  667    H    ILE  85           H        ILE  85  89.670   7.219  -5.391
  668    HA   ILE  85           HA       ILE  85  88.893   7.405  -8.181
  669    HB   ILE  85           HB       ILE  85  87.643   8.421  -5.624
  670   HG12  ILE  85          HG12      ILE  85  87.758   5.880  -6.344
  671   HG13  ILE  85          HG13      ILE  85  86.250   6.552  -5.731
  672   HG21  ILE  85          HG21      ILE  85  86.875   9.941  -7.262
  673   HG22  ILE  85          HG22      ILE  85  85.616   8.707  -7.205
  674   HG23  ILE  85          HG23      ILE  85  86.802   8.693  -8.508
  675   HD11  ILE  85          HD11      ILE  85  86.211   5.147  -7.937
  676   HD12  ILE  85          HD12      ILE  85  86.812   6.628  -8.682
  677   HD13  ILE  85          HD13      ILE  85  85.261   6.629  -7.842
  678    H    LYS  86           H        LYS  86  88.360   9.465  -9.210
  679    HA   LYS  86           HA       LYS  86  90.320  11.541  -8.487
  680    HB2  LYS  86           HB2      LYS  86  88.855  10.937 -11.058
  681    HB3  LYS  86           HB3      LYS  86  89.864  12.364 -10.823
  682    HG2  LYS  86           HG2      LYS  86  91.780  10.889 -10.249
  683    HG3  LYS  86           HG3      LYS  86  90.767   9.480 -10.568
  684    HD2  LYS  86           HD2      LYS  86  90.577  10.008 -12.880
  685    HD3  LYS  86           HD3      LYS  86  91.193  11.643 -12.636
  686    HE2  LYS  86           HE2      LYS  86  93.401  10.778 -12.079
  687    HE3  LYS  86           HE3      LYS  86  92.807   9.119 -12.167
  688    HZ1  LYS  86           HZ1      LYS  86  92.087  10.271 -14.551
  689    HZ2  LYS  86           HZ2      LYS  86  93.355   9.169 -14.301
  690    HZ3  LYS  86           HZ3      LYS  86  93.658  10.841 -14.267
  691    H    LYS  87           H        LYS  87  87.109  11.605 -10.072
  692    HA   LYS  87           HA       LYS  87  86.576  14.215  -8.933
  693    HB2  LYS  87           HB2      LYS  87  84.764  12.425 -10.564
  694    HB3  LYS  87           HB3      LYS  87  84.530  14.142 -10.243
  695    HG2  LYS  87           HG2      LYS  87  86.983  13.042 -11.639
  696    HG3  LYS  87           HG3      LYS  87  85.552  13.599 -12.505
  697    HD2  LYS  87           HD2      LYS  87  85.826  15.792 -11.152
  698    HD3  LYS  87           HD3      LYS  87  87.452  15.207 -10.798
  699    HE2  LYS  87           HE2      LYS  87  87.873  14.974 -13.237
  700    HE3  LYS  87           HE3      LYS  87  86.273  15.643 -13.557
  701    HZ1  LYS  87           HZ1      LYS  87  88.120  17.126 -11.822
  702    HZ2  LYS  87           HZ2      LYS  87  86.884  17.709 -12.832
  703    HZ3  LYS  87           HZ3      LYS  87  88.354  17.181 -13.501
  704    H    LYS  88           H        LYS  88  84.530  14.688  -7.813
  705    HA   LYS  88           HA       LYS  88  84.202  12.985  -5.539
  706    HB2  LYS  88           HB2      LYS  88  83.921  15.512  -5.578
  707    HB3  LYS  88           HB3      LYS  88  82.364  15.235  -6.362
  708    HG2  LYS  88           HG2      LYS  88  81.774  13.701  -4.431
  709    HG3  LYS  88           HG3      LYS  88  83.238  14.266  -3.628
  710    HD2  LYS  88           HD2      LYS  88  81.718  15.780  -2.758
  711    HD3  LYS  88           HD3      LYS  88  82.213  16.660  -4.203
  712    HE2  LYS  88           HE2      LYS  88  80.274  15.677  -5.426
  713    HE3  LYS  88           HE3      LYS  88  79.761  14.894  -3.932
  714    HZ1  LYS  88           HZ1      LYS  88  79.755  17.173  -2.922
  715    HZ2  LYS  88           HZ2      LYS  88  78.558  16.898  -4.096
  716    HZ3  LYS  88           HZ3      LYS  88  79.945  17.799  -4.486
  717    H    THR  89           H        THR  89  82.031  13.890  -8.231
  718    HA   THR  89           HA       THR  89  79.848  12.324  -7.548
  719    HB   THR  89           HB       THR  89  79.349  12.249  -9.990
  720    HG1  THR  89           HG1      THR  89  82.003  12.757 -10.064
  721   HG21  THR  89          HG21      THR  89  79.009  14.620 -10.201
  722   HG22  THR  89          HG22      THR  89  80.340  14.966  -9.096
  723   HG23  THR  89          HG23      THR  89  78.858  14.229  -8.488
  724    H    GLU  90           H        GLU  90  82.947  11.371  -8.799
  725    HA   GLU  90           HA       GLU  90  82.187   8.777  -9.716
  726    HB2  GLU  90           HB2      GLU  90  84.816  10.019  -8.916
  727    HB3  GLU  90           HB3      GLU  90  84.697   8.314  -9.341
  728    HG2  GLU  90           HG2      GLU  90  83.982   8.800 -11.547
  729    HG3  GLU  90           HG3      GLU  90  83.612  10.476 -11.144
  730    H    ARG  91           H        ARG  91  83.223  10.160  -6.661
  731    HA   ARG  91           HA       ARG  91  83.371   7.628  -5.276
  732    HB2  ARG  91           HB2      ARG  91  83.181  10.445  -4.166
  733    HB3  ARG  91           HB3      ARG  91  83.642   9.001  -3.266
  734    HG2  ARG  91           HG2      ARG  91  85.550   8.699  -4.877
  735    HG3  ARG  91           HG3      ARG  91  85.145  10.271  -5.564
  736    HD2  ARG  91           HD2      ARG  91  85.234  10.685  -2.779
  737    HD3  ARG  91           HD3      ARG  91  86.627   9.672  -3.142
  738    HE   ARG  91           HE       ARG  91  86.724  11.614  -5.063
  739   HH11  ARG  91          HH21      ARG  91  86.481  11.576  -1.607
  740   HH12  ARG  91          HH22      ARG  91  87.305  13.085  -1.397
  741   HH21  ARG  91          HH11      ARG  91  87.805  13.591  -4.790
  742   HH22  ARG  91          HH12      ARG  91  88.054  14.225  -3.198
  743    H    GLU  92           H        GLU  92  81.122  10.397  -5.281
  744    HA   GLU  92           HA       GLU  92  79.237   9.359  -3.492
  745    HB2  GLU  92           HB2      GLU  92  79.359  11.715  -4.511
  746    HB3  GLU  92           HB3      GLU  92  78.497  11.034  -5.891
  747    HG2  GLU  92           HG2      GLU  92  76.799  10.142  -4.180
  748    HG3  GLU  92           HG3      GLU  92  77.567  11.228  -3.023
  749    H    ASP  93           H        ASP  93  79.241   9.228  -7.066
  750    HA   ASP  93           HA       ASP  93  76.968   7.613  -7.357
  751    HB2  ASP  93           HB2      ASP  93  79.446   7.810  -9.084
  752    HB3  ASP  93           HB1      ASP  93  77.960   6.993  -9.564
  753    H    LEU  94           H        LEU  94  80.410   6.701  -7.182
  754    HA   LEU  94           HA       LEU  94  80.094   3.925  -7.358
  755    HB2  LEU  94           HB2      LEU  94  82.301   4.970  -7.493
  756    HB3  LEU  94           HB3      LEU  94  82.155   5.527  -5.828
  757    HG   LEU  94           HG       LEU  94  82.101   3.234  -5.010
  758   HD11  LEU  94          HD11      LEU  94  81.964   2.643  -7.950
  759   HD12  LEU  94          HD12      LEU  94  81.016   1.960  -6.629
  760   HD13  LEU  94          HD13      LEU  94  82.691   1.463  -6.859
  761   HD21  LEU  94          HD21      LEU  94  84.371   3.243  -6.984
  762   HD22  LEU  94          HD22      LEU  94  84.371   2.770  -5.286
  763   HD23  LEU  94          HD23      LEU  94  84.309   4.475  -5.724
  764    H    ILE  95           H        ILE  95  79.827   6.129  -4.642
  765    HA   ILE  95           HA       ILE  95  79.619   4.055  -2.688
  766    HB   ILE  95           HB       ILE  95  79.222   7.032  -2.626
  767   HG12  ILE  95          HG12      ILE  95  81.078   5.365  -0.945
  768   HG13  ILE  95          HG13      ILE  95  81.468   5.667  -2.632
  769   HG21  ILE  95          HG21      ILE  95  79.127   6.440  -0.019
  770   HG22  ILE  95          HG22      ILE  95  78.381   4.965  -0.633
  771   HG23  ILE  95          HG23      ILE  95  77.658   6.531  -0.990
  772   HD11  ILE  95          HD11      ILE  95  82.243   7.325  -0.675
  773   HD12  ILE  95          HD12      ILE  95  80.662   8.024  -1.010
  774   HD13  ILE  95          HD13      ILE  95  81.859   7.895  -2.297
  775    H    ALA  96           H        ALA  96  77.418   5.842  -4.699
  776    HA   ALA  96           HA       ALA  96  75.023   5.296  -3.286
  777    HB1  ALA  96           HB1      ALA  96  75.390   5.660  -6.269
  778    HB2  ALA  96           HB2      ALA  96  75.235   6.982  -5.112
  779    HB3  ALA  96           HB3      ALA  96  73.893   5.865  -5.360
  780    H    TYR  97           H        TYR  97  76.945   3.529  -5.630
  781    HA   TYR  97           HA       TYR  97  75.020   1.409  -5.962
  782    HB2  TYR  97           HB2      TYR  97  76.512   1.781  -7.797
  783    HB3  TYR  97           HB3      TYR  97  77.926   1.693  -6.746
  784    HD1  TYR  97           HD1      TYR  97  75.090  -0.298  -8.123
  785    HD2  TYR  97           HD2      TYR  97  78.925  -0.395  -6.193
  786    HE1  TYR  97           HE1      TYR  97  75.198  -2.749  -8.464
  787    HE2  TYR  97           HE2      TYR  97  79.032  -2.848  -6.537
  788    HH   TYR  97           HH       TYR  97  77.447  -4.726  -6.882
  789    H    LEU  98           H        LEU  98  78.061   1.869  -4.157
  790    HA   LEU  98           HA       LEU  98  78.295  -0.689  -3.073
  791    HB2  LEU  98           HB2      LEU  98  79.153   2.041  -2.174
  792    HB3  LEU  98           HB3      LEU  98  79.352   0.679  -1.080
  793    HG   LEU  98           HG       LEU  98  80.324   0.464  -3.926
  794   HD11  LEU  98          HD11      LEU  98  82.143   1.379  -1.715
  795   HD12  LEU  98          HD12      LEU  98  81.247   2.564  -2.661
  796   HD13  LEU  98          HD13      LEU  98  82.379   1.478  -3.457
  797   HD21  LEU  98          HD21      LEU  98  81.231  -0.717  -1.285
  798   HD22  LEU  98          HD22      LEU  98  81.899  -1.112  -2.868
  799   HD23  LEU  98          HD23      LEU  98  80.235  -1.544  -2.480
  800    H    LYS  99           H        LYS  99  76.051   1.853  -2.390
  801    HA   LYS  99           HA       LYS  99  75.266   0.861   0.207
  802    HB2  LYS  99           HB2      LYS  99  74.277   3.012  -1.642
  803    HB3  LYS  99           HB3      LYS  99  73.283   2.496  -0.279
  804    HG2  LYS  99           HG2      LYS  99  75.325   2.873   1.199
  805    HG3  LYS  99           HG3      LYS  99  76.080   3.655  -0.188
  806    HD2  LYS  99           HD2      LYS  99  73.376   4.486   0.892
  807    HD3  LYS  99           HD3      LYS  99  74.887   5.215   1.435
  808    HE2  LYS  99           HE2      LYS  99  75.389   5.691  -1.022
  809    HE3  LYS  99           HE3      LYS  99  73.713   5.248  -1.352
  810    HZ1  LYS  99           HZ1      LYS  99  74.615   7.708  -0.578
  811    HZ2  LYS  99           HZ2      LYS  99  73.934   7.062   0.839
  812    HZ3  LYS  99           HZ3      LYS  99  73.001   7.186  -0.576
  813    H    LYS 100           H        LYS 100  73.688   0.987  -2.995
  814    HA   LYS 100           HA       LYS 100  71.512  -0.690  -2.163
  815    HB2  LYS 100           HB2      LYS 100  72.467   0.288  -4.855
  816    HB3  LYS 100           HB3      LYS 100  71.073  -0.778  -4.672
  817    HG2  LYS 100           HG2      LYS 100  69.945   0.843  -3.261
  818    HG3  LYS 100           HG3      LYS 100  71.372   1.880  -3.246
  819    HD2  LYS 100           HD2      LYS 100  69.728   2.727  -4.862
  820    HD3  LYS 100           HD3      LYS 100  71.175   2.168  -5.700
  821    HE2  LYS 100           HE2      LYS 100  70.117   0.257  -6.532
  822    HE3  LYS 100           HE3      LYS 100  68.885   0.266  -5.270
  823    HZ1  LYS 100           HZ1      LYS 100  67.575   1.367  -6.650
  824    HZ2  LYS 100           HZ2      LYS 100  68.801   1.451  -7.823
  825    HZ3  LYS 100           HZ3      LYS 100  68.664   2.668  -6.645
  826    H    ALA 101           H        ALA 101  74.708  -1.263  -3.237
  827    HA   ALA 101           HA       ALA 101  74.181  -3.949  -4.226
  828    HB1  ALA 101           HB1      ALA 101  76.510  -4.033  -4.748
  829    HB2  ALA 101           HB2      ALA 101  76.865  -2.671  -3.686
  830    HB3  ALA 101           HB3      ALA 101  75.959  -2.415  -5.178
  831    H    THR 102           H        THR 102  75.332  -2.362  -1.327
  832    HA   THR 102           HA       THR 102  76.140  -4.892  -0.103
  833    HB   THR 102           HB       THR 102  76.721  -3.440   1.840
  834    HG1  THR 102           HG1      THR 102  75.128  -1.766   0.528
  835   HG21  THR 102          HG21      THR 102  78.441  -2.036   0.490
  836   HG22  THR 102          HG22      THR 102  77.766  -2.851  -0.922
  837   HG23  THR 102          HG23      THR 102  78.514  -3.793   0.366
  838    H    ASN 103           H        ASN 103  73.350  -3.123  -0.554
  839    HA   ASN 103           HA       ASN 103  72.080  -3.805   1.980
  840    HB2  ASN 103           HB2      ASN 103  71.272  -2.291  -0.486
  841    HB3  ASN 103           HB1      ASN 103  70.055  -2.816   0.669
  842   HD21  ASN 103          HD21      ASN 103  73.281  -2.002   1.796
  843   HD22  ASN 103          HD22      ASN 103  72.844  -0.549   2.556
  844    H    GLU 104           H        GLU 104  72.339  -5.012  -1.266
  845    HA   GLU 104           HA       GLU 104  70.113  -6.504  -1.711
  846    HB2  GLU 104           HB2      GLU 104  73.011  -7.230  -2.139
  847    HB3  GLU 104           HB3      GLU 104  71.687  -8.249  -2.707
  848    HG2  GLU 104           HG2      GLU 104  70.777  -6.367  -4.003
  849    HG3  GLU 104           HG3      GLU 104  72.078  -5.329  -3.422
  850    HHA  HEC 201           HA       HEC 105  89.286  -3.606   3.435
  851    HHB  HEC 201           HB       HEC 105  85.493  -0.062  -0.181
  852    HHC  HEC 201           HC       HEC 105  88.859  -1.697  -5.283
  853    HHD  HEC 201           HD       HEC 105  92.266  -5.679  -1.744
  854   HMA1  HEC 201          HMA1      HEC 105  85.663   0.746   2.563
  855   HMA2  HEC 201          HMA2      HEC 105  85.045  -0.594   3.528
  856   HMA3  HEC 201          HMA3      HEC 105  84.515  -0.393   1.860
  857   HAA1  HEC 201          HAA1      HEC 105  86.878  -1.081   4.757
  858   HAA2  HEC 201          HAA2      HEC 105  88.249  -2.170   4.714
  859   HBA1  HEC 201          HBA1      HEC 105  86.855  -4.091   4.641
  860   HBA2  HEC 201          HBA2      HEC 105  85.428  -3.134   4.260
  861   HMB1  HEC 201          HMB1      HEC 105  84.095   0.097  -2.531
  862   HMB2  HEC 201          HMB2      HEC 105  84.827   1.201  -3.688
  863   HMB3  HEC 201          HMB3      HEC 105  85.061   1.456  -1.961
  864    HAB  HEC 201           HAB      HEC 105  87.374  -0.491  -5.935
  865   HBB1  HEC 201          HBB1      HEC 105  86.330   1.924  -6.208
  866   HBB2  HEC 201          HBB2      HEC 105  86.675   2.037  -4.484
  867   HBB3  HEC 201          HBB3      HEC 105  87.981   1.728  -5.623
  868   HMC1  HEC 201          HMC1      HEC 105  91.320  -4.190  -6.659
  869   HMC2  HEC 201          HMC2      HEC 105  91.389  -2.451  -6.382
  870   HMC3  HEC 201          HMC3      HEC 105  89.836  -3.243  -6.638
  871    HAC  HEC 201           HAC      HEC 105  92.717  -6.078  -3.676
  872   HBC1  HEC 201          HBC1      HEC 105  93.647  -5.491  -6.209
  873   HBC2  HEC 201          HBC2      HEC 105  94.410  -4.969  -4.709
  874   HBC3  HEC 201          HBC3      HEC 105  93.305  -3.889  -5.557
  875   HMD1  HEC 201          HMD1      HEC 105  92.381  -7.434   0.497
  876   HMD2  HEC 201          HMD2      HEC 105  93.230  -6.589   1.791
  877   HMD3  HEC 201          HMD3      HEC 105  93.537  -6.159   0.110
  878   HAD1  HEC 201          HAD1      HEC 105  91.670  -6.448   3.416
  879   HAD2  HEC 201          HAD2      HEC 105  90.440  -5.340   3.978
  880   HBD1  HEC 201          HBD1      HEC 105  92.784  -3.809   3.346
  881   HBD2  HEC 201          HBD2      HEC 105  93.267  -5.175   4.346
  882    H1   HOH 301           H2       HOH 200  82.979   2.768  -0.618
  883    H2   HOH 301           H1       HOH 200  82.111   3.741  -1.395
  884    H1   HOH 302           H2       HOH 201  85.441   5.505   6.531
  885    H2   HOH 302           H1       HOH 201  86.224   6.669   5.954
  886    H1   HOH 303           H2       HOH 202  84.812  -5.852   5.554
  887    H2   HOH 303           H1       HOH 202  83.623  -6.746   5.269
  888    H1   HOH 304           H2       HOH 203  82.002 -11.056  -0.454
  889    H2   HOH 304           H1       HOH 203  82.819  -9.828  -0.114
  Start of MODEL   20
    1    H1   GLY   1           H1       GLY   1  72.767  10.295  -5.766
    2    H2   GLY   1           H2       GLY   1  73.096  11.163  -7.189
    3    H3   GLY   1           H3       GLY   1  74.032  11.423  -5.796
    4    HA2  GLY   1           HA2      GLY   1  75.387  10.094  -7.118
    5    HA3  GLY   1           HA3      GLY   1  74.660   8.979  -5.960
    6    H    ASP   2           H        ASP   2  75.637   8.618  -8.785
    7    HA   ASP   2           HA       ASP   2  73.134   7.723 -10.080
    8    HB2  ASP   2           HB2      ASP   2  75.894   8.187 -11.228
    9    HB3  ASP   2           HB1      ASP   2  74.507   7.591 -12.138
   10    H    VAL   3           H        VAL   3  72.902   5.814  -8.858
   11    HA   VAL   3           HA       VAL   3  74.789   3.873  -8.327
   12    HB   VAL   3           HB       VAL   3  72.562   3.694  -7.426
   13   HG11  VAL   3          HG11      VAL   3  70.664   3.070  -8.981
   14   HG12  VAL   3          HG12      VAL   3  71.730   3.462 -10.330
   15   HG13  VAL   3          HG13      VAL   3  71.264   4.716  -9.180
   16   HG21  VAL   3          HG21      VAL   3  72.237   1.376  -7.684
   17   HG22  VAL   3          HG22      VAL   3  73.933   1.587  -8.111
   18   HG23  VAL   3          HG23      VAL   3  72.723   1.400  -9.379
   19    H    GLU   4           H        GLU   4  73.567   4.882 -11.365
   20    HA   GLU   4           HA       GLU   4  74.013   2.435 -12.797
   21    HB2  GLU   4           HB2      GLU   4  73.835   5.277 -13.826
   22    HB3  GLU   4           HB3      GLU   4  73.731   3.814 -14.807
   23    HG2  GLU   4           HG2      GLU   4  71.853   4.403 -12.506
   24    HG3  GLU   4           HG3      GLU   4  71.496   4.836 -14.177
   25    H    LYS   5           H        LYS   5  75.768   5.551 -12.821
   26    HA   LYS   5           HA       LYS   5  78.034   4.434 -14.168
   27    HB2  LYS   5           HB2      LYS   5  77.623   7.028 -12.662
   28    HB3  LYS   5           HB3      LYS   5  79.127   6.613 -13.483
   29    HG2  LYS   5           HG2      LYS   5  77.867   6.330 -15.607
   30    HG3  LYS   5           HG3      LYS   5  76.392   6.826 -14.777
   31    HD2  LYS   5           HD2      LYS   5  78.803   8.612 -14.630
   32    HD3  LYS   5           HD3      LYS   5  77.838   8.604 -16.105
   33    HE2  LYS   5           HE2      LYS   5  75.911   9.380 -15.001
   34    HE3  LYS   5           HE3      LYS   5  76.513   8.900 -13.414
   35    HZ1  LYS   5           HZ1      LYS   5  76.752  11.226 -13.554
   36    HZ2  LYS   5           HZ2      LYS   5  77.441  11.149 -15.106
   37    HZ3  LYS   5           HZ3      LYS   5  78.312  10.591 -13.757
   38    H    GLY   6           H        GLY   6  76.956   4.568 -10.915
   39    HA2  GLY   6           HA2      GLY   6  79.499   4.298  -9.628
   40    HA3  GLY   6           HA3      GLY   6  77.926   3.928  -8.916
   41    H    LYS   7           H        LYS   7  77.121   2.154 -11.033
   42    HA   LYS   7           HA       LYS   7  78.205  -0.289 -10.046
   43    HB2  LYS   7           HB2      LYS   7  75.870   0.086 -11.008
   44    HB3  LYS   7           HB3      LYS   7  76.630   0.056 -12.600
   45    HG2  LYS   7           HG2      LYS   7  77.692  -2.181 -11.818
   46    HG3  LYS   7           HG3      LYS   7  76.460  -2.156 -10.557
   47    HD2  LYS   7           HD2      LYS   7  75.330  -3.326 -12.214
   48    HD3  LYS   7           HD3      LYS   7  74.835  -1.679 -12.598
   49    HE2  LYS   7           HE2      LYS   7  75.527  -2.543 -14.681
   50    HE3  LYS   7           HE3      LYS   7  76.935  -1.636 -14.130
   51    HZ1  LYS   7           HZ1      LYS   7  78.084  -3.503 -14.322
   52    HZ2  LYS   7           HZ2      LYS   7  76.686  -4.413 -14.639
   53    HZ3  LYS   7           HZ3      LYS   7  77.187  -4.151 -13.037
   54    H    LYS   8           H        LYS   8  78.617   1.593 -13.039
   55    HA   LYS   8           HA       LYS   8  80.267  -0.242 -14.400
   56    HB2  LYS   8           HB2      LYS   8  79.276   1.653 -15.548
   57    HB3  LYS   8           HB3      LYS   8  80.180   2.781 -14.540
   58    HG2  LYS   8           HG2      LYS   8  81.847   0.753 -15.918
   59    HG3  LYS   8           HG3      LYS   8  81.029   1.883 -16.995
   60    HD2  LYS   8           HD2      LYS   8  82.483   2.931 -14.576
   61    HD3  LYS   8           HD3      LYS   8  83.390   2.507 -16.027
   62    HE2  LYS   8           HE2      LYS   8  82.040   4.033 -17.369
   63    HE3  LYS   8           HE3      LYS   8  81.019   4.399 -15.978
   64    HZ1  LYS   8           HZ1      LYS   8  83.391   4.953 -14.960
   65    HZ2  LYS   8           HZ2      LYS   8  82.460   6.106 -15.791
   66    HZ3  LYS   8           HZ3      LYS   8  83.722   5.294 -16.588
   67    H    ILE   9           H        ILE   9  81.088   2.460 -12.239
   68    HA   ILE   9           HA       ILE   9  83.903   2.123 -12.411
   69    HB   ILE   9           HB       ILE   9  82.239   3.382 -10.220
   70   HG12  ILE   9          HG12      ILE   9  83.696   4.783 -12.468
   71   HG13  ILE   9          HG13      ILE   9  82.025   4.250 -12.648
   72   HG21  ILE   9          HG21      ILE   9  84.368   4.646  -9.799
   73   HG22  ILE   9          HG22      ILE   9  85.178   3.573 -10.940
   74   HG23  ILE   9          HG23      ILE   9  84.494   2.923  -9.450
   75   HD11  ILE   9          HD11      ILE   9  83.058   6.100 -10.477
   76   HD12  ILE   9          HD12      ILE   9  81.388   5.561 -10.655
   77   HD13  ILE   9          HD13      ILE   9  82.117   6.594 -11.885
   78    H    PHE  10           H        PHE  10  81.430   0.502 -10.628
   79    HA   PHE  10           HA       PHE  10  83.203  -0.528  -8.588
   80    HB2  PHE  10           HB2      PHE  10  81.029  -0.339  -7.787
   81    HB3  PHE  10           HB1      PHE  10  80.315  -0.905  -9.296
   82    HD1  PHE  10           HD1      PHE  10  80.262  -3.293  -9.853
   83    HD2  PHE  10           HD2      PHE  10  81.892  -1.906  -6.135
   84    HE1  PHE  10           HE1      PHE  10  80.214  -5.609  -8.975
   85    HE2  PHE  10           HE2      PHE  10  81.849  -4.224  -5.253
   86    HZ   PHE  10           HZ       PHE  10  81.008  -6.076  -6.675
   87    H    VAL  11           H        VAL  11  81.426  -1.999 -11.324
   88    HA   VAL  11           HA       VAL  11  82.401  -4.594 -11.050
   89    HB   VAL  11           HB       VAL  11  81.874  -4.867 -13.456
   90   HG11  VAL  11          HG11      VAL  11  79.776  -3.172 -12.101
   91   HG12  VAL  11          HG12      VAL  11  80.134  -4.820 -11.587
   92   HG13  VAL  11          HG13      VAL  11  79.532  -4.513 -13.217
   93   HG21  VAL  11          HG21      VAL  11  82.671  -2.683 -14.241
   94   HG22  VAL  11          HG22      VAL  11  81.419  -1.875 -13.299
   95   HG23  VAL  11          HG23      VAL  11  80.971  -2.891 -14.667
   96    H    GLN  12           H        GLN  12  83.893  -1.771 -12.472
   97    HA   GLN  12           HA       GLN  12  86.083  -3.402 -13.545
   98    HB2  GLN  12           HB2      GLN  12  86.797  -1.431 -14.687
   99    HB3  GLN  12           HB1      GLN  12  85.048  -1.555 -14.876
  100    HG2  GLN  12           HG2      GLN  12  84.826  -0.011 -12.875
  101    HG3  GLN  12           HG1      GLN  12  86.568   0.248 -12.979
  102   HE21  GLN  12          HE21      GLN  12  85.812  -0.254 -16.106
  103   HE22  GLN  12          HE22      GLN  12  85.448   1.327 -16.595
  104    H    LYS  13           H        LYS  13  85.442  -1.231 -10.862
  105    HA   LYS  13           HA       LYS  13  88.325  -1.113 -10.275
  106    HB2  LYS  13           HB2      LYS  13  86.742   0.939 -10.311
  107    HB3  LYS  13           HB3      LYS  13  86.247   0.377  -8.714
  108    HG2  LYS  13           HG2      LYS  13  88.026   1.770  -8.146
  109    HG3  LYS  13           HG3      LYS  13  88.860   0.226  -8.301
  110    HD2  LYS  13           HD2      LYS  13  90.224   1.560  -9.623
  111    HD3  LYS  13           HD3      LYS  13  89.087   0.986 -10.842
  112    HE2  LYS  13           HE2      LYS  13  87.730   3.040 -10.519
  113    HE3  LYS  13           HE3      LYS  13  88.909   3.617  -9.342
  114    HZ1  LYS  13           HZ1      LYS  13  90.371   4.147 -10.938
  115    HZ2  LYS  13           HZ2      LYS  13  89.012   4.157 -11.957
  116    HZ3  LYS  13           HZ3      LYS  13  90.013   2.787 -11.885
  117    H    CYS  14           H        CYS  14  85.395  -1.485  -8.217
  118    HA   CYS  14           HA       CYS  14  87.000  -2.728  -6.168
  119    HB2  CYS  14           HB2      CYS  14  84.016  -2.658  -6.091
  120    HB3  CYS  14           HB1      CYS  14  85.163  -2.505  -4.764
  121    H    ALA  15           H        ALA  15  84.594  -3.959  -8.469
  122    HA   ALA  15           HA       ALA  15  84.069  -6.426  -7.385
  123    HB1  ALA  15           HB1      ALA  15  82.930  -6.047  -9.366
  124    HB2  ALA  15           HB2      ALA  15  84.152  -7.203  -9.900
  125    HB3  ALA  15           HB3      ALA  15  84.373  -5.481 -10.206
  126    H    GLN  16           H        GLN  16  87.061  -5.287  -8.748
  127    HA   GLN  16           HA       GLN  16  88.406  -7.578  -9.430
  128    HB2  GLN  16           HB2      GLN  16  89.358  -5.089  -8.029
  129    HB3  GLN  16           HB1      GLN  16  90.468  -6.378  -8.492
  130    HG2  GLN  16           HG2      GLN  16  89.658  -6.195 -10.836
  131    HG3  GLN  16           HG1      GLN  16  88.625  -4.852 -10.354
  132   HE21  GLN  16          HE21      GLN  16  90.432  -4.186 -12.276
  133   HE22  GLN  16          HE22      GLN  16  91.732  -3.306 -11.628
  134    H    CYS  17           H        CYS  17  88.530  -6.145  -6.137
  135    HA   CYS  17           HA       CYS  17  88.904  -8.893  -5.093
  136    HB2  CYS  17           HB2      CYS  17  90.068  -6.695  -3.497
  137    HB3  CYS  17           HB1      CYS  17  90.721  -8.286  -3.869
  138    H    HIS  18           H        HSD  18  86.348  -8.040  -5.237
  139    HA   HIS  18           HA       HSD  18  85.633  -7.857  -2.427
  140    HB2  HIS  18           HB2      HSD  18  85.137  -5.596  -4.337
  141    HB3  HIS  18           HB1      HSD  18  83.986  -5.918  -3.045
  142    HD1  HIS  18           HD1      HSD  18  84.793  -5.568  -0.598
  143    HD2  HIS  18           HD2      HSD  18  87.653  -4.611  -3.468
  144    HE1  HIS  18           HE1      HSD  18  86.616  -4.288   0.608
  145    H    THR  19           H        THR  19  83.046  -7.513  -2.416
  146    HA   THR  19           HA       THR  19  81.811  -9.108  -4.545
  147    HB   THR  19           HB       THR  19  81.127  -9.851  -1.737
  148    HG1  THR  19           HG1      THR  19  83.111 -11.389  -2.714
  149   HG21  THR  19          HG21      THR  19  80.195 -10.727  -4.046
  150   HG22  THR  19          HG22      THR  19  80.470 -11.848  -2.715
  151   HG23  THR  19          HG23      THR  19  81.652 -11.718  -4.018
  152    H    VAL  20           H        VAL  20  81.460  -7.167  -1.626
  153    HA   VAL  20           HA       VAL  20  79.720  -5.909  -0.803
  154    HB   VAL  20           HB       VAL  20  78.974  -4.193  -2.333
  155   HG11  VAL  20          HG11      VAL  20  81.286  -4.055  -1.526
  156   HG12  VAL  20          HG12      VAL  20  81.186  -3.446  -3.176
  157   HG13  VAL  20          HG13      VAL  20  81.834  -5.054  -2.869
  158   HG21  VAL  20          HG21      VAL  20  78.546  -5.858  -4.232
  159   HG22  VAL  20          HG22      VAL  20  80.272  -5.763  -4.563
  160   HG23  VAL  20          HG23      VAL  20  79.270  -4.322  -4.696
  161    H    GLU  21           H        GLU  21  78.894  -8.612  -1.448
  162    HA   GLU  21           HA       GLU  21  76.027  -8.060  -1.878
  163    HB2  GLU  21           HB2      GLU  21  75.736  -9.836  -3.387
  164    HB3  GLU  21           HB3      GLU  21  77.219  -9.060  -3.940
  165    HG2  GLU  21           HG2      GLU  21  78.464 -10.739  -2.456
  166    HG3  GLU  21           HG3      GLU  21  76.933 -11.608  -2.347
  167    H    LYS  22           H        LYS  22  74.867  -8.761  -0.224
  168    HA   LYS  22           HA       LYS  22  75.893 -10.073   2.003
  169    HB2  LYS  22           HB2      LYS  22  73.726  -8.775   1.834
  170    HB3  LYS  22           HB3      LYS  22  73.009 -10.210   1.107
  171    HG2  LYS  22           HG2      LYS  22  74.498 -10.648   3.652
  172    HG3  LYS  22           HG3      LYS  22  72.995  -9.738   3.782
  173    HD2  LYS  22           HD2      LYS  22  71.832 -11.569   2.531
  174    HD3  LYS  22           HD3      LYS  22  73.332 -12.496   2.569
  175    HE2  LYS  22           HE2      LYS  22  73.296 -12.235   5.096
  176    HE3  LYS  22           HE3      LYS  22  71.659 -11.602   4.926
  177    HZ1  LYS  22           HZ1      LYS  22  71.295 -13.740   3.550
  178    HZ2  LYS  22           HZ2      LYS  22  71.294 -13.835   5.247
  179    HZ3  LYS  22           HZ3      LYS  22  72.668 -14.309   4.367
  180    H    GLY  23           H        GLY  23  76.106 -12.158   2.629
  181    HA2  GLY  23           HA2      GLY  23  76.236 -14.448   2.497
  182    HA3  GLY  23           HA3      GLY  23  74.768 -14.378   1.530
  183    H    GLY  24           H        GLY  24  77.741 -12.758   0.594
  184    HA2  GLY  24           HA2      GLY  24  77.826 -14.397  -1.835
  185    HA3  GLY  24           HA3      GLY  24  78.672 -12.876  -1.574
  186    H    LYS  25           H        LYS  25  80.674 -13.633  -2.173
  187    HA   LYS  25           HA       LYS  25  82.009 -15.362  -0.200
  188    HB2  LYS  25           HB2      LYS  25  82.446 -15.655  -3.177
  189    HB3  LYS  25           HB3      LYS  25  83.089 -16.673  -1.891
  190    HG2  LYS  25           HG2      LYS  25  81.294 -17.985  -2.514
  191    HG3  LYS  25           HG3      LYS  25  80.485 -16.963  -1.330
  192    HD2  LYS  25           HD2      LYS  25  79.034 -16.763  -3.140
  193    HD3  LYS  25           HD3      LYS  25  80.092 -15.381  -3.417
  194    HE2  LYS  25           HE2      LYS  25  79.948 -16.498  -5.517
  195    HE3  LYS  25           HE3      LYS  25  81.520 -16.947  -4.855
  196    HZ1  LYS  25           HZ1      LYS  25  80.839 -19.027  -5.214
  197    HZ2  LYS  25           HZ2      LYS  25  79.207 -18.581  -5.368
  198    HZ3  LYS  25           HZ3      LYS  25  79.882 -18.828  -3.829
  199    H    HIS  26           H        HIS  26  83.372 -13.910   0.682
  200    HA   HIS  26           HA       HIS  26  84.444 -11.640  -0.525
  201    HB2  HIS  26           HB2      HIS  26  86.354 -12.743   1.351
  202    HB3  HIS  26           HB1      HIS  26  85.317 -11.330   1.527
  203    HD1  HIS  26           HD1      HIS  26  84.902 -15.129   1.689
  204    HD2  HIS  26           HD2      HIS  26  83.461 -11.676   3.527
  205    HE1  HIS  26           HE1      HIS  26  83.327 -15.895   3.518
  206    HE2  HIS  26           HE2      HIS  26  82.440 -13.801   4.648
  207    H    LYS  27           H        LYS  27  85.727 -11.461  -2.231
  208    HA   LYS  27           HA       LYS  27  87.574 -13.675  -2.879
  209    HB2  LYS  27           HB2      LYS  27  86.783 -11.426  -4.725
  210    HB3  LYS  27           HB3      LYS  27  87.452 -13.004  -5.142
  211    HG2  LYS  27           HG2      LYS  27  85.342 -14.014  -4.107
  212    HG3  LYS  27           HG3      LYS  27  84.682 -12.378  -4.103
  213    HD2  LYS  27           HD2      LYS  27  84.951 -12.210  -6.515
  214    HD3  LYS  27           HD3      LYS  27  85.759 -13.778  -6.567
  215    HE2  LYS  27           HE2      LYS  27  83.725 -14.887  -5.775
  216    HE3  LYS  27           HE3      LYS  27  82.910 -13.329  -5.630
  217    HZ1  LYS  27           HZ1      LYS  27  82.222 -14.034  -7.687
  218    HZ2  LYS  27           HZ2      LYS  27  83.693 -14.799  -8.052
  219    HZ3  LYS  27           HZ3      LYS  27  83.577 -13.106  -8.108
  220    H    THR  28           H        THR  28  89.654 -13.376  -2.459
  221    HA   THR  28           HA       THR  28  91.580 -12.301  -1.743
  222    HB   THR  28           HB       THR  28  90.890 -10.659  -4.192
  223    HG1  THR  28           HG1      THR  28  92.089 -12.263  -5.256
  224   HG21  THR  28          HG21      THR  28  93.598 -10.955  -4.163
  225   HG22  THR  28          HG22      THR  28  93.270 -10.865  -2.434
  226   HG23  THR  28          HG23      THR  28  92.764  -9.552  -3.498
  227    H    GLY  29           H        GLY  29  89.041 -11.206  -0.635
  228    HA2  GLY  29           HA2      GLY  29  90.060  -9.067   0.831
  229    HA3  GLY  29           HA3      GLY  29  89.170  -8.375  -0.522
  230    HA   PRO  30           HA       PRO  30  86.296  -9.838   2.994
  231    HB2  PRO  30           HB2      PRO  30  85.937  -7.518   4.379
  232    HB3  PRO  30           HB1      PRO  30  87.235  -8.669   4.754
  233    HG2  PRO  30           HG2      PRO  30  87.357  -6.117   3.218
  234    HG3  PRO  30           HG1      PRO  30  88.505  -6.781   4.394
  235    HD2  PRO  30           HD2      PRO  30  88.878  -6.943   1.676
  236    HD3  PRO  30           HD1      PRO  30  89.540  -8.125   2.826
  237    H    ASN  31           H        ASN  31  84.033  -9.109   3.310
  238    HA   ASN  31           HA       ASN  31  82.994  -7.883   0.872
  239    HB2  ASN  31           HB2      ASN  31  82.087  -9.991   2.189
  240    HB3  ASN  31           HB1      ASN  31  81.254  -8.771   3.147
  241   HD21  ASN  31          HD21      ASN  31  80.631 -10.782   0.670
  242   HD22  ASN  31          HD22      ASN  31  79.576  -9.826  -0.253
  243    H    LEU  32           H        LEU  32  81.027  -6.365   1.259
  244    HA   LEU  32           HA       LEU  32  81.695  -4.450   3.416
  245    HB2  LEU  32           HB2      LEU  32  80.587  -3.570   0.759
  246    HB3  LEU  32           HB3      LEU  32  81.408  -2.608   1.983
  247    HG   LEU  32           HG       LEU  32  82.679  -4.732   0.230
  248   HD11  LEU  32          HD11      LEU  32  82.044  -2.155  -0.443
  249   HD12  LEU  32          HD12      LEU  32  83.408  -3.040  -1.121
  250   HD13  LEU  32          HD13      LEU  32  83.658  -1.933   0.227
  251   HD21  LEU  32          HD21      LEU  32  83.532  -3.484   2.749
  252   HD22  LEU  32          HD22      LEU  32  84.692  -3.242   1.449
  253   HD23  LEU  32          HD23      LEU  32  84.208  -4.872   1.902
  254    H    HIS  33           H        HIS  33  79.772  -6.483   3.725
  255    HA   HIS  33           HA       HIS  33  77.135  -5.657   3.096
  256    HB2  HIS  33           HB2      HIS  33  78.067  -7.335   5.441
  257    HB3  HIS  33           HB1      HIS  33  76.424  -7.252   4.809
  258    HD1  HIS  33           HD1      HIS  33  78.269  -9.864   4.860
  259    HD2  HIS  33           HD2      HIS  33  77.564  -7.426   1.553
  260    HE1  HIS  33           HE1      HIS  33  78.703 -11.290   2.814
  261    HE2  HIS  33           HE2      HIS  33  78.279  -9.817   0.791
  262    H    GLY  34           H        GLY  34  75.655  -4.410   4.220
  263    HA2  GLY  34           HA2      GLY  34  75.161  -2.460   5.423
  264    HA3  GLY  34           HA3      GLY  34  75.474  -3.566   6.759
  265    H    LEU  35           H        LEU  35  77.923  -2.585   4.490
  266    HA   LEU  35           HA       LEU  35  79.945  -2.001   6.196
  267    HB2  LEU  35           HB2      LEU  35  80.193  -2.048   3.770
  268    HB3  LEU  35           HB3      LEU  35  79.249  -0.570   3.624
  269    HG   LEU  35           HG       LEU  35  81.099   0.401   5.259
  270   HD11  LEU  35          HD11      LEU  35  82.767  -1.617   3.777
  271   HD12  LEU  35          HD12      LEU  35  82.105  -2.003   5.363
  272   HD13  LEU  35          HD13      LEU  35  83.205  -0.638   5.175
  273   HD21  LEU  35          HD21      LEU  35  81.854  -0.142   2.382
  274   HD22  LEU  35          HD22      LEU  35  82.253   1.272   3.358
  275   HD23  LEU  35          HD23      LEU  35  80.592   1.006   2.828
  276    H    PHE  36           H        PHE  36  77.750   0.465   4.872
  277    HA   PHE  36           HA       PHE  36  78.683   2.619   6.371
  278    HB2  PHE  36           HB2      PHE  36  75.806   2.249   5.528
  279    HB3  PHE  36           HB1      PHE  36  76.690   3.762   5.730
  280    HD1  PHE  36           HD2      PHE  36  76.434   0.678   3.663
  281    HD2  PHE  36           HD1      PHE  36  78.098   4.627   3.987
  282    HE1  PHE  36           HE2      PHE  36  77.199   0.552   1.310
  283    HE2  PHE  36           HE1      PHE  36  78.855   4.501   1.638
  284    HZ   PHE  36           HZ       PHE  36  78.406   2.466   0.295
  285    H    GLY  37           H        GLY  37  79.060   2.007   8.529
  286    HA2  GLY  37           HA2      GLY  37  77.582   2.739  10.547
  287    HA3  GLY  37           HA3      GLY  37  76.705   1.274  10.140
  288    H    ARG  38           H        ARG  38  79.277  -0.104   9.369
  289    HA   ARG  38           HA       ARG  38  79.932  -0.985  12.075
  290    HB2  ARG  38           HB2      ARG  38  80.164  -2.097   9.353
  291    HB3  ARG  38           HB3      ARG  38  81.500  -2.502  10.430
  292    HG2  ARG  38           HG2      ARG  38  79.735  -3.186  12.147
  293    HG3  ARG  38           HG3      ARG  38  78.555  -3.064  10.843
  294    HD2  ARG  38           HD2      ARG  38  81.043  -4.669  10.374
  295    HD3  ARG  38           HD3      ARG  38  79.768  -5.368  11.362
  296    HE   ARG  38           HE       ARG  38  78.348  -4.607   9.246
  297   HH11  ARG  38          HH21      ARG  38  81.467  -6.124   9.431
  298   HH12  ARG  38          HH22      ARG  38  81.297  -6.948   7.918
  299   HH21  ARG  38          HH11      ARG  38  78.131  -5.705   7.277
  300   HH22  ARG  38          HH12      ARG  38  79.417  -6.717   6.707
  301    H    LYS  39           H        LYS  39  81.963  -1.002  12.997
  302    HA   LYS  39           HA       LYS  39  83.658   1.203  12.409
  303    HB2  LYS  39           HB2      LYS  39  83.621  -1.033  14.362
  304    HB3  LYS  39           HB3      LYS  39  85.185  -0.278  14.061
  305    HG2  LYS  39           HG2      LYS  39  82.788   1.467  14.561
  306    HG3  LYS  39           HG3      LYS  39  83.590   0.694  15.927
  307    HD2  LYS  39           HD2      LYS  39  85.755   1.675  15.182
  308    HD3  LYS  39           HD3      LYS  39  84.904   2.507  13.880
  309    HE2  LYS  39           HE2      LYS  39  83.475   3.638  15.580
  310    HE3  LYS  39           HE3      LYS  39  84.425   2.869  16.851
  311    HZ1  LYS  39           HZ1      LYS  39  86.058   4.172  14.898
  312    HZ2  LYS  39           HZ2      LYS  39  86.059   4.330  16.591
  313    HZ3  LYS  39           HZ3      LYS  39  84.984   5.249  15.650
  314    H    THR  40           H        THR  40  86.103   0.869  12.195
  315    HA   THR  40           HA       THR  40  86.615  -0.435   9.725
  316    HB   THR  40           HB       THR  40  89.034   0.160  10.295
  317    HG1  THR  40           HG1      THR  40  87.944   1.776  12.287
  318   HG21  THR  40          HG21      THR  40  87.919   1.665   8.879
  319   HG22  THR  40          HG22      THR  40  88.428   2.688  10.222
  320   HG23  THR  40          HG23      THR  40  86.761   2.123  10.127
  321    H    GLY  41           H        GLY  41  87.809  -2.241   9.235
  322    HA2  GLY  41           HA2      GLY  41  88.363  -4.464   9.501
  323    HA3  GLY  41           HA3      GLY  41  89.378  -3.837  10.797
  324    H    GLN  42           H        GLN  42  85.847  -4.180  10.421
  325    HA   GLN  42           HA       GLN  42  85.797  -5.577  13.030
  326    HB2  GLN  42           HB2      GLN  42  84.554  -3.320  12.642
  327    HB3  GLN  42           HB1      GLN  42  83.390  -4.305  11.754
  328    HG2  GLN  42           HG2      GLN  42  83.440  -5.837  13.869
  329    HG3  GLN  42           HG1      GLN  42  84.130  -4.428  14.672
  330   HE21  GLN  42          HE21      GLN  42  81.218  -5.652  13.049
  331   HE22  GLN  42          HE22      GLN  42  80.190  -4.417  13.596
  332    H    ALA  43           H        ALA  43  85.155  -5.873   9.665
  333    HA   ALA  43           HA       ALA  43  83.166  -7.892   9.761
  334    HB1  ALA  43           HB1      ALA  43  84.472  -8.351   7.403
  335    HB2  ALA  43           HB2      ALA  43  84.915  -6.676   7.734
  336    HB3  ALA  43           HB3      ALA  43  83.217  -7.133   7.631
  337    HA   PRO  44           HA       PRO  44  86.049 -11.107  11.056
  338    HB2  PRO  44           HB2      PRO  44  84.231 -13.044  11.553
  339    HB3  PRO  44           HB1      PRO  44  84.413 -11.637  12.622
  340    HG2  PRO  44           HG2      PRO  44  82.363 -12.162  10.523
  341    HG3  PRO  44           HG1      PRO  44  82.171 -11.446  12.133
  342    HD2  PRO  44           HD2      PRO  44  82.331  -9.975   9.793
  343    HD3  PRO  44           HD1      PRO  44  82.741  -9.340  11.403
  344    H    GLY  45           H        GLY  45  86.990 -11.290   8.913
  345    HA2  GLY  45           HA2      GLY  45  86.434 -13.811   7.650
  346    HA3  GLY  45           HA3      GLY  45  85.949 -12.444   6.651
  347    H    PHE  46           H        PHE  46  87.583 -10.879   6.051
  348    HA   PHE  46           HA       PHE  46  90.038 -12.116   5.273
  349    HB2  PHE  46           HB2      PHE  46  88.785 -10.275   4.031
  350    HB3  PHE  46           HB1      PHE  46  89.444  -9.157   5.225
  351    HD1  PHE  46           HD2      PHE  46  90.400 -11.704   2.673
  352    HD2  PHE  46           HD1      PHE  46  91.678  -8.379   5.075
  353    HE1  PHE  46           HE2      PHE  46  92.537 -11.618   1.418
  354    HE2  PHE  46           HE1      PHE  46  93.814  -8.293   3.820
  355    HZ   PHE  46           HZ       PHE  46  94.244  -9.912   1.991
  356    H    THR  47           H        THR  47  92.177 -11.445   5.849
  357    HA   THR  47           HA       THR  47  92.501 -11.040   8.675
  358    HB   THR  47           HB       THR  47  94.677 -10.904   6.590
  359    HG1  THR  47           HG1      THR  47  94.258 -12.899   6.176
  360   HG21  THR  47          HG21      THR  47  95.301 -10.304   8.887
  361   HG22  THR  47          HG22      THR  47  96.020 -11.851   8.441
  362   HG23  THR  47          HG23      THR  47  94.596 -11.808   9.482
  363    H    TYR  48           H        TYR  48  91.415  -8.966   8.860
  364    HA   TYR  48           HA       TYR  48  92.231  -6.617   7.556
  365    HB2  TYR  48           HB2      TYR  48  90.815  -7.208  10.130
  366    HB3  TYR  48           HB3      TYR  48  91.323  -5.556   9.790
  367    HD1  TYR  48           HD2      TYR  48  90.644  -4.512   7.561
  368    HD2  TYR  48           HD1      TYR  48  88.876  -8.104   9.113
  369    HE1  TYR  48           HE2      TYR  48  88.700  -4.203   6.057
  370    HE2  TYR  48           HE1      TYR  48  86.931  -7.798   7.605
  371    HH   TYR  48           HH       TYR  48  86.386  -4.870   5.904
  372    H    THR  49           H        THR  49  93.561  -4.905   8.235
  373    HA   THR  49           HA       THR  49  95.944  -5.789   9.666
  374    HB   THR  49           HB       THR  49  96.936  -3.714   8.875
  375    HG1  THR  49           HG1      THR  49  94.939  -2.507   9.153
  376   HG21  THR  49          HG21      THR  49  95.261  -5.214   6.853
  377   HG22  THR  49          HG22      THR  49  96.963  -5.459   7.243
  378   HG23  THR  49          HG23      THR  49  96.455  -4.004   6.388
  379    H    ASP  50           H        ASP  50  96.822  -4.698  11.470
  380    HA   ASP  50           HA       ASP  50  95.146  -4.131  13.571
  381    HB2  ASP  50           HB2      ASP  50  97.783  -2.716  13.222
  382    HB3  ASP  50           HB1      ASP  50  97.021  -3.255  14.717
  383    H    ALA  51           H        ALA  51  96.472  -1.862  11.196
  384    HA   ALA  51           HA       ALA  51  95.627   0.543  12.299
  385    HB1  ALA  51           HB1      ALA  51  95.469   1.286   9.844
  386    HB2  ALA  51           HB2      ALA  51  95.966  -0.360   9.447
  387    HB3  ALA  51           HB3      ALA  51  97.024   0.673  10.408
  388    H    ASN  52           H        ASN  52  93.824  -1.701  10.212
  389    HA   ASN  52           HA       ASN  52  91.454  -0.038  10.253
  390    HB2  ASN  52           HB2      ASN  52  92.426  -2.188   8.681
  391    HB3  ASN  52           HB1      ASN  52  90.939  -2.761   9.428
  392   HD21  ASN  52          HD21      ASN  52  90.052  -2.679   7.151
  393   HD22  ASN  52          HD22      ASN  52  89.495  -1.191   6.549
  394    H    LYS  53           H        LYS  53  92.767  -2.670  12.082
  395    HA   LYS  53           HA       LYS  53  90.246  -3.304  13.386
  396    HB2  LYS  53           HB2      LYS  53  91.414  -5.261  13.377
  397    HB3  LYS  53           HB3      LYS  53  92.966  -4.447  13.249
  398    HG2  LYS  53           HG2      LYS  53  92.941  -3.944  15.645
  399    HG3  LYS  53           HG3      LYS  53  91.332  -4.655  15.796
  400    HD2  LYS  53           HD2      LYS  53  92.414  -6.796  14.809
  401    HD3  LYS  53           HD3      LYS  53  93.951  -6.034  15.219
  402    HE2  LYS  53           HE2      LYS  53  91.685  -6.678  17.124
  403    HE3  LYS  53           HE3      LYS  53  93.274  -7.440  17.078
  404    HZ1  LYS  53           HZ1      LYS  53  93.877  -5.894  18.537
  405    HZ2  LYS  53           HZ2      LYS  53  92.472  -4.972  18.283
  406    HZ3  LYS  53           HZ3      LYS  53  93.817  -4.777  17.262
  407    H    ASN  54           H        ASN  54  92.640  -0.985  13.624
  408    HA   ASN  54           HA       ASN  54  92.871  -0.637  16.427
  409    HB2  ASN  54           HB2      ASN  54  94.019   1.295  15.914
  410    HB3  ASN  54           HB1      ASN  54  94.203   0.411  14.406
  411   HD21  ASN  54          HD21      ASN  54  91.509   0.845  13.401
  412   HD22  ASN  54          HD22      ASN  54  91.360   2.497  13.042
  413    H    LYS  55           H        LYS  55  90.385  -0.031  14.194
  414    HA   LYS  55           HA       LYS  55  88.290   0.913  14.375
  415    HB2  LYS  55           HB2      LYS  55  88.931   0.471  17.294
  416    HB3  LYS  55           HB3      LYS  55  87.373   1.076  16.735
  417    HG2  LYS  55           HG2      LYS  55  86.839  -0.924  15.638
  418    HG3  LYS  55           HG3      LYS  55  88.525  -1.428  15.528
  419    HD2  LYS  55           HD2      LYS  55  87.276  -2.735  17.233
  420    HD3  LYS  55           HD3      LYS  55  88.598  -1.813  17.946
  421    HE2  LYS  55           HE2      LYS  55  85.945  -0.457  17.803
  422    HE3  LYS  55           HE3      LYS  55  86.109  -1.770  18.968
  423    HZ1  LYS  55           HZ1      LYS  55  86.773   0.147  20.099
  424    HZ2  LYS  55           HZ2      LYS  55  87.687   0.726  18.789
  425    HZ3  LYS  55           HZ3      LYS  55  88.227  -0.618  19.679
  426    H    GLY  56           H        GLY  56  89.758   2.794  13.564
  427    HA2  GLY  56           HA2      GLY  56  90.008   4.990  15.472
  428    HA3  GLY  56           HA3      GLY  56  90.541   4.997  13.793
  429    H    ILE  57           H        ILE  57  88.112   4.152  12.599
  430    HA   ILE  57           HA       ILE  57  86.101   6.124  13.397
  431    HB   ILE  57           HB       ILE  57  85.982   7.154  11.209
  432   HG12  ILE  57          HG12      ILE  57  87.973   6.552   9.612
  433   HG13  ILE  57          HG13      ILE  57  88.044   5.053  10.534
  434   HG21  ILE  57          HG21      ILE  57  88.890   7.072  12.048
  435   HG22  ILE  57          HG22      ILE  57  87.653   7.974  12.924
  436   HG23  ILE  57          HG23      ILE  57  88.039   8.399  11.257
  437   HD11  ILE  57          HD11      ILE  57  86.152   4.242   9.572
  438   HD12  ILE  57          HD12      ILE  57  86.427   5.475   8.349
  439   HD13  ILE  57          HD13      ILE  57  85.315   5.789   9.676
  440    H    THR  58           H        THR  58  84.155   5.929  11.837
  441    HA   THR  58           HA       THR  58  83.700   3.050  11.336
  442    HB   THR  58           HB       THR  58  81.787   5.254  12.118
  443    HG1  THR  58           HG1      THR  58  83.202   4.028  13.655
  444   HG21  THR  58          HG21      THR  58  81.300   2.417  11.204
  445   HG22  THR  58          HG22      THR  58  80.592   3.897  10.561
  446   HG23  THR  58          HG23      THR  58  80.124   3.318  12.159
  447    H    TRP  59           H        TRP  59  82.865   2.366   9.411
  448    HA   TRP  59           HA       TRP  59  83.254   3.972   7.113
  449    HB2  TRP  59           HB2      TRP  59  81.410   1.587   7.197
  450    HB3  TRP  59           HB1      TRP  59  82.396   2.168   5.856
  451    HD1  TRP  59           HD1      TRP  59  85.168   2.472   7.267
  452    HE1  TRP  59           HE1      TRP  59  86.471   0.372   8.023
  453    HE3  TRP  59           HE3      TRP  59  81.352  -0.901   7.556
  454    HZ2  TRP  59           HZ2      TRP  59  85.949  -2.357   8.697
  455    HZ3  TRP  59           HZ3      TRP  59  81.780  -3.239   8.248
  456    HH2  TRP  59           HH2      TRP  59  84.074  -3.969   8.819
  457    H    LYS  60           H        LYS  60  81.884   5.217   5.945
  458    HA   LYS  60           HA       LYS  60  79.024   5.208   6.443
  459    HB2  LYS  60           HB2      LYS  60  80.764   7.578   7.167
  460    HB3  LYS  60           HB3      LYS  60  79.019   7.680   6.950
  461    HG2  LYS  60           HG2      LYS  60  78.852   5.774   8.667
  462    HG3  LYS  60           HG3      LYS  60  80.545   6.108   9.031
  463    HD2  LYS  60           HD2      LYS  60  78.438   8.278   9.064
  464    HD3  LYS  60           HD3      LYS  60  78.812   7.308  10.488
  465    HE2  LYS  60           HE2      LYS  60  81.214   7.977  10.251
  466    HE3  LYS  60           HE3      LYS  60  80.741   9.054   8.937
  467    HZ1  LYS  60           HZ1      LYS  60  79.324  10.258  10.428
  468    HZ2  LYS  60           HZ2      LYS  60  80.881  10.178  11.103
  469    HZ3  LYS  60           HZ3      LYS  60  79.644   9.174  11.692
  470    H    GLU  61           H        GLU  61  78.429   7.659   5.233
  471    HA   GLU  61           HA       GLU  61  78.908   6.988   2.482
  472    HB2  GLU  61           HB2      GLU  61  76.770   7.967   3.285
  473    HB3  GLU  61           HB3      GLU  61  77.625   9.467   3.651
  474    HG2  GLU  61           HG2      GLU  61  78.274   9.695   1.292
  475    HG3  GLU  61           HG3      GLU  61  77.464   8.175   0.912
  476    H    GLU  62           H        GLU  62  79.632   9.920   4.399
  477    HA   GLU  62           HA       GLU  62  81.363  11.005   2.409
  478    HB2  GLU  62           HB2      GLU  62  81.886  12.703   4.049
  479    HB3  GLU  62           HB3      GLU  62  80.158  12.357   4.136
  480    HG2  GLU  62           HG2      GLU  62  80.726  10.693   5.989
  481    HG3  GLU  62           HG3      GLU  62  82.334  11.414   6.012
  482    H    THR  63           H        THR  63  81.896   9.123   5.353
  483    HA   THR  63           HA       THR  63  84.689   9.358   5.493
  484    HB   THR  63           HB       THR  63  84.623   7.278   6.788
  485    HG1  THR  63           HG1      THR  63  82.163   7.082   5.483
  486   HG21  THR  63          HG21      THR  63  83.963   9.183   8.035
  487   HG22  THR  63          HG22      THR  63  82.739   7.962   8.378
  488   HG23  THR  63          HG23      THR  63  82.394   9.259   7.234
  489    H    LEU  64           H        LEU  64  82.597   7.255   3.602
  490    HA   LEU  64           HA       LEU  64  84.666   5.578   2.604
  491    HB2  LEU  64           HB2      LEU  64  81.806   5.944   2.143
  492    HB3  LEU  64           HB3      LEU  64  82.674   5.588   0.657
  493    HG   LEU  64           HG       LEU  64  82.887   3.957   3.202
  494   HD11  LEU  64          HD11      LEU  64  80.835   3.237   2.515
  495   HD12  LEU  64          HD12      LEU  64  81.767   2.311   1.338
  496   HD13  LEU  64          HD13      LEU  64  81.047   3.852   0.876
  497   HD21  LEU  64          HD21      LEU  64  83.759   2.399   1.103
  498   HD22  LEU  64          HD22      LEU  64  84.817   3.304   2.180
  499   HD23  LEU  64          HD23      LEU  64  84.346   3.994   0.629
  500    H    MET  65           H        MET  65  83.234   8.624   1.516
  501    HA   MET  65           HA       MET  65  84.352   8.757  -1.047
  502    HB2  MET  65           HB2      MET  65  83.881  11.015   0.914
  503    HB3  MET  65           HB1      MET  65  84.173  11.211  -0.815
  504    HG2  MET  65           HG2      MET  65  82.159  10.002  -1.362
  505    HG3  MET  65           HG1      MET  65  81.912   9.557   0.325
  506    HE1  MET  65           HE1      MET  65  81.581  12.021  -2.441
  507    HE2  MET  65           HE2      MET  65  80.253  13.009  -1.841
  508    HE3  MET  65           HE3      MET  65  80.053  11.264  -1.971
  509    H    GLU  66           H        GLU  66  85.684  10.157   1.963
  510    HA   GLU  66           HA       GLU  66  88.144  10.959   0.873
  511    HB2  GLU  66           HB2      GLU  66  87.585  10.056   3.709
  512    HB3  GLU  66           HB3      GLU  66  88.939  11.054   3.179
  513    HG2  GLU  66           HG2      GLU  66  87.236  12.716   2.305
  514    HG3  GLU  66           HG3      GLU  66  85.998  11.768   3.127
  515    H    TYR  67           H        TYR  67  86.967   7.872   1.953
  516    HA   TYR  67           HA       TYR  67  89.549   6.591   2.062
  517    HB2  TYR  67           HB2      TYR  67  87.653   5.792   3.415
  518    HB3  TYR  67           HB3      TYR  67  86.759   5.427   1.944
  519    HD1  TYR  67           HD1      TYR  67  89.765   4.536   3.931
  520    HD2  TYR  67           HD2      TYR  67  87.179   3.447   0.678
  521    HE1  TYR  67           HE1      TYR  67  90.841   2.303   3.824
  522    HE2  TYR  67           HE2      TYR  67  88.257   1.216   0.568
  523    HH   TYR  67           HH       TYR  67  90.608   0.276   1.255
  524    H    LEU  68           H        LEU  68  87.046   7.110  -0.316
  525    HA   LEU  68           HA       LEU  68  88.033   5.166  -2.191
  526    HB2  LEU  68           HB2      LEU  68  85.983   7.369  -2.304
  527    HB3  LEU  68           HB3      LEU  68  86.461   6.511  -3.762
  528    HG   LEU  68           HG       LEU  68  85.283   5.274  -1.256
  529   HD11  LEU  68          HD11      LEU  68  83.468   4.657  -2.896
  530   HD12  LEU  68          HD12      LEU  68  84.251   5.721  -4.062
  531   HD13  LEU  68          HD13      LEU  68  83.601   6.383  -2.567
  532   HD21  LEU  68          HD21      LEU  68  85.161   3.314  -3.088
  533   HD22  LEU  68          HD22      LEU  68  86.531   3.492  -1.997
  534   HD23  LEU  68          HD23      LEU  68  86.631   4.105  -3.647
  535    H    GLU  69           H        GLU  69  88.757   8.473  -1.448
  536    HA   GLU  69           HA       GLU  69  90.113   8.883  -4.017
  537    HB2  GLU  69           HB2      GLU  69  90.088  11.140  -3.552
  538    HB3  GLU  69           HB3      GLU  69  88.680  10.626  -2.627
  539    HG2  GLU  69           HG2      GLU  69  90.314  10.314  -0.657
  540    HG3  GLU  69           HG3      GLU  69  91.452  11.259  -1.615
  541    H    ASN  70           H        ASN  70  90.792   7.670  -0.966
  542    HA   ASN  70           HA       ASN  70  93.540   7.264  -1.518
  543    HB2  ASN  70           HB2      ASN  70  93.248   9.812  -0.805
  544    HB3  ASN  70           HB1      ASN  70  93.265   9.118   0.811
  545   HD21  ASN  70          HD21      ASN  70  95.122   7.009   0.470
  546   HD22  ASN  70          HD22      ASN  70  96.637   7.662   0.072
  547    HA   PRO  71           HA       PRO  71  91.215   4.501   1.474
  548    HB2  PRO  71           HB2      PRO  71  93.047   2.616   0.050
  549    HB3  PRO  71           HB1      PRO  71  91.337   2.421   0.476
  550    HG2  PRO  71           HG2      PRO  71  92.103   2.950  -2.021
  551    HG3  PRO  71           HG1      PRO  71  90.607   3.615  -1.344
  552    HD2  PRO  71           HD2      PRO  71  93.197   4.990  -1.896
  553    HD3  PRO  71           HD1      PRO  71  91.545   5.645  -1.912
  554    H    LYS  72           H        LYS  72  94.664   4.669   0.648
  555    HA   LYS  72           HA       LYS  72  95.507   3.413   3.098
  556    HB2  LYS  72           HB2      LYS  72  96.798   3.226   1.003
  557    HB3  LYS  72           HB3      LYS  72  97.109   4.957   1.051
  558    HG2  LYS  72           HG2      LYS  72  99.046   4.069   2.033
  559    HG3  LYS  72           HG3      LYS  72  98.070   4.492   3.434
  560    HD2  LYS  72           HD2      LYS  72  99.016   2.246   3.713
  561    HD3  LYS  72           HD3      LYS  72  97.265   2.145   3.565
  562    HE2  LYS  72           HE2      LYS  72  97.370   1.052   1.557
  563    HE3  LYS  72           HE3      LYS  72  98.768   1.977   1.009
  564    HZ1  LYS  72           HZ1      LYS  72 100.151   0.680   2.529
  565    HZ2  LYS  72           HZ2      LYS  72  99.370  -0.311   1.391
  566    HZ3  LYS  72           HZ3      LYS  72  98.799  -0.236   2.989
  567    H    LYS  73           H        LYS  73  95.653   6.753   1.841
  568    HA   LYS  73           HA       LYS  73  96.953   7.861   4.054
  569    HB2  LYS  73           HB2      LYS  73  96.634   8.999   1.856
  570    HB3  LYS  73           HB3      LYS  73  94.947   9.267   2.291
  571    HG2  LYS  73           HG2      LYS  73  95.652  10.519   4.294
  572    HG3  LYS  73           HG3      LYS  73  97.341  10.243   3.872
  573    HD2  LYS  73           HD2      LYS  73  97.031  12.343   2.936
  574    HD3  LYS  73           HD3      LYS  73  96.600  11.328   1.561
  575    HE2  LYS  73           HE2      LYS  73  94.863  12.974   1.778
  576    HE3  LYS  73           HE3      LYS  73  94.192  11.452   2.365
  577    HZ1  LYS  73           HZ1      LYS  73  95.377  12.572   4.557
  578    HZ2  LYS  73           HZ2      LYS  73  93.712  12.548   4.219
  579    HZ3  LYS  73           HZ3      LYS  73  94.652  13.891   3.775
  580    H    TYR  74           H        TYR  74  93.592   6.999   3.604
  581    HA   TYR  74           HA       TYR  74  92.564   8.598   5.732
  582    HB2  TYR  74           HB2      TYR  74  91.360   7.287   3.744
  583    HB3  TYR  74           HB3      TYR  74  91.218   6.038   4.980
  584    HD1  TYR  74           HD1      TYR  74  90.853   9.776   4.728
  585    HD2  TYR  74           HD2      TYR  74  89.274   6.088   6.270
  586    HE1  TYR  74           HE1      TYR  74  88.966  11.012   5.754
  587    HE2  TYR  74           HE2      TYR  74  87.388   7.327   7.296
  588    HH   TYR  74           HH       TYR  74  86.475  10.312   6.456
  589    H    ILE  75           H        ILE  75  93.194   5.087   5.533
  590    HA   ILE  75           HA       ILE  75  93.709   5.112   8.450
  591    HB   ILE  75           HB       ILE  75  92.328   2.923   6.875
  592   HG12  ILE  75          HG12      ILE  75  91.144   4.621   9.079
  593   HG13  ILE  75          HG13      ILE  75  91.067   5.133   7.394
  594   HG21  ILE  75          HG21      ILE  75  93.496   1.869   8.646
  595   HG22  ILE  75          HG22      ILE  75  91.886   2.142   9.310
  596   HG23  ILE  75          HG23      ILE  75  93.215   3.216   9.749
  597   HD11  ILE  75          HD11      ILE  75  89.891   3.093   6.776
  598   HD12  ILE  75          HD12      ILE  75  89.040   3.859   8.118
  599   HD13  ILE  75          HD13      ILE  75  90.070   2.458   8.412
  600    HA   PRO  76           HA       PRO  76  97.494   3.869   5.935
  601    HB2  PRO  76           HB2      PRO  76  98.496   4.659   8.653
  602    HB3  PRO  76           HB1      PRO  76  99.214   4.962   7.058
  603    HG2  PRO  76           HG2      PRO  76  97.887   6.866   8.372
  604    HG3  PRO  76           HG1      PRO  76  97.806   6.720   6.608
  605    HD2  PRO  76           HD2      PRO  76  95.720   6.110   8.630
  606    HD3  PRO  76           HD1      PRO  76  95.539   6.522   6.913
  607    H    GLY  77           H        GLY  77  98.094   1.786   5.856
  608    HA2  GLY  77           HA2      GLY  77  99.136  -0.101   7.046
  609    HA3  GLY  77           HA3      GLY  77  97.959   0.156   8.329
  610    H    THR  78           H        THR  78  95.794   0.705   6.399
  611    HA   THR  78           HA       THR  78  94.648  -1.828   6.206
  612    HB   THR  78           HB       THR  78  93.435   0.358   6.033
  613    HG1  THR  78           HG1      THR  78  92.367  -1.501   5.423
  614   HG21  THR  78          HG21      THR  78  93.439   1.582   3.997
  615   HG22  THR  78          HG22      THR  78  94.281   0.292   3.137
  616   HG23  THR  78          HG23      THR  78  95.137   1.253   4.345
  617    H    LYS  79           H        LYS  79  94.500  -3.364   4.590
  618    HA   LYS  79           HA       LYS  79  96.636  -3.261   2.590
  619    HB2  LYS  79           HB2      LYS  79  95.302  -5.332   4.082
  620    HB3  LYS  79           HB3      LYS  79  95.148  -5.675   2.361
  621    HG2  LYS  79           HG2      LYS  79  97.798  -4.912   3.604
  622    HG3  LYS  79           HG3      LYS  79  97.242  -6.584   3.538
  623    HD2  LYS  79           HD2      LYS  79  97.236  -6.614   1.170
  624    HD3  LYS  79           HD3      LYS  79  97.313  -4.856   1.065
  625    HE2  LYS  79           HE2      LYS  79  99.494  -6.220   0.644
  626    HE3  LYS  79           HE3      LYS  79  99.581  -4.791   1.674
  627    HZ1  LYS  79           HZ1      LYS  79 100.665  -6.863   2.560
  628    HZ2  LYS  79           HZ2      LYS  79  99.104  -7.507   2.751
  629    HZ3  LYS  79           HZ3      LYS  79  99.559  -6.109   3.602
  630    H    MET  80           H        MET  80  95.863  -1.790   1.078
  631    HA   MET  80           HA       MET  80  94.229  -2.843  -0.981
  632    HB2  MET  80           HB2      MET  80  92.365  -2.374   0.510
  633    HB3  MET  80           HB1      MET  80  92.943  -0.726   0.763
  634    HG2  MET  80           HG2      MET  80  92.488  -0.110  -1.495
  635    HG3  MET  80           HG1      MET  80  92.280  -1.789  -1.989
  636    HE1  MET  80           HE1      MET  80  90.526   1.280  -1.636
  637    HE2  MET  80           HE2      MET  80  88.916   0.618  -1.903
  638    HE3  MET  80           HE3      MET  80  90.247   0.129  -2.949
  639    H    ILE  81           H        ILE  81  95.864  -2.170  -2.321
  640    HA   ILE  81           HA       ILE  81  96.065   0.746  -2.741
  641    HB   ILE  81           HB       ILE  81  98.390  -1.195  -2.794
  642   HG12  ILE  81          HG12      ILE  81  99.061   0.573  -0.894
  643   HG13  ILE  81          HG13      ILE  81  97.310   0.694  -0.730
  644   HG21  ILE  81          HG21      ILE  81  98.717   0.551  -4.415
  645   HG22  ILE  81          HG22      ILE  81  99.681   0.977  -3.000
  646   HG23  ILE  81          HG23      ILE  81  98.139   1.782  -3.292
  647   HD11  ILE  81          HD11      ILE  81  97.527  -1.988  -0.789
  648   HD12  ILE  81          HD12      ILE  81  97.664  -1.069   0.707
  649   HD13  ILE  81          HD13      ILE  81  99.118  -1.600  -0.136
  650    H    PHE  82           H        PHE  82  94.725   0.646  -4.540
  651    HA   PHE  82           HA       PHE  82  95.852  -0.791  -6.875
  652    HB2  PHE  82           HB2      PHE  82  93.768  -1.867  -6.143
  653    HB3  PHE  82           HB1      PHE  82  92.928  -0.319  -6.240
  654    HD1  PHE  82           HD2      PHE  82  95.142  -2.498  -8.352
  655    HD2  PHE  82           HD1      PHE  82  91.778   0.171  -8.213
  656    HE1  PHE  82           HE2      PHE  82  94.748  -2.867 -10.773
  657    HE2  PHE  82           HE1      PHE  82  91.385  -0.200 -10.633
  658    HZ   PHE  82           HZ       PHE  82  92.870  -1.717 -11.913
  659    H    ALA  83           H        ALA  83  93.333   1.668  -6.271
  660    HA   ALA  83           HA       ALA  83  94.737   3.835  -7.395
  661    HB1  ALA  83           HB1      ALA  83  93.005   2.259  -9.296
  662    HB2  ALA  83           HB2      ALA  83  94.674   2.784  -9.520
  663    HB3  ALA  83           HB3      ALA  83  93.364   3.966  -9.551
  664    H    GLY  84           H        GLY  84  93.807   5.324  -6.139
  665    HA2  GLY  84           HA2      GLY  84  91.131   5.199  -5.188
  666    HA3  GLY  84           HA3      GLY  84  92.202   6.593  -5.078
  667    H    ILE  85           H        ILE  85  89.950   7.566  -5.476
  668    HA   ILE  85           HA       ILE  85  89.355   7.692  -8.370
  669    HB   ILE  85           HB       ILE  85  87.724   8.022  -5.883
  670   HG12  ILE  85          HG12      ILE  85  87.104   6.856  -8.612
  671   HG13  ILE  85          HG13      ILE  85  87.790   5.929  -7.279
  672   HG21  ILE  85          HG21      ILE  85  87.350  10.163  -6.998
  673   HG22  ILE  85          HG22      ILE  85  85.946   9.129  -7.229
  674   HG23  ILE  85          HG23      ILE  85  87.098   9.343  -8.541
  675   HD11  ILE  85          HD11      ILE  85  85.231   7.495  -6.943
  676   HD12  ILE  85          HD12      ILE  85  85.842   6.166  -5.960
  677   HD13  ILE  85          HD13      ILE  85  85.228   5.852  -7.581
  678    H    LYS  86           H        LYS  86  88.758   9.831  -9.235
  679    HA   LYS  86           HA       LYS  86  90.526  11.904  -8.117
  680    HB2  LYS  86           HB2      LYS  86  90.782  11.055 -10.514
  681    HB3  LYS  86           HB3      LYS  86  89.276  11.904 -10.859
  682    HG2  LYS  86           HG2      LYS  86  90.790  13.589 -11.344
  683    HG3  LYS  86           HG3      LYS  86  90.527  13.911  -9.631
  684    HD2  LYS  86           HD2      LYS  86  92.514  12.317  -9.213
  685    HD3  LYS  86           HD3      LYS  86  92.855  12.494 -10.934
  686    HE2  LYS  86           HE2      LYS  86  92.573  14.821  -9.010
  687    HE3  LYS  86           HE3      LYS  86  94.116  14.123  -9.502
  688    HZ1  LYS  86           HZ1      LYS  86  92.797  14.539 -11.848
  689    HZ2  LYS  86           HZ2      LYS  86  94.023  15.525 -11.205
  690    HZ3  LYS  86           HZ3      LYS  86  92.390  15.904 -10.927
  691    H    LYS  87           H        LYS  87  87.311  11.688  -9.726
  692    HA   LYS  87           HA       LYS  87  86.627  14.309  -8.629
  693    HB2  LYS  87           HB2      LYS  87  84.785  12.553 -10.232
  694    HB3  LYS  87           HB3      LYS  87  84.807  14.312 -10.109
  695    HG2  LYS  87           HG2      LYS  87  87.266  13.994 -11.097
  696    HG3  LYS  87           HG3      LYS  87  86.565  12.501 -11.719
  697    HD2  LYS  87           HD2      LYS  87  85.446  15.288 -12.150
  698    HD3  LYS  87           HD3      LYS  87  86.314  14.332 -13.352
  699    HE2  LYS  87           HE2      LYS  87  84.560  12.568 -13.164
  700    HE3  LYS  87           HE3      LYS  87  83.671  13.607 -12.051
  701    HZ1  LYS  87           HZ1      LYS  87  84.272  15.180 -14.231
  702    HZ2  LYS  87           HZ2      LYS  87  82.753  14.538 -13.822
  703    HZ3  LYS  87           HZ3      LYS  87  83.776  13.695 -14.885
  704    H    LYS  88           H        LYS  88  84.571  14.661  -7.541
  705    HA   LYS  88           HA       LYS  88  84.232  12.870  -5.337
  706    HB2  LYS  88           HB2      LYS  88  83.880  15.395  -5.317
  707    HB3  LYS  88           HB3      LYS  88  82.345  15.088  -6.130
  708    HG2  LYS  88           HG2      LYS  88  81.677  13.581  -4.275
  709    HG3  LYS  88           HG3      LYS  88  83.195  13.940  -3.454
  710    HD2  LYS  88           HD2      LYS  88  81.810  15.498  -2.435
  711    HD3  LYS  88           HD3      LYS  88  82.400  16.455  -3.793
  712    HE2  LYS  88           HE2      LYS  88  80.381  15.758  -5.098
  713    HE3  LYS  88           HE3      LYS  88  79.779  14.936  -3.660
  714    HZ1  LYS  88           HZ1      LYS  88  79.568  16.942  -2.516
  715    HZ2  LYS  88           HZ2      LYS  88  78.982  17.294  -4.071
  716    HZ3  LYS  88           HZ3      LYS  88  80.540  17.791  -3.615
  717    H    THR  89           H        THR  89  82.059  13.855  -8.001
  718    HA   THR  89           HA       THR  89  79.913  12.210  -7.466
  719    HB   THR  89           HB       THR  89  79.459  12.228  -9.894
  720    HG1  THR  89           HG1      THR  89  81.951  12.207 -10.175
  721   HG21  THR  89          HG21      THR  89  80.357  14.751  -8.510
  722   HG22  THR  89          HG22      THR  89  78.714  14.179  -8.803
  723   HG23  THR  89          HG23      THR  89  79.683  14.802 -10.139
  724    H    GLU  90           H        GLU  90  83.059  11.356  -8.719
  725    HA   GLU  90           HA       GLU  90  82.390   8.786  -9.727
  726    HB2  GLU  90           HB2      GLU  90  84.920  10.137  -8.855
  727    HB3  GLU  90           HB3      GLU  90  84.933   8.391  -9.085
  728    HG2  GLU  90           HG2      GLU  90  83.999   8.748 -11.377
  729    HG3  GLU  90           HG3      GLU  90  84.170  10.486 -11.131
  730    H    ARG  91           H        ARG  91  83.368  10.013  -6.569
  731    HA   ARG  91           HA       ARG  91  83.392   7.409  -5.325
  732    HB2  ARG  91           HB2      ARG  91  83.181  10.054  -3.883
  733    HB3  ARG  91           HB3      ARG  91  83.885   8.547  -3.303
  734    HG2  ARG  91           HG2      ARG  91  85.670   8.733  -5.006
  735    HG3  ARG  91           HG3      ARG  91  84.973  10.259  -5.551
  736    HD2  ARG  91           HD2      ARG  91  85.201  10.684  -2.843
  737    HD3  ARG  91           HD3      ARG  91  86.620   9.696  -3.174
  738    HE   ARG  91           HE       ARG  91  86.649  11.593  -5.154
  739   HH11  ARG  91          HH21      ARG  91  86.476  11.605  -1.696
  740   HH12  ARG  91          HH22      ARG  91  87.291  13.124  -1.525
  741   HH21  ARG  91          HH11      ARG  91  87.716  13.583  -4.934
  742   HH22  ARG  91          HH12      ARG  91  87.995  14.242  -3.357
  743    H    GLU  92           H        GLU  92  81.201  10.221  -5.293
  744    HA   GLU  92           HA       GLU  92  79.290   9.188  -3.522
  745    HB2  GLU  92           HB2      GLU  92  79.446  11.558  -4.448
  746    HB3  GLU  92           HB3      GLU  92  78.642  10.944  -5.894
  747    HG2  GLU  92           HG2      GLU  92  76.765  10.136  -4.498
  748    HG3  GLU  92           HG3      GLU  92  77.561  10.786  -3.065
  749    H    ASP  93           H        ASP  93  79.299   9.112  -7.099
  750    HA   ASP  93           HA       ASP  93  76.982   7.566  -7.414
  751    HB2  ASP  93           HB2      ASP  93  79.463   7.602  -9.152
  752    HB3  ASP  93           HB1      ASP  93  77.877   7.004  -9.635
  753    H    LEU  94           H        LEU  94  80.388   6.572  -7.213
  754    HA   LEU  94           HA       LEU  94  80.011   3.804  -7.434
  755    HB2  LEU  94           HB2      LEU  94  82.229   4.829  -7.581
  756    HB3  LEU  94           HB3      LEU  94  82.104   5.358  -5.905
  757    HG   LEU  94           HG       LEU  94  82.110   3.091  -5.099
  758   HD11  LEU  94          HD11      LEU  94  81.784   2.451  -8.022
  759   HD12  LEU  94          HD12      LEU  94  80.856   1.853  -6.647
  760   HD13  LEU  94          HD13      LEU  94  82.494   1.267  -6.925
  761   HD21  LEU  94          HD21      LEU  94  84.317   4.001  -5.548
  762   HD22  LEU  94          HD22      LEU  94  84.203   3.541  -7.244
  763   HD23  LEU  94          HD23      LEU  94  84.304   2.299  -5.997
  764    H    ILE  95           H        ILE  95  79.917   5.960  -4.659
  765    HA   ILE  95           HA       ILE  95  79.673   3.883  -2.726
  766    HB   ILE  95           HB       ILE  95  79.247   6.864  -2.639
  767   HG12  ILE  95          HG12      ILE  95  81.222   5.173  -1.102
  768   HG13  ILE  95          HG13      ILE  95  81.532   5.629  -2.773
  769   HG21  ILE  95          HG21      ILE  95  78.603   4.751  -0.601
  770   HG22  ILE  95          HG22      ILE  95  77.739   6.243  -0.970
  771   HG23  ILE  95          HG23      ILE  95  79.242   6.301  -0.051
  772   HD11  ILE  95          HD11      ILE  95  81.701   7.893  -2.271
  773   HD12  ILE  95          HD12      ILE  95  82.401   7.166  -0.830
  774   HD13  ILE  95          HD13      ILE  95  80.738   7.745  -0.804
  775    H    ALA  96           H        ALA  96  77.467   5.715  -4.691
  776    HA   ALA  96           HA       ALA  96  75.084   5.185  -3.247
  777    HB1  ALA  96           HB1      ALA  96  75.406   5.615  -6.226
  778    HB2  ALA  96           HB2      ALA  96  75.319   6.914  -5.036
  779    HB3  ALA  96           HB3      ALA  96  73.936   5.845  -5.278
  780    H    TYR  97           H        TYR  97  76.913   3.435  -5.691
  781    HA   TYR  97           HA       TYR  97  74.928   1.385  -6.062
  782    HB2  TYR  97           HB2      TYR  97  76.425   1.693  -7.887
  783    HB3  TYR  97           HB3      TYR  97  77.839   1.624  -6.835
  784    HD1  TYR  97           HD1      TYR  97  75.022  -0.394  -8.206
  785    HD2  TYR  97           HD2      TYR  97  78.842  -0.458  -6.245
  786    HE1  TYR  97           HE1      TYR  97  75.143  -2.847  -8.525
  787    HE2  TYR  97           HE2      TYR  97  78.961  -2.914  -6.565
  788    HH   TYR  97           HH       TYR  97  77.989  -4.615  -8.114
  789    H    LEU  98           H        LEU  98  77.749   1.892  -4.036
  790    HA   LEU  98           HA       LEU  98  78.076  -0.719  -3.043
  791    HB2  LEU  98           HB2      LEU  98  78.695   2.018  -1.962
  792    HB3  LEU  98           HB3      LEU  98  78.972   0.588  -0.975
  793    HG   LEU  98           HG       LEU  98  80.067   0.831  -3.785
  794   HD11  LEU  98          HD11      LEU  98  81.425   2.460  -3.000
  795   HD12  LEU  98          HD12      LEU  98  82.203   1.196  -2.051
  796   HD13  LEU  98          HD13      LEU  98  80.931   2.183  -1.332
  797   HD21  LEU  98          HD21      LEU  98  80.281  -1.395  -3.158
  798   HD22  LEU  98          HD22      LEU  98  80.413  -1.014  -1.444
  799   HD23  LEU  98          HD23      LEU  98  81.789  -0.749  -2.513
  800    H    LYS  99           H        LYS  99  76.164   2.025  -1.845
  801    HA   LYS  99           HA       LYS  99  75.130   0.825   0.458
  802    HB2  LYS  99           HB2      LYS  99  73.946   2.949  -1.335
  803    HB3  LYS  99           HB3      LYS  99  73.301   2.517   0.248
  804    HG2  LYS  99           HG2      LYS  99  75.343   3.177   1.347
  805    HG3  LYS  99           HG3      LYS  99  76.168   3.384  -0.198
  806    HD2  LYS  99           HD2      LYS  99  75.449   5.558   0.761
  807    HD3  LYS  99           HD3      LYS  99  74.665   5.230  -0.784
  808    HE2  LYS  99           HE2      LYS  99  72.601   4.742   0.219
  809    HE3  LYS  99           HE3      LYS  99  73.334   4.409   1.789
  810    HZ1  LYS  99           HZ1      LYS  99  74.044   6.970   1.333
  811    HZ2  LYS  99           HZ2      LYS  99  72.714   6.483   2.272
  812    HZ3  LYS  99           HZ3      LYS  99  72.496   6.915   0.643
  813    H    LYS 100           H        LYS 100  73.626   1.086  -2.774
  814    HA   LYS 100           HA       LYS 100  71.393  -0.554  -2.055
  815    HB2  LYS 100           HB2      LYS 100  72.445   0.229  -4.782
  816    HB3  LYS 100           HB3      LYS 100  70.868  -0.494  -4.460
  817    HG2  LYS 100           HG2      LYS 100  70.210   1.418  -3.109
  818    HG3  LYS 100           HG3      LYS 100  71.821   2.121  -3.259
  819    HD2  LYS 100           HD2      LYS 100  71.537   2.535  -5.587
  820    HD3  LYS 100           HD3      LYS 100  70.110   1.502  -5.672
  821    HE2  LYS 100           HE2      LYS 100  69.634   4.000  -5.636
  822    HE3  LYS 100           HE3      LYS 100  68.800   3.058  -4.401
  823    HZ1  LYS 100           HZ1      LYS 100  71.433   4.131  -3.734
  824    HZ2  LYS 100           HZ2      LYS 100  70.065   3.916  -2.749
  825    HZ3  LYS 100           HZ3      LYS 100  70.145   5.232  -3.822
  826    H    ALA 101           H        ALA 101  74.589  -1.213  -3.242
  827    HA   ALA 101           HA       ALA 101  73.918  -3.897  -4.151
  828    HB1  ALA 101           HB1      ALA 101  76.600  -2.526  -3.856
  829    HB2  ALA 101           HB2      ALA 101  75.639  -2.607  -5.334
  830    HB3  ALA 101           HB3      ALA 101  76.317  -4.079  -4.642
  831    H    THR 102           H        THR 102  75.047  -2.347  -1.270
  832    HA   THR 102           HA       THR 102  75.976  -4.876  -0.108
  833    HB   THR 102           HB       THR 102  76.589  -3.411   1.837
  834    HG1  THR 102           HG1      THR 102  75.256  -1.610   0.212
  835   HG21  THR 102          HG21      THR 102  77.623  -2.885  -0.945
  836   HG22  THR 102          HG22      THR 102  78.351  -3.850   0.337
  837   HG23  THR 102          HG23      THR 102  78.338  -2.091   0.458
  838    H    ASN 103           H        ASN 103  73.122  -3.382  -0.584
  839    HA   ASN 103           HA       ASN 103  71.967  -4.043   2.041
  840    HB2  ASN 103           HB2      ASN 103  71.014  -2.441  -0.325
  841    HB3  ASN 103           HB1      ASN 103  69.911  -2.951   0.947
  842   HD21  ASN 103          HD21      ASN 103  73.268  -2.206   1.703
  843   HD22  ASN 103          HD22      ASN 103  72.944  -0.765   2.536
  844    H    GLU 104           H        GLU 104  72.141  -5.111  -1.245
  845    HA   GLU 104           HA       GLU 104  69.796  -6.771  -1.189
  846    HB2  GLU 104           HB2      GLU 104  72.180  -6.579  -3.028
  847    HB3  GLU 104           HB3      GLU 104  70.930  -7.804  -3.244
  848    HG2  GLU 104           HG2      GLU 104  70.169  -4.905  -2.942
  849    HG3  GLU 104           HG3      GLU 104  70.698  -5.523  -4.506
  850    HHA  HEC 201           HA       HEC 105  89.120  -3.357   3.330
  851    HHB  HEC 201           HB       HEC 105  85.330  -0.006  -0.459
  852    HHC  HEC 201           HC       HEC 105  88.800  -1.764  -5.450
  853    HHD  HEC 201           HD       HEC 105  92.104  -5.683  -1.739
  854   HMA1  HEC 201          HMA1      HEC 105  84.386  -0.159   1.515
  855   HMA2  HEC 201          HMA2      HEC 105  85.486   0.893   2.405
  856   HMA3  HEC 201          HMA3      HEC 105  84.752  -0.498   3.202
  857   HAA1  HEC 201          HAA1      HEC 105  86.511  -0.898   4.516
  858   HAA2  HEC 201          HAA2      HEC 105  88.095  -1.647   4.533
  859   HBA1  HEC 201          HBA1      HEC 105  87.113  -3.856   4.413
  860   HBA2  HEC 201          HBA2      HEC 105  85.502  -3.169   4.229
  861   HMB1  HEC 201          HMB1      HEC 105  84.753   1.224  -3.959
  862   HMB2  HEC 201          HMB2      HEC 105  84.773   1.292  -2.201
  863   HMB3  HEC 201          HMB3      HEC 105  83.945  -0.028  -3.022
  864    HAB  HEC 201           HAB      HEC 105  87.289  -0.613  -6.169
  865   HBB1  HEC 201          HBB1      HEC 105  87.960   1.600  -5.833
  866   HBB2  HEC 201          HBB2      HEC 105  86.379   1.791  -6.587
  867   HBB3  HEC 201          HBB3      HEC 105  86.555   1.984  -4.844
  868   HMC1  HEC 201          HMC1      HEC 105  91.432  -2.615  -6.469
  869   HMC2  HEC 201          HMC2      HEC 105  89.815  -3.261  -6.737
  870   HMC3  HEC 201          HMC3      HEC 105  91.201  -4.343  -6.725
  871    HAC  HEC 201           HAC      HEC 105  92.611  -6.124  -3.645
  872   HBC1  HEC 201          HBC1      HEC 105  93.287  -5.155  -6.338
  873   HBC2  HEC 201          HBC2      HEC 105  94.347  -5.512  -4.976
  874   HBC3  HEC 201          HBC3      HEC 105  93.543  -3.947  -5.079
  875   HMD1  HEC 201          HMD1      HEC 105  93.352  -6.105   0.151
  876   HMD2  HEC 201          HMD2      HEC 105  92.175  -7.352   0.562
  877   HMD3  HEC 201          HMD3      HEC 105  93.016  -6.475   1.840
  878   HAD1  HEC 201          HAD1      HEC 105  91.420  -6.269   3.431
  879   HAD2  HEC 201          HAD2      HEC 105  90.211  -5.112   3.940
  880   HBD1  HEC 201          HBD1      HEC 105  92.587  -3.646   3.312
  881   HBD2  HEC 201          HBD2      HEC 105  93.045  -5.009   4.328
  882    H1   HOH 301           H2       HOH 200  82.614   3.876  -0.389
  883    H2   HOH 301           H1       HOH 200  83.700   3.432  -1.342
  884    H1   HOH 302           H2       HOH 201  85.446   5.024   6.025
  885    H2   HOH 302           H1       HOH 201  86.428   5.815   5.182
  886    H1   HOH 303           H2       HOH 202  82.742  -5.249   5.366
  887    H2   HOH 303           H1       HOH 202  83.345  -6.614   5.624
  888    H1   HOH 304           H2       HOH 203  83.288  -9.439  -0.576
  889    H2   HOH 304           H1       HOH 203  83.306 -10.369   0.615
  Start of MODEL   21
    1    H1   GLY   1           H1       GLY   1  75.655  10.202  -8.108
    2    H2   GLY   1           H2       GLY   1  76.459   9.482  -6.795
    3    H3   GLY   1           H3       GLY   1  75.797  11.039  -6.639
    4    HA2  GLY   1           HA2      GLY   1  74.574   8.849  -5.774
    5    HA3  GLY   1           HA3      GLY   1  73.715  10.297  -6.302
    6    H    ASP   2           H        ASP   2  75.498   8.626  -8.714
    7    HA   ASP   2           HA       ASP   2  72.980   7.706  -9.941
    8    HB2  ASP   2           HB2      ASP   2  75.699   7.912 -11.237
    9    HB3  ASP   2           HB1      ASP   2  74.134   7.738 -12.029
   10    H    VAL   3           H        VAL   3  72.735   5.798  -8.731
   11    HA   VAL   3           HA       VAL   3  74.571   3.816  -8.213
   12    HB   VAL   3           HB       VAL   3  72.306   3.691  -7.362
   13   HG11  VAL   3          HG11      VAL   3  70.415   3.184  -8.867
   14   HG12  VAL   3          HG12      VAL   3  71.499   3.271 -10.257
   15   HG13  VAL   3          HG13      VAL   3  71.175   4.716  -9.299
   16   HG21  VAL   3          HG21      VAL   3  71.896   1.359  -7.694
   17   HG22  VAL   3          HG22      VAL   3  73.638   1.565  -7.864
   18   HG23  VAL   3          HG23      VAL   3  72.629   1.388  -9.298
   19    H    GLU   4           H        GLU   4  73.387   4.869 -11.256
   20    HA   GLU   4           HA       GLU   4  73.831   2.428 -12.702
   21    HB2  GLU   4           HB2      GLU   4  73.468   5.298 -13.566
   22    HB3  GLU   4           HB3      GLU   4  73.706   3.975 -14.708
   23    HG2  GLU   4           HG2      GLU   4  71.554   3.895 -12.589
   24    HG3  GLU   4           HG3      GLU   4  71.275   4.600 -14.180
   25    H    LYS   5           H        LYS   5  75.583   5.549 -12.712
   26    HA   LYS   5           HA       LYS   5  77.846   4.418 -14.067
   27    HB2  LYS   5           HB2      LYS   5  77.276   7.058 -12.735
   28    HB3  LYS   5           HB3      LYS   5  78.911   6.656 -13.260
   29    HG2  LYS   5           HG2      LYS   5  78.268   6.487 -15.531
   30    HG3  LYS   5           HG3      LYS   5  76.555   6.375 -15.128
   31    HD2  LYS   5           HD2      LYS   5  78.050   8.842 -14.304
   32    HD3  LYS   5           HD3      LYS   5  77.600   8.661 -16.000
   33    HE2  LYS   5           HE2      LYS   5  75.284   8.552 -15.489
   34    HE3  LYS   5           HE3      LYS   5  75.593   8.266 -13.778
   35    HZ1  LYS   5           HZ1      LYS   5  75.307  10.454 -13.572
   36    HZ2  LYS   5           HZ2      LYS   5  75.498  10.743 -15.236
   37    HZ3  LYS   5           HZ3      LYS   5  76.862  10.604 -14.233
   38    H    GLY   6           H        GLY   6  76.780   4.541 -10.822
   39    HA2  GLY   6           HA2      GLY   6  79.342   4.350  -9.547
   40    HA3  GLY   6           HA3      GLY   6  77.783   3.959  -8.817
   41    H    LYS   7           H        LYS   7  76.950   2.135 -10.831
   42    HA   LYS   7           HA       LYS   7  78.125  -0.273  -9.867
   43    HB2  LYS   7           HB2      LYS   7  75.785  -0.156 -10.600
   44    HB3  LYS   7           HB3      LYS   7  76.307   0.222 -12.239
   45    HG2  LYS   7           HG2      LYS   7  77.561  -2.205 -11.112
   46    HG3  LYS   7           HG3      LYS   7  75.813  -2.323 -11.300
   47    HD2  LYS   7           HD2      LYS   7  76.053  -1.559 -13.667
   48    HD3  LYS   7           HD3      LYS   7  77.805  -1.580 -13.463
   49    HE2  LYS   7           HE2      LYS   7  77.433  -3.693 -14.366
   50    HE3  LYS   7           HE3      LYS   7  77.380  -4.048 -12.639
   51    HZ1  LYS   7           HZ1      LYS   7  75.063  -4.116 -12.652
   52    HZ2  LYS   7           HZ2      LYS   7  75.503  -4.939 -14.071
   53    HZ3  LYS   7           HZ3      LYS   7  74.943  -3.337 -14.153
   54    H    LYS   8           H        LYS   8  78.389   1.589 -12.880
   55    HA   LYS   8           HA       LYS   8  79.999  -0.220 -14.315
   56    HB2  LYS   8           HB2      LYS   8  78.930   1.654 -15.416
   57    HB3  LYS   8           HB3      LYS   8  79.851   2.799 -14.440
   58    HG2  LYS   8           HG2      LYS   8  81.509   0.818 -15.889
   59    HG3  LYS   8           HG3      LYS   8  80.616   1.920 -16.934
   60    HD2  LYS   8           HD2      LYS   8  82.152   3.001 -14.578
   61    HD3  LYS   8           HD3      LYS   8  82.989   2.624 -16.083
   62    HE2  LYS   8           HE2      LYS   8  80.512   4.357 -16.004
   63    HE3  LYS   8           HE3      LYS   8  82.138   5.023 -15.852
   64    HZ1  LYS   8           HZ1      LYS   8  80.832   3.807 -18.163
   65    HZ2  LYS   8           HZ2      LYS   8  82.499   3.531 -17.978
   66    HZ3  LYS   8           HZ3      LYS   8  81.905   5.119 -18.090
   67    H    ILE   9           H        ILE   9  80.894   2.523 -12.227
   68    HA   ILE   9           HA       ILE   9  83.698   2.213 -12.522
   69    HB   ILE   9           HB       ILE   9  82.107   3.466 -10.274
   70   HG12  ILE   9          HG12      ILE   9  83.509   4.857 -12.564
   71   HG13  ILE   9          HG13      ILE   9  81.829   4.334 -12.692
   72   HG21  ILE   9          HG21      ILE   9  84.373   3.017  -9.546
   73   HG22  ILE   9          HG22      ILE   9  84.249   4.737  -9.916
   74   HG23  ILE   9          HG23      ILE   9  85.029   3.643 -11.059
   75   HD11  ILE   9          HD11      ILE   9  81.307   5.635 -10.624
   76   HD12  ILE   9          HD12      ILE   9  81.886   6.655 -11.942
   77   HD13  ILE   9          HD13      ILE   9  82.968   6.229 -10.616
   78    H    PHE  10           H        PHE  10  81.332   0.569 -10.617
   79    HA   PHE  10           HA       PHE  10  83.199  -0.429  -8.653
   80    HB2  PHE  10           HB2      PHE  10  81.063  -0.324  -7.763
   81    HB3  PHE  10           HB1      PHE  10  80.298  -0.852  -9.262
   82    HD1  PHE  10           HD1      PHE  10  80.237  -3.221  -9.887
   83    HD2  PHE  10           HD2      PHE  10  82.031  -1.931  -6.209
   84    HE1  PHE  10           HE1      PHE  10  80.263  -5.565  -9.082
   85    HE2  PHE  10           HE2      PHE  10  82.066  -4.276  -5.404
   86    HZ   PHE  10           HZ       PHE  10  81.179  -6.095  -6.841
   87    H    VAL  11           H        VAL  11  81.373  -1.939 -11.335
   88    HA   VAL  11           HA       VAL  11  82.396  -4.511 -11.103
   89    HB   VAL  11           HB       VAL  11  81.867  -4.758 -13.524
   90   HG11  VAL  11          HG11      VAL  11  80.156  -4.785 -11.599
   91   HG12  VAL  11          HG12      VAL  11  79.532  -4.549 -13.230
   92   HG13  VAL  11          HG13      VAL  11  79.705  -3.171 -12.145
   93   HG21  VAL  11          HG21      VAL  11  81.212  -1.810 -13.307
   94   HG22  VAL  11          HG22      VAL  11  80.941  -2.827 -14.719
   95   HG23  VAL  11          HG23      VAL  11  82.586  -2.471 -14.191
   96    H    GLN  12           H        GLN  12  83.824  -1.666 -12.550
   97    HA   GLN  12           HA       GLN  12  86.028  -3.259 -13.644
   98    HB2  GLN  12           HB2      GLN  12  86.705  -1.251 -14.772
   99    HB3  GLN  12           HB1      GLN  12  84.967  -1.455 -14.982
  100    HG2  GLN  12           HG2      GLN  12  84.634   0.082 -13.002
  101    HG3  GLN  12           HG1      GLN  12  86.369   0.404 -13.047
  102   HE21  GLN  12          HE21      GLN  12  85.680  -0.126 -16.203
  103   HE22  GLN  12          HE22      GLN  12  85.298   1.450 -16.697
  104    H    LYS  13           H        LYS  13  85.394  -1.123 -10.937
  105    HA   LYS  13           HA       LYS  13  88.285  -0.925 -10.410
  106    HB2  LYS  13           HB2      LYS  13  86.651   1.079 -10.400
  107    HB3  LYS  13           HB3      LYS  13  86.184   0.488  -8.805
  108    HG2  LYS  13           HG2      LYS  13  87.921   1.940  -8.254
  109    HG3  LYS  13           HG3      LYS  13  88.792   0.415  -8.397
  110    HD2  LYS  13           HD2      LYS  13  90.128   1.764  -9.730
  111    HD3  LYS  13           HD3      LYS  13  88.998   1.171 -10.945
  112    HE2  LYS  13           HE2      LYS  13  89.101   3.538 -11.251
  113    HE3  LYS  13           HE3      LYS  13  87.572   3.225 -10.433
  114    HZ1  LYS  13           HZ1      LYS  13  89.785   3.598  -8.637
  115    HZ2  LYS  13           HZ2      LYS  13  88.240   4.306  -8.619
  116    HZ3  LYS  13           HZ3      LYS  13  89.468   4.960  -9.594
  117    H    CYS  14           H        CYS  14  85.405  -1.422  -8.304
  118    HA   CYS  14           HA       CYS  14  87.111  -2.661  -6.321
  119    HB2  CYS  14           HB2      CYS  14  84.137  -2.583  -6.097
  120    HB3  CYS  14           HB1      CYS  14  85.349  -2.437  -4.831
  121    H    ALA  15           H        ALA  15  84.607  -3.855  -8.532
  122    HA   ALA  15           HA       ALA  15  84.095  -6.320  -7.436
  123    HB1  ALA  15           HB1      ALA  15  82.893  -5.883  -9.377
  124    HB2  ALA  15           HB2      ALA  15  84.038  -7.102  -9.932
  125    HB3  ALA  15           HB3      ALA  15  84.330  -5.398 -10.277
  126    H    GLN  16           H        GLN  16  87.043  -5.215  -8.916
  127    HA   GLN  16           HA       GLN  16  88.325  -7.527  -9.655
  128    HB2  GLN  16           HB2      GLN  16  89.308  -4.989  -8.395
  129    HB3  GLN  16           HB1      GLN  16  90.432  -6.311  -8.705
  130    HG2  GLN  16           HG2      GLN  16  89.873  -6.311 -11.064
  131    HG3  GLN  16           HG1      GLN  16  88.593  -5.127 -10.802
  132   HE21  GLN  16          HE21      GLN  16  89.713  -3.148  -9.313
  133   HE22  GLN  16          HE22      GLN  16  91.092  -2.505 -10.067
  134    H    CYS  17           H        CYS  17  88.447  -6.114  -6.352
  135    HA   CYS  17           HA       CYS  17  88.899  -8.858  -5.335
  136    HB2  CYS  17           HB2      CYS  17  90.128  -6.669  -3.775
  137    HB3  CYS  17           HB1      CYS  17  90.756  -8.264  -4.165
  138    H    HIS  18           H        HSD  18  86.347  -8.037  -5.378
  139    HA   HIS  18           HA       HSD  18  85.718  -7.861  -2.557
  140    HB2  HIS  18           HB2      HSD  18  85.192  -5.558  -4.411
  141    HB3  HIS  18           HB1      HSD  18  84.095  -5.880  -3.070
  142    HD1  HIS  18           HD1      HSD  18  85.105  -5.717  -0.635
  143    HD2  HIS  18           HD2      HSD  18  87.685  -4.497  -3.668
  144    HE1  HIS  18           HE1      HSD  18  86.993  -4.458   0.494
  145    H    THR  19           H        THR  19  83.130  -7.469  -2.466
  146    HA   THR  19           HA       THR  19  81.844  -9.083  -4.567
  147    HB   THR  19           HB       THR  19  80.900  -9.746  -1.871
  148    HG1  THR  19           HG1      THR  19  83.109 -11.145  -2.105
  149   HG21  THR  19          HG21      THR  19  80.848 -11.936  -2.758
  150   HG22  THR  19          HG22      THR  19  82.095 -11.572  -3.951
  151   HG23  THR  19          HG23      THR  19  80.475 -10.900  -4.134
  152    H    VAL  20           H        VAL  20  81.501  -7.009  -1.731
  153    HA   VAL  20           HA       VAL  20  79.768  -5.683  -0.997
  154    HB   VAL  20           HB       VAL  20  79.114  -3.996  -2.602
  155   HG11  VAL  20          HG11      VAL  20  81.964  -4.953  -2.994
  156   HG12  VAL  20          HG12      VAL  20  81.392  -3.859  -1.737
  157   HG13  VAL  20          HG13      VAL  20  81.374  -3.348  -3.422
  158   HG21  VAL  20          HG21      VAL  20  78.686  -5.692  -4.460
  159   HG22  VAL  20          HG22      VAL  20  80.424  -5.684  -4.736
  160   HG23  VAL  20          HG23      VAL  20  79.494  -4.206  -4.951
  161    H    GLU  21           H        GLU  21  78.900  -8.394  -1.641
  162    HA   GLU  21           HA       GLU  21  76.066  -7.767  -2.187
  163    HB2  GLU  21           HB2      GLU  21  75.788  -9.607  -3.636
  164    HB3  GLU  21           HB3      GLU  21  77.280  -8.839  -4.176
  165    HG2  GLU  21           HG2      GLU  21  78.466 -10.492  -2.566
  166    HG3  GLU  21           HG3      GLU  21  76.941 -11.376  -2.588
  167    H    LYS  22           H        LYS  22  74.916  -8.257  -0.462
  168    HA   LYS  22           HA       LYS  22  75.822  -9.674   1.762
  169    HB2  LYS  22           HB2      LYS  22  73.870  -8.115   1.719
  170    HB3  LYS  22           HB3      LYS  22  72.941  -9.366   0.894
  171    HG2  LYS  22           HG2      LYS  22  72.878 -10.753   2.765
  172    HG3  LYS  22           HG3      LYS  22  74.346 -10.061   3.457
  173    HD2  LYS  22           HD2      LYS  22  73.197  -8.048   4.094
  174    HD3  LYS  22           HD3      LYS  22  71.757  -8.518   3.190
  175    HE2  LYS  22           HE2      LYS  22  71.249 -10.279   4.710
  176    HE3  LYS  22           HE3      LYS  22  72.847 -10.199   5.453
  177    HZ1  LYS  22           HZ1      LYS  22  70.857  -7.999   5.537
  178    HZ2  LYS  22           HZ2      LYS  22  72.337  -8.071   6.369
  179    HZ3  LYS  22           HZ3      LYS  22  71.075  -9.133   6.780
  180    H    GLY  23           H        GLY  23  75.595 -11.765   2.476
  181    HA2  GLY  23           HA2      GLY  23  75.319 -14.045   2.371
  182    HA3  GLY  23           HA3      GLY  23  74.047 -13.764   1.186
  183    H    GLY  24           H        GLY  24  77.166 -12.436   0.544
  184    HA2  GLY  24           HA2      GLY  24  77.477 -14.246  -1.737
  185    HA3  GLY  24           HA3      GLY  24  78.372 -12.757  -1.455
  186    H    LYS  25           H        LYS  25  80.428 -13.508  -1.608
  187    HA   LYS  25           HA       LYS  25  81.401 -15.119   0.617
  188    HB2  LYS  25           HB2      LYS  25  82.624 -16.674  -0.880
  189    HB3  LYS  25           HB3      LYS  25  80.874 -16.839  -1.024
  190    HG2  LYS  25           HG2      LYS  25  81.153 -15.070  -2.960
  191    HG3  LYS  25           HG3      LYS  25  82.826 -15.628  -2.963
  192    HD2  LYS  25           HD2      LYS  25  82.064 -17.949  -3.272
  193    HD3  LYS  25           HD3      LYS  25  80.386 -17.407  -3.247
  194    HE2  LYS  25           HE2      LYS  25  80.999 -15.876  -5.202
  195    HE3  LYS  25           HE3      LYS  25  82.503 -16.791  -5.316
  196    HZ1  LYS  25           HZ1      LYS  25  80.287 -18.540  -5.099
  197    HZ2  LYS  25           HZ2      LYS  25  81.450 -18.433  -6.333
  198    HZ3  LYS  25           HZ3      LYS  25  80.052 -17.468  -6.391
  199    H    HIS  26           H        HIS  26  82.960 -13.856   1.399
  200    HA   HIS  26           HA       HIS  26  84.263 -11.789   0.067
  201    HB2  HIS  26           HB2      HIS  26  86.073 -12.212   1.901
  202    HB3  HIS  26           HB1      HIS  26  84.454 -11.714   2.390
  203    HD1  HIS  26           HD1      HIS  26  85.743 -15.170   1.406
  204    HD2  HIS  26           HD2      HIS  26  83.926 -13.247   4.627
  205    HE1  HIS  26           HE1      HIS  26  85.266 -16.961   3.133
  206    HE2  HIS  26           HE2      HIS  26  84.157 -15.804   5.102
  207    H    LYS  27           H        LYS  27  85.834 -11.704  -1.397
  208    HA   LYS  27           HA       LYS  27  87.664 -13.996  -1.697
  209    HB2  LYS  27           HB2      LYS  27  87.450 -13.560  -4.236
  210    HB3  LYS  27           HB3      LYS  27  86.160 -14.461  -3.441
  211    HG2  LYS  27           HG2      LYS  27  84.669 -12.662  -3.510
  212    HG3  LYS  27           HG3      LYS  27  85.957 -11.467  -3.638
  213    HD2  LYS  27           HD2      LYS  27  85.028 -11.528  -5.807
  214    HD3  LYS  27           HD3      LYS  27  86.462 -12.543  -5.940
  215    HE2  LYS  27           HE2      LYS  27  84.783 -13.837  -6.969
  216    HE3  LYS  27           HE3      LYS  27  84.862 -14.504  -5.339
  217    HZ1  LYS  27           HZ1      LYS  27  82.799 -13.840  -4.919
  218    HZ2  LYS  27           HZ2      LYS  27  82.639 -13.506  -6.577
  219    HZ3  LYS  27           HZ3      LYS  27  83.091 -12.274  -5.499
  220    H    THR  28           H        THR  28  89.726 -13.370  -1.816
  221    HA   THR  28           HA       THR  28  91.532 -11.933  -1.730
  222    HB   THR  28           HB       THR  28  90.331 -10.568  -4.123
  223    HG1  THR  28           HG1      THR  28  90.036 -12.972  -4.043
  224   HG21  THR  28          HG21      THR  28  92.673 -10.730  -4.912
  225   HG22  THR  28          HG22      THR  28  93.105 -11.573  -3.425
  226   HG23  THR  28          HG23      THR  28  92.569  -9.895  -3.363
  227    H    GLY  29           H        GLY  29  89.068 -11.073  -0.312
  228    HA2  GLY  29           HA2      GLY  29  89.857  -8.654   0.728
  229    HA3  GLY  29           HA3      GLY  29  88.800  -8.235  -0.617
  230    HA   PRO  30           HA       PRO  30  86.344  -9.513   3.253
  231    HB2  PRO  30           HB2      PRO  30  85.794  -7.092   4.359
  232    HB3  PRO  30           HB1      PRO  30  87.264  -8.005   4.750
  233    HG2  PRO  30           HG2      PRO  30  86.909  -5.700   2.893
  234    HG3  PRO  30           HG1      PRO  30  88.222  -6.037   4.034
  235    HD2  PRO  30           HD2      PRO  30  88.404  -6.538   1.333
  236    HD3  PRO  30           HD1      PRO  30  89.322  -7.437   2.563
  237    H    ASN  31           H        ASN  31  84.038  -8.945   3.697
  238    HA   ASN  31           HA       ASN  31  82.691  -8.160   1.208
  239    HB2  ASN  31           HB2      ASN  31  80.761  -9.255   2.093
  240    HB3  ASN  31           HB1      ASN  31  82.132 -10.301   2.457
  241   HD21  ASN  31          HD21      ASN  31  82.618 -10.700   4.667
  242   HD22  ASN  31          HD22      ASN  31  81.739 -10.021   5.950
  243    H    LEU  32           H        LEU  32  81.913  -6.159   0.986
  244    HA   LEU  32           HA       LEU  32  81.865  -4.317   3.198
  245    HB2  LEU  32           HB2      LEU  32  80.686  -3.782   0.480
  246    HB3  LEU  32           HB3      LEU  32  81.393  -2.637   1.614
  247    HG   LEU  32           HG       LEU  32  82.814  -4.693  -0.086
  248   HD11  LEU  32          HD11      LEU  32  82.201  -2.040  -0.531
  249   HD12  LEU  32          HD12      LEU  32  83.535  -2.904  -1.291
  250   HD13  LEU  32          HD13      LEU  32  83.823  -1.930   0.149
  251   HD21  LEU  32          HD21      LEU  32  84.887  -3.736   1.137
  252   HD22  LEU  32          HD22      LEU  32  83.922  -4.938   1.993
  253   HD23  LEU  32          HD23      LEU  32  83.750  -3.227   2.381
  254    H    HIS  33           H        HIS  33  80.024  -6.611   3.381
  255    HA   HIS  33           HA       HIS  33  77.361  -5.877   2.824
  256    HB2  HIS  33           HB2      HIS  33  78.413  -7.596   5.086
  257    HB3  HIS  33           HB1      HIS  33  76.739  -7.536   4.537
  258    HD1  HIS  33           HD1      HIS  33  78.078 -10.224   4.348
  259    HD2  HIS  33           HD2      HIS  33  78.295  -7.424   1.267
  260    HE1  HIS  33           HE1      HIS  33  78.596 -11.521   2.237
  261    HE2  HIS  33           HE2      HIS  33  78.727  -9.830   0.349
  262    H    GLY  34           H        GLY  34  75.880  -4.627   3.896
  263    HA2  GLY  34           HA2      GLY  34  75.307  -2.751   5.168
  264    HA3  GLY  34           HA3      GLY  34  75.619  -3.890   6.476
  265    H    LEU  35           H        LEU  35  78.114  -2.831   4.304
  266    HA   LEU  35           HA       LEU  35  80.080  -2.237   6.064
  267    HB2  LEU  35           HB2      LEU  35  80.423  -2.213   3.663
  268    HB3  LEU  35           HB3      LEU  35  79.397  -0.794   3.493
  269    HG   LEU  35           HG       LEU  35  81.131   0.273   5.190
  270   HD11  LEU  35          HD11      LEU  35  83.299  -0.638   5.167
  271   HD12  LEU  35          HD12      LEU  35  82.961  -1.635   3.755
  272   HD13  LEU  35          HD13      LEU  35  82.275  -2.065   5.320
  273   HD21  LEU  35          HD21      LEU  35  81.918  -0.216   2.307
  274   HD22  LEU  35          HD22      LEU  35  82.360   1.166   3.308
  275   HD23  LEU  35          HD23      LEU  35  80.685   0.942   2.805
  276    H    PHE  36           H        PHE  36  77.862   0.216   4.758
  277    HA   PHE  36           HA       PHE  36  78.713   2.358   6.322
  278    HB2  PHE  36           HB2      PHE  36  75.860   1.938   5.425
  279    HB3  PHE  36           HB1      PHE  36  76.708   3.466   5.662
  280    HD1  PHE  36           HD2      PHE  36  76.535   0.413   3.545
  281    HD2  PHE  36           HD1      PHE  36  78.140   4.377   3.963
  282    HE1  PHE  36           HE2      PHE  36  77.343   0.337   1.204
  283    HE2  PHE  36           HE1      PHE  36  78.942   4.300   1.627
  284    HZ   PHE  36           HZ       PHE  36  78.543   2.283   0.245
  285    H    GLY  37           H        GLY  37  79.040   1.851   8.495
  286    HA2  GLY  37           HA2      GLY  37  77.467   2.473  10.466
  287    HA3  GLY  37           HA3      GLY  37  76.691   0.958  10.039
  288    H    ARG  38           H        ARG  38  79.356  -0.275   9.356
  289    HA   ARG  38           HA       ARG  38  79.974  -1.112  12.082
  290    HB2  ARG  38           HB2      ARG  38  80.403  -2.185   9.363
  291    HB3  ARG  38           HB3      ARG  38  81.688  -2.534  10.516
  292    HG2  ARG  38           HG2      ARG  38  79.896  -3.349  12.117
  293    HG3  ARG  38           HG3      ARG  38  78.747  -3.210  10.786
  294    HD2  ARG  38           HD2      ARG  38  81.233  -4.684  10.139
  295    HD3  ARG  38           HD3      ARG  38  80.196  -5.467  11.324
  296    HE   ARG  38           HE       ARG  38  78.371  -5.014   9.523
  297   HH11  ARG  38          HH21      ARG  38  81.712  -5.791   8.934
  298   HH12  ARG  38          HH22      ARG  38  81.395  -6.563   7.418
  299   HH21  ARG  38          HH11      ARG  38  77.973  -6.047   7.553
  300   HH22  ARG  38          HH12      ARG  38  79.287  -6.717   6.643
  301    H    LYS  39           H        LYS  39  82.152  -1.290  12.877
  302    HA   LYS  39           HA       LYS  39  83.680   1.117  12.424
  303    HB2  LYS  39           HB2      LYS  39  83.824  -1.194  14.324
  304    HB3  LYS  39           HB3      LYS  39  85.232  -0.150  14.136
  305    HG2  LYS  39           HG2      LYS  39  82.558   1.145  14.537
  306    HG3  LYS  39           HG3      LYS  39  83.346   0.408  15.931
  307    HD2  LYS  39           HD2      LYS  39  85.377   1.753  15.492
  308    HD3  LYS  39           HD3      LYS  39  84.573   2.504  14.113
  309    HE2  LYS  39           HE2      LYS  39  82.954   3.565  15.510
  310    HE3  LYS  39           HE3      LYS  39  83.411   2.587  16.903
  311    HZ1  LYS  39           HZ1      LYS  39  84.639   4.973  15.844
  312    HZ2  LYS  39           HZ2      LYS  39  85.741   3.739  16.230
  313    HZ3  LYS  39           HZ3      LYS  39  84.681   4.336  17.416
  314    H    THR  40           H        THR  40  86.082   0.994  12.134
  315    HA   THR  40           HA       THR  40  86.728  -0.306   9.724
  316    HB   THR  40           HB       THR  40  89.132   0.337  10.436
  317    HG1  THR  40           HG1      THR  40  87.915   2.049  12.238
  318   HG21  THR  40          HG21      THR  40  87.854   1.675   8.871
  319   HG22  THR  40          HG22      THR  40  88.612   2.757  10.040
  320   HG23  THR  40          HG23      THR  40  86.899   2.365  10.184
  321    H    GLY  41           H        GLY  41  87.944  -2.076   9.225
  322    HA2  GLY  41           HA2      GLY  41  88.559  -4.283   9.470
  323    HA3  GLY  41           HA3      GLY  41  89.558  -3.643  10.772
  324    H    GLN  42           H        GLN  42  86.041  -4.073  10.390
  325    HA   GLN  42           HA       GLN  42  86.035  -5.565  12.952
  326    HB2  GLN  42           HB2      GLN  42  84.871  -3.408  13.090
  327    HB3  GLN  42           HB1      GLN  42  83.846  -3.869  11.730
  328    HG2  GLN  42           HG2      GLN  42  82.810  -5.617  12.967
  329    HG3  GLN  42           HG1      GLN  42  84.034  -5.549  14.233
  330   HE21  GLN  42          HE21      GLN  42  81.821  -3.157  12.657
  331   HE22  GLN  42          HE22      GLN  42  81.302  -2.470  14.120
  332    H    ALA  43           H        ALA  43  85.264  -5.655   9.601
  333    HA   ALA  43           HA       ALA  43  83.191  -7.560   9.608
  334    HB1  ALA  43           HB1      ALA  43  84.834  -6.240   7.674
  335    HB2  ALA  43           HB2      ALA  43  83.299  -7.070   7.420
  336    HB3  ALA  43           HB3      ALA  43  84.814  -7.964   7.301
  337    HA   PRO  44           HA       PRO  44  85.733 -11.028  10.921
  338    HB2  PRO  44           HB2      PRO  44  83.783 -12.897  11.069
  339    HB3  PRO  44           HB1      PRO  44  83.913 -11.582  12.254
  340    HG2  PRO  44           HG2      PRO  44  82.084 -11.844   9.913
  341    HG3  PRO  44           HG1      PRO  44  81.750 -11.230  11.542
  342    HD2  PRO  44           HD2      PRO  44  82.232  -9.608   9.354
  343    HD3  PRO  44           HD1      PRO  44  82.510  -9.114  11.040
  344    H    GLY  45           H        GLY  45  87.082 -11.832   9.377
  345    HA2  GLY  45           HA2      GLY  45  86.614 -14.013   7.821
  346    HA3  GLY  45           HA3      GLY  45  86.113 -12.679   6.789
  347    H    PHE  46           H        PHE  46  87.698 -11.033   6.264
  348    HA   PHE  46           HA       PHE  46  90.238 -12.160   5.611
  349    HB2  PHE  46           HB2      PHE  46  88.912 -10.357   4.338
  350    HB3  PHE  46           HB1      PHE  46  89.576  -9.220   5.512
  351    HD1  PHE  46           HD1      PHE  46  90.378 -11.553   2.767
  352    HD2  PHE  46           HD2      PHE  46  91.950  -8.687   5.553
  353    HE1  PHE  46           HE1      PHE  46  92.504 -11.479   1.492
  354    HE2  PHE  46           HE2      PHE  46  94.076  -8.613   4.279
  355    HZ   PHE  46           HZ       PHE  46  94.352 -10.010   2.248
  356    H    THR  47           H        THR  47  92.312 -11.460   6.295
  357    HA   THR  47           HA       THR  47  92.472 -10.920   9.121
  358    HB   THR  47           HB       THR  47  94.039 -12.475   8.057
  359    HG1  THR  47           HG1      THR  47  95.833 -11.662   9.062
  360   HG21  THR  47          HG21      THR  47  95.599 -10.316   6.780
  361   HG22  THR  47          HG22      THR  47  94.079 -10.706   5.977
  362   HG23  THR  47          HG23      THR  47  95.293 -11.960   6.226
  363    H    TYR  48           H        TYR  48  91.504  -8.831   9.218
  364    HA   TYR  48           HA       TYR  48  92.370  -6.573   7.792
  365    HB2  TYR  48           HB2      TYR  48  90.930  -7.016  10.373
  366    HB3  TYR  48           HB3      TYR  48  91.497  -5.393   9.993
  367    HD1  TYR  48           HD2      TYR  48  91.034  -4.637   7.487
  368    HD2  TYR  48           HD1      TYR  48  88.800  -7.621   9.611
  369    HE1  TYR  48           HE2      TYR  48  89.119  -4.286   5.958
  370    HE2  TYR  48           HE1      TYR  48  86.882  -7.267   8.083
  371    HH   TYR  48           HH       TYR  48  86.458  -4.675   6.242
  372    H    THR  49           H        THR  49  93.748  -4.871   8.344
  373    HA   THR  49           HA       THR  49  96.133  -5.690   9.780
  374    HB   THR  49           HB       THR  49  97.032  -3.520   9.036
  375    HG1  THR  49           HG1      THR  49  94.341  -3.166   8.278
  376   HG21  THR  49          HG21      THR  49  95.559  -4.552   6.645
  377   HG22  THR  49          HG22      THR  49  96.632  -5.660   7.498
  378   HG23  THR  49          HG23      THR  49  97.268  -4.161   6.824
  379    H    ASP  50           H        ASP  50  97.104  -4.344  11.464
  380    HA   ASP  50           HA       ASP  50  95.446  -3.927  13.659
  381    HB2  ASP  50           HB2      ASP  50  97.854  -4.178  13.893
  382    HB3  ASP  50           HB1      ASP  50  98.122  -2.662  13.035
  383    H    ALA  51           H        ALA  51  96.606  -1.594  11.250
  384    HA   ALA  51           HA       ALA  51  95.637   0.753  12.408
  385    HB1  ALA  51           HB1      ALA  51  96.042  -0.073   9.537
  386    HB2  ALA  51           HB2      ALA  51  97.050   0.983  10.526
  387    HB3  ALA  51           HB3      ALA  51  95.471   1.537   9.971
  388    H    ASN  52           H        ASN  52  93.993  -1.583  10.304
  389    HA   ASN  52           HA       ASN  52  91.529  -0.063  10.311
  390    HB2  ASN  52           HB2      ASN  52  92.627  -1.999   8.656
  391    HB3  ASN  52           HB1      ASN  52  91.352  -2.878   9.491
  392   HD21  ASN  52          HD21      ASN  52  90.409  -2.863   7.173
  393   HD22  ASN  52          HD22      ASN  52  89.465  -1.523   6.732
  394    H    LYS  53           H        LYS  53  92.988  -2.579  12.174
  395    HA   LYS  53           HA       LYS  53  90.501  -3.394  13.444
  396    HB2  LYS  53           HB2      LYS  53  91.785  -5.267  13.527
  397    HB3  LYS  53           HB3      LYS  53  93.276  -4.360  13.318
  398    HG2  LYS  53           HG2      LYS  53  93.280  -3.760  15.698
  399    HG3  LYS  53           HG3      LYS  53  91.739  -4.592  15.923
  400    HD2  LYS  53           HD2      LYS  53  92.808  -6.715  15.197
  401    HD3  LYS  53           HD3      LYS  53  94.350  -5.867  15.062
  402    HE2  LYS  53           HE2      LYS  53  92.745  -5.892  17.623
  403    HE3  LYS  53           HE3      LYS  53  93.950  -7.126  17.254
  404    HZ1  LYS  53           HZ1      LYS  53  94.544  -4.885  18.508
  405    HZ2  LYS  53           HZ2      LYS  53  94.761  -4.349  16.910
  406    HZ3  LYS  53           HZ3      LYS  53  95.647  -5.678  17.492
  407    H    ASN  54           H        ASN  54  92.727  -0.911  13.705
  408    HA   ASN  54           HA       ASN  54  92.870  -0.527  16.508
  409    HB2  ASN  54           HB2      ASN  54  93.906   1.469  15.999
  410    HB3  ASN  54           HB1      ASN  54  94.178   0.583  14.505
  411   HD21  ASN  54          HD21      ASN  54  91.501   0.832  13.420
  412   HD22  ASN  54          HD22      ASN  54  91.248   2.467  13.045
  413    H    LYS  55           H        LYS  55  90.393  -0.062  14.210
  414    HA   LYS  55           HA       LYS  55  88.255   0.794  14.343
  415    HB2  LYS  55           HB2      LYS  55  88.431   0.807  17.335
  416    HB3  LYS  55           HB3      LYS  55  87.081   0.348  16.294
  417    HG2  LYS  55           HG2      LYS  55  88.718  -1.564  15.509
  418    HG3  LYS  55           HG3      LYS  55  89.522  -1.234  17.043
  419    HD2  LYS  55           HD2      LYS  55  87.201  -1.440  18.123
  420    HD3  LYS  55           HD3      LYS  55  86.677  -2.143  16.591
  421    HE2  LYS  55           HE2      LYS  55  88.614  -3.780  16.819
  422    HE3  LYS  55           HE3      LYS  55  88.809  -3.186  18.469
  423    HZ1  LYS  55           HZ1      LYS  55  86.205  -3.658  18.442
  424    HZ2  LYS  55           HZ2      LYS  55  87.350  -4.829  18.896
  425    HZ3  LYS  55           HZ3      LYS  55  86.703  -4.832  17.323
  426    H    GLY  56           H        GLY  56  89.657   2.777  13.633
  427    HA2  GLY  56           HA2      GLY  56  89.739   4.915  15.613
  428    HA3  GLY  56           HA3      GLY  56  90.324   5.002  13.956
  429    H    ILE  57           H        ILE  57  88.004   4.156  12.599
  430    HA   ILE  57           HA       ILE  57  85.935   6.095  13.399
  431    HB   ILE  57           HB       ILE  57  85.805   7.032  11.173
  432   HG12  ILE  57          HG12      ILE  57  87.878   6.339   9.646
  433   HG13  ILE  57          HG13      ILE  57  87.783   4.846  10.574
  434   HG21  ILE  57          HG21      ILE  57  88.689   6.966  12.104
  435   HG22  ILE  57          HG22      ILE  57  87.433   7.989  12.799
  436   HG23  ILE  57          HG23      ILE  57  87.934   8.223  11.125
  437   HD11  ILE  57          HD11      ILE  57  86.399   5.157   8.325
  438   HD12  ILE  57          HD12      ILE  57  85.247   5.938   9.402
  439   HD13  ILE  57          HD13      ILE  57  85.722   4.264   9.682
  440    H    THR  58           H        THR  58  84.085   5.887  11.602
  441    HA   THR  58           HA       THR  58  83.540   2.992  11.301
  442    HB   THR  58           HB       THR  58  81.567   5.230  11.806
  443    HG1  THR  58           HG1      THR  58  81.498   3.487  13.713
  444   HG21  THR  58          HG21      THR  58  81.077   2.255  11.913
  445   HG22  THR  58          HG22      THR  58  80.830   3.183  10.435
  446   HG23  THR  58          HG23      THR  58  79.888   3.555  11.876
  447    H    TRP  59           H        TRP  59  82.733   2.262   9.381
  448    HA   TRP  59           HA       TRP  59  83.174   3.816   7.046
  449    HB2  TRP  59           HB2      TRP  59  81.389   1.388   7.165
  450    HB3  TRP  59           HB1      TRP  59  82.372   1.967   5.818
  451    HD1  TRP  59           HD1      TRP  59  85.093   2.425   7.280
  452    HE1  TRP  59           HE1      TRP  59  86.477   0.408   8.100
  453    HE3  TRP  59           HE3      TRP  59  81.434  -1.124   7.553
  454    HZ2  TRP  59           HZ2      TRP  59  86.072  -2.333   8.815
  455    HZ3  TRP  59           HZ3      TRP  59  81.960  -3.424   8.301
  456    HH2  TRP  59           HH2      TRP  59  84.275  -4.032   8.932
  457    H    LYS  60           H        LYS  60  81.850   5.102   5.911
  458    HA   LYS  60           HA       LYS  60  78.965   5.010   6.273
  459    HB2  LYS  60           HB2      LYS  60  80.608   7.431   7.056
  460    HB3  LYS  60           HB3      LYS  60  78.859   7.449   6.829
  461    HG2  LYS  60           HG2      LYS  60  78.753   5.547   8.533
  462    HG3  LYS  60           HG3      LYS  60  80.441   5.906   8.896
  463    HD2  LYS  60           HD2      LYS  60  78.315   8.054   8.955
  464    HD3  LYS  60           HD3      LYS  60  78.668   7.056  10.364
  465    HE2  LYS  60           HE2      LYS  60  81.059   7.739  10.213
  466    HE3  LYS  60           HE3      LYS  60  80.643   8.807   8.873
  467    HZ1  LYS  60           HZ1      LYS  60  78.928   9.760  10.493
  468    HZ2  LYS  60           HZ2      LYS  60  80.559  10.183  10.716
  469    HZ3  LYS  60           HZ3      LYS  60  79.841   9.002  11.705
  470    H    GLU  61           H        GLU  61  78.402   7.493   5.073
  471    HA   GLU  61           HA       GLU  61  78.979   6.849   2.334
  472    HB2  GLU  61           HB2      GLU  61  76.821   7.862   3.169
  473    HB3  GLU  61           HB3      GLU  61  77.702   9.374   3.396
  474    HG2  GLU  61           HG2      GLU  61  78.290   9.429   1.028
  475    HG3  GLU  61           HG3      GLU  61  77.519   7.865   0.773
  476    H    GLU  62           H        GLU  62  79.632   9.759   4.310
  477    HA   GLU  62           HA       GLU  62  81.429  10.880   2.405
  478    HB2  GLU  62           HB2      GLU  62  81.139  11.472   5.360
  479    HB3  GLU  62           HB3      GLU  62  81.975  12.484   4.181
  480    HG2  GLU  62           HG2      GLU  62  79.813  12.617   2.885
  481    HG3  GLU  62           HG3      GLU  62  79.024  11.806   4.238
  482    H    THR  63           H        THR  63  81.917   9.074   5.425
  483    HA   THR  63           HA       THR  63  84.681   9.223   5.619
  484    HB   THR  63           HB       THR  63  84.556   7.054   6.795
  485    HG1  THR  63           HG1      THR  63  82.076   7.041   5.499
  486   HG21  THR  63          HG21      THR  63  82.701   7.737   8.412
  487   HG22  THR  63          HG22      THR  63  82.404   9.097   7.330
  488   HG23  THR  63          HG23      THR  63  83.968   8.929   8.126
  489    H    LEU  64           H        LEU  64  82.657   7.133   3.631
  490    HA   LEU  64           HA       LEU  64  84.762   5.518   2.630
  491    HB2  LEU  64           HB2      LEU  64  81.911   5.891   2.086
  492    HB3  LEU  64           HB3      LEU  64  82.835   5.530   0.635
  493    HG   LEU  64           HG       LEU  64  82.975   3.911   3.193
  494   HD11  LEU  64          HD11      LEU  64  81.877   2.263   1.314
  495   HD12  LEU  64          HD12      LEU  64  81.163   3.806   0.850
  496   HD13  LEU  64          HD13      LEU  64  80.937   3.186   2.485
  497   HD21  LEU  64          HD21      LEU  64  83.874   2.341   1.110
  498   HD22  LEU  64          HD22      LEU  64  84.916   3.238   2.211
  499   HD23  LEU  64          HD23      LEU  64  84.482   3.933   0.650
  500    H    MET  65           H        MET  65  83.340   8.584   1.569
  501    HA   MET  65           HA       MET  65  84.520   8.774  -0.961
  502    HB2  MET  65           HB2      MET  65  84.080  11.011   1.033
  503    HB3  MET  65           HB1      MET  65  84.352  11.211  -0.696
  504    HG2  MET  65           HG2      MET  65  82.313   9.976  -1.202
  505    HG3  MET  65           HG1      MET  65  82.059   9.649   0.510
  506    HE1  MET  65           HE1      MET  65  81.805  12.064  -2.402
  507    HE2  MET  65           HE2      MET  65  80.402  12.964  -1.831
  508    HE3  MET  65           HE3      MET  65  80.335  11.205  -1.925
  509    H    GLU  66           H        GLU  66  85.794  10.058   2.122
  510    HA   GLU  66           HA       GLU  66  88.294  10.862   1.140
  511    HB2  GLU  66           HB2      GLU  66  87.454   9.935   3.895
  512    HB3  GLU  66           HB3      GLU  66  89.036  10.630   3.538
  513    HG2  GLU  66           HG2      GLU  66  86.452  12.037   2.842
  514    HG3  GLU  66           HG3      GLU  66  87.266  12.265   4.390
  515    H    TYR  67           H        TYR  67  87.052   7.743   2.058
  516    HA   TYR  67           HA       TYR  67  89.619   6.431   2.153
  517    HB2  TYR  67           HB2      TYR  67  87.656   5.610   3.429
  518    HB3  TYR  67           HB3      TYR  67  86.838   5.265   1.910
  519    HD1  TYR  67           HD1      TYR  67  89.797   4.391   3.984
  520    HD2  TYR  67           HD2      TYR  67  87.307   3.297   0.659
  521    HE1  TYR  67           HE1      TYR  67  90.909   2.176   3.881
  522    HE2  TYR  67           HE2      TYR  67  88.421   1.083   0.553
  523    HH   TYR  67           HH       TYR  67  90.724   0.149   1.273
  524    H    LEU  68           H        LEU  68  87.178   7.111  -0.233
  525    HA   LEU  68           HA       LEU  68  88.198   5.254  -2.190
  526    HB2  LEU  68           HB2      LEU  68  86.131   7.446  -2.232
  527    HB3  LEU  68           HB3      LEU  68  86.633   6.641  -3.710
  528    HG   LEU  68           HG       LEU  68  85.402   5.326  -1.271
  529   HD11  LEU  68          HD11      LEU  68  83.785   6.507  -2.650
  530   HD12  LEU  68          HD12      LEU  68  83.611   4.771  -2.921
  531   HD13  LEU  68          HD13      LEU  68  84.443   5.772  -4.110
  532   HD21  LEU  68          HD21      LEU  68  85.337   3.402  -3.139
  533   HD22  LEU  68          HD22      LEU  68  86.693   3.570  -2.028
  534   HD23  LEU  68          HD23      LEU  68  86.808   4.216  -3.665
  535    H    GLU  69           H        GLU  69  88.789   8.558  -1.286
  536    HA   GLU  69           HA       GLU  69  90.190   9.140  -3.790
  537    HB2  GLU  69           HB2      GLU  69  90.126  11.360  -3.174
  538    HB3  GLU  69           HB3      GLU  69  88.723  10.765  -2.289
  539    HG2  GLU  69           HG2      GLU  69  90.365  10.341  -0.343
  540    HG3  GLU  69           HG3      GLU  69  91.483  11.373  -1.230
  541    H    ASN  70           H        ASN  70  90.854   7.618  -0.937
  542    HA   ASN  70           HA       ASN  70  93.577   7.239  -1.429
  543    HB2  ASN  70           HB2      ASN  70  92.988   9.759  -0.145
  544    HB3  ASN  70           HB1      ASN  70  93.911   8.737   0.948
  545   HD21  ASN  70          HD21      ASN  70  96.047   7.937   0.160
  546   HD22  ASN  70          HD22      ASN  70  96.856   8.783  -1.070
  547    HA   PRO  71           HA       PRO  71  91.226   4.439   1.471
  548    HB2  PRO  71           HB2      PRO  71  93.072   2.561   0.061
  549    HB3  PRO  71           HB1      PRO  71  91.345   2.386   0.423
  550    HG2  PRO  71           HG2      PRO  71  92.215   2.950  -2.038
  551    HG3  PRO  71           HG1      PRO  71  90.698   3.610  -1.406
  552    HD2  PRO  71           HD2      PRO  71  93.314   4.977  -1.832
  553    HD3  PRO  71           HD1      PRO  71  91.667   5.642  -1.904
  554    H    LYS  72           H        LYS  72  94.659   4.762   0.721
  555    HA   LYS  72           HA       LYS  72  95.511   3.437   3.147
  556    HB2  LYS  72           HB2      LYS  72  96.810   3.322   1.039
  557    HB3  LYS  72           HB3      LYS  72  97.111   5.051   1.153
  558    HG2  LYS  72           HG2      LYS  72  99.041   4.151   2.129
  559    HG3  LYS  72           HG3      LYS  72  98.039   4.497   3.534
  560    HD2  LYS  72           HD2      LYS  72  99.019   2.252   3.718
  561    HD3  LYS  72           HD3      LYS  72  97.269   2.140   3.559
  562    HE2  LYS  72           HE2      LYS  72  97.393   1.131   1.507
  563    HE3  LYS  72           HE3      LYS  72  98.782   2.095   1.003
  564    HZ1  LYS  72           HZ1      LYS  72  98.716  -0.382   2.584
  565    HZ2  LYS  72           HZ2      LYS  72 100.000   0.709   2.799
  566    HZ3  LYS  72           HZ3      LYS  72  99.707   0.028   1.270
  567    H    LYS  73           H        LYS  73  95.600   6.801   1.929
  568    HA   LYS  73           HA       LYS  73  96.874   7.915   4.146
  569    HB2  LYS  73           HB2      LYS  73  96.050   8.936   1.805
  570    HB3  LYS  73           HB3      LYS  73  94.758   9.547   2.837
  571    HG2  LYS  73           HG2      LYS  73  96.678  10.292   4.426
  572    HG3  LYS  73           HG3      LYS  73  97.719  10.072   3.021
  573    HD2  LYS  73           HD2      LYS  73  97.039  12.375   3.014
  574    HD3  LYS  73           HD3      LYS  73  96.131  11.574   1.733
  575    HE2  LYS  73           HE2      LYS  73  94.123  11.737   2.867
  576    HE3  LYS  73           HE3      LYS  73  94.888  11.662   4.454
  577    HZ1  LYS  73           HZ1      LYS  73  94.934  13.857   4.545
  578    HZ2  LYS  73           HZ2      LYS  73  94.051  13.920   3.095
  579    HZ3  LYS  73           HZ3      LYS  73  95.750  13.965   3.063
  580    H    TYR  74           H        TYR  74  93.484   7.095   3.653
  581    HA   TYR  74           HA       TYR  74  92.461   8.501   5.894
  582    HB2  TYR  74           HB2      TYR  74  91.281   7.252   3.839
  583    HB3  TYR  74           HB3      TYR  74  91.157   5.961   5.032
  584    HD1  TYR  74           HD1      TYR  74  90.735   9.698   4.907
  585    HD2  TYR  74           HD2      TYR  74  89.213   5.936   6.320
  586    HE1  TYR  74           HE1      TYR  74  88.824  10.869   5.969
  587    HE2  TYR  74           HE2      TYR  74  87.304   7.109   7.382
  588    HH   TYR  74           HH       TYR  74  87.025  10.660   7.252
  589    H    ILE  75           H        ILE  75  93.167   5.023   5.488
  590    HA   ILE  75           HA       ILE  75  93.737   4.894   8.391
  591    HB   ILE  75           HB       ILE  75  92.364   2.739   6.765
  592   HG12  ILE  75          HG12      ILE  75  91.116   4.413   8.950
  593   HG13  ILE  75          HG13      ILE  75  91.058   4.924   7.265
  594   HG21  ILE  75          HG21      ILE  75  93.535   1.713   8.560
  595   HG22  ILE  75          HG22      ILE  75  91.893   1.922   9.167
  596   HG23  ILE  75          HG23      ILE  75  93.165   3.037   9.665
  597   HD11  ILE  75          HD11      ILE  75  90.071   2.249   8.289
  598   HD12  ILE  75          HD12      ILE  75  89.950   2.839   6.632
  599   HD13  ILE  75          HD13      ILE  75  89.039   3.629   7.918
  600    HA   PRO  76           HA       PRO  76  97.435   3.767   5.678
  601    HB2  PRO  76           HB2      PRO  76  98.531   4.490   8.379
  602    HB3  PRO  76           HB1      PRO  76  99.193   4.834   6.768
  603    HG2  PRO  76           HG2      PRO  76  97.911   6.705   8.165
  604    HG3  PRO  76           HG1      PRO  76  97.755   6.592   6.404
  605    HD2  PRO  76           HD2      PRO  76  95.762   5.921   8.503
  606    HD3  PRO  76           HD1      PRO  76  95.502   6.378   6.806
  607    H    GLY  77           H        GLY  77  98.335   1.769   5.599
  608    HA2  GLY  77           HA2      GLY  77  99.319  -0.171   6.639
  609    HA3  GLY  77           HA3      GLY  77  98.226   0.052   8.004
  610    H    THR  78           H        THR  78  95.956   0.643   6.188
  611    HA   THR  78           HA       THR  78  94.787  -1.881   6.036
  612    HB   THR  78           HB       THR  78  93.573   0.305   5.944
  613    HG1  THR  78           HG1      THR  78  93.126  -1.944   4.527
  614   HG21  THR  78          HG21      THR  78  94.302   0.273   3.015
  615   HG22  THR  78          HG22      THR  78  95.191   1.230   4.200
  616   HG23  THR  78          HG23      THR  78  93.480   1.547   3.915
  617    H    LYS  79           H        LYS  79  94.769  -3.491   4.554
  618    HA   LYS  79           HA       LYS  79  96.761  -3.422   2.466
  619    HB2  LYS  79           HB2      LYS  79  95.136  -5.429   3.820
  620    HB3  LYS  79           HB3      LYS  79  95.197  -5.712   2.083
  621    HG2  LYS  79           HG2      LYS  79  97.064  -6.875   3.060
  622    HG3  LYS  79           HG3      LYS  79  97.714  -5.464   2.227
  623    HD2  LYS  79           HD2      LYS  79  97.521  -4.256   4.497
  624    HD3  LYS  79           HD3      LYS  79  97.309  -5.862   5.194
  625    HE2  LYS  79           HE2      LYS  79  99.659  -5.022   3.471
  626    HE3  LYS  79           HE3      LYS  79  99.688  -5.133   5.231
  627    HZ1  LYS  79           HZ1      LYS  79  99.183  -7.350   3.321
  628    HZ2  LYS  79           HZ2      LYS  79  99.048  -7.486   5.009
  629    HZ3  LYS  79           HZ3      LYS  79 100.554  -7.146   4.299
  630    H    MET  80           H        MET  80  96.102  -1.840   0.989
  631    HA   MET  80           HA       MET  80  94.452  -2.710  -1.120
  632    HB2  MET  80           HB2      MET  80  92.577  -2.276   0.376
  633    HB3  MET  80           HB1      MET  80  93.176  -0.647   0.691
  634    HG2  MET  80           HG2      MET  80  92.663   0.101  -1.470
  635    HG3  MET  80           HG1      MET  80  92.648  -1.531  -2.138
  636    HE1  MET  80           HE1      MET  80  90.375   0.220  -3.058
  637    HE2  MET  80           HE2      MET  80  90.685   1.280  -1.687
  638    HE3  MET  80           HE3      MET  80  89.078   0.607  -1.920
  639    H    ILE  81           H        ILE  81  95.965  -1.985  -2.515
  640    HA   ILE  81           HA       ILE  81  96.265   0.933  -2.763
  641    HB   ILE  81           HB       ILE  81  98.556  -1.049  -2.876
  642   HG12  ILE  81          HG12      ILE  81  99.269   0.690  -0.962
  643   HG13  ILE  81          HG13      ILE  81  97.522   0.840  -0.789
  644   HG21  ILE  81          HG21      ILE  81  98.327   1.917  -3.419
  645   HG22  ILE  81          HG22      ILE  81  99.000   0.666  -4.463
  646   HG23  ILE  81          HG23      ILE  81  99.865   1.160  -3.009
  647   HD11  ILE  81          HD11      ILE  81  99.291  -1.500  -0.243
  648   HD12  ILE  81          HD12      ILE  81  97.680  -1.840  -0.870
  649   HD13  ILE  81          HD13      ILE  81  97.868  -0.941   0.634
  650    H    PHE  82           H        PHE  82  94.690   0.574  -4.470
  651    HA   PHE  82           HA       PHE  82  95.838  -0.682  -6.895
  652    HB2  PHE  82           HB2      PHE  82  93.737  -1.713  -6.109
  653    HB3  PHE  82           HB1      PHE  82  92.934  -0.148  -6.223
  654    HD1  PHE  82           HD2      PHE  82  94.862  -2.636  -8.240
  655    HD2  PHE  82           HD1      PHE  82  91.997   0.565  -8.270
  656    HE1  PHE  82           HE2      PHE  82  94.442  -3.036 -10.651
  657    HE2  PHE  82           HE1      PHE  82  91.577   0.165 -10.681
  658    HZ   PHE  82           HZ       PHE  82  92.800  -1.635 -11.872
  659    H    ALA  83           H        ALA  83  93.315   1.763  -6.291
  660    HA   ALA  83           HA       ALA  83  94.756   3.949  -7.367
  661    HB1  ALA  83           HB1      ALA  83  92.882   2.523  -9.268
  662    HB2  ALA  83           HB2      ALA  83  94.609   2.803  -9.490
  663    HB3  ALA  83           HB3      ALA  83  93.484   4.161  -9.517
  664    H    GLY  84           H        GLY  84  93.856   5.512  -6.199
  665    HA2  GLY  84           HA2      GLY  84  91.257   5.390  -5.076
  666    HA3  GLY  84           HA3      GLY  84  92.291   6.814  -5.125
  667    H    ILE  85           H        ILE  85  89.791   7.444  -5.393
  668    HA   ILE  85           HA       ILE  85  88.984   7.427  -8.209
  669    HB   ILE  85           HB       ILE  85  87.663   8.401  -5.674
  670   HG12  ILE  85          HG12      ILE  85  87.847   5.875  -6.422
  671   HG13  ILE  85          HG13      ILE  85  86.313   6.503  -5.830
  672   HG21  ILE  85          HG21      ILE  85  85.651   8.683  -7.249
  673   HG22  ILE  85          HG22      ILE  85  86.826   8.677  -8.561
  674   HG23  ILE  85          HG23      ILE  85  86.898   9.926  -7.319
  675   HD11  ILE  85          HD11      ILE  85  86.355   5.123  -8.054
  676   HD12  ILE  85          HD12      ILE  85  86.921   6.632  -8.769
  677   HD13  ILE  85          HD13      ILE  85  85.358   6.573  -7.955
  678    H    LYS  86           H        LYS  86  88.379   9.467  -9.266
  679    HA   LYS  86           HA       LYS  86  90.301  11.585  -8.586
  680    HB2  LYS  86           HB2      LYS  86  90.217  10.561 -10.898
  681    HB3  LYS  86           HB3      LYS  86  88.649  11.344 -11.101
  682    HG2  LYS  86           HG2      LYS  86  89.751  13.534 -10.521
  683    HG3  LYS  86           HG3      LYS  86  91.305  12.698 -10.558
  684    HD2  LYS  86           HD2      LYS  86  91.040  12.140 -12.884
  685    HD3  LYS  86           HD3      LYS  86  89.365  12.693 -12.883
  686    HE2  LYS  86           HE2      LYS  86  91.650  14.547 -12.203
  687    HE3  LYS  86           HE3      LYS  86  91.111  14.306 -13.865
  688    HZ1  LYS  86           HZ1      LYS  86  90.082  16.181 -12.414
  689    HZ2  LYS  86           HZ2      LYS  86  89.126  14.923 -11.791
  690    HZ3  LYS  86           HZ3      LYS  86  89.094  15.273 -13.452
  691    H    LYS  87           H        LYS  87  87.030  11.625 -10.041
  692    HA   LYS  87           HA       LYS  87  86.515  14.215  -8.841
  693    HB2  LYS  87           HB2      LYS  87  84.745  12.433 -10.528
  694    HB3  LYS  87           HB3      LYS  87  84.396  14.103 -10.080
  695    HG2  LYS  87           HG2      LYS  87  86.421  14.862 -11.247
  696    HG3  LYS  87           HG3      LYS  87  86.819  13.194 -11.662
  697    HD2  LYS  87           HD2      LYS  87  85.740  13.862 -13.609
  698    HD3  LYS  87           HD3      LYS  87  84.379  13.204 -12.702
  699    HE2  LYS  87           HE2      LYS  87  83.949  15.536 -11.825
  700    HE3  LYS  87           HE3      LYS  87  85.171  16.118 -12.956
  701    HZ1  LYS  87           HZ1      LYS  87  83.904  15.418 -14.782
  702    HZ2  LYS  87           HZ2      LYS  87  82.793  16.176 -13.743
  703    HZ3  LYS  87           HZ3      LYS  87  82.863  14.481 -13.823
  704    H    LYS  88           H        LYS  88  84.493  14.654  -7.676
  705    HA   LYS  88           HA       LYS  88  84.208  12.904  -5.431
  706    HB2  LYS  88           HB2      LYS  88  83.924  15.431  -5.415
  707    HB3  LYS  88           HB3      LYS  88  82.357  15.171  -6.182
  708    HG2  LYS  88           HG2      LYS  88  81.744  13.645  -4.284
  709    HG3  LYS  88           HG3      LYS  88  83.259  14.086  -3.497
  710    HD2  LYS  88           HD2      LYS  88  81.850  15.643  -2.520
  711    HD3  LYS  88           HD3      LYS  88  82.368  16.560  -3.935
  712    HE2  LYS  88           HE2      LYS  88  80.319  15.503  -5.118
  713    HE3  LYS  88           HE3      LYS  88  79.766  15.097  -3.494
  714    HZ1  LYS  88           HZ1      LYS  88  79.797  17.379  -2.882
  715    HZ2  LYS  88           HZ2      LYS  88  78.945  17.262  -4.347
  716    HZ3  LYS  88           HZ3      LYS  88  80.545  17.833  -4.334
  717    H    THR  89           H        THR  89  81.998  13.853  -8.078
  718    HA   THR  89           HA       THR  89  79.825  12.272  -7.393
  719    HB   THR  89           HB       THR  89  79.292  12.236  -9.825
  720    HG1  THR  89           HG1      THR  89  81.421  13.893 -10.382
  721   HG21  THR  89          HG21      THR  89  80.292  14.926  -8.855
  722   HG22  THR  89          HG22      THR  89  78.782  14.186  -8.325
  723   HG23  THR  89          HG23      THR  89  78.998  14.633 -10.017
  724    H    GLU  90           H        GLU  90  82.908  11.352  -8.721
  725    HA   GLU  90           HA       GLU  90  82.143   8.773  -9.670
  726    HB2  GLU  90           HB2      GLU  90  84.778  10.009  -8.883
  727    HB3  GLU  90           HB3      GLU  90  84.662   8.311  -9.337
  728    HG2  GLU  90           HG2      GLU  90  83.912   8.837 -11.525
  729    HG3  GLU  90           HG3      GLU  90  83.542  10.504 -11.083
  730    H    ARG  91           H        ARG  91  83.227  10.090  -6.600
  731    HA   ARG  91           HA       ARG  91  83.383   7.528  -5.275
  732    HB2  ARG  91           HB2      ARG  91  83.199  10.291  -4.045
  733    HB3  ARG  91           HB3      ARG  91  83.753   8.816  -3.254
  734    HG2  ARG  91           HG2      ARG  91  85.604   8.664  -4.909
  735    HG3  ARG  91           HG3      ARG  91  85.081  10.199  -5.599
  736    HD2  ARG  91           HD2      ARG  91  85.249  10.777  -2.897
  737    HD3  ARG  91           HD3      ARG  91  86.609   9.684  -3.143
  738    HE   ARG  91           HE       ARG  91  86.892  11.401  -5.206
  739   HH11  ARG  91          HH21      ARG  91  86.322  11.845  -1.815
  740   HH12  ARG  91          HH22      ARG  91  87.119  13.379  -1.747
  741   HH21  ARG  91          HH11      ARG  91  87.937  13.410  -5.115
  742   HH22  ARG  91          HH12      ARG  91  88.033  14.265  -3.611
  743    H    GLU  92           H        GLU  92  81.127  10.292  -5.217
  744    HA   GLU  92           HA       GLU  92  79.277   9.219  -3.403
  745    HB2  GLU  92           HB2      GLU  92  79.286  11.582  -4.231
  746    HB3  GLU  92           HB3      GLU  92  78.653  11.002  -5.771
  747    HG2  GLU  92           HG2      GLU  92  76.679  10.086  -4.644
  748    HG3  GLU  92           HG3      GLU  92  77.317  10.593  -3.081
  749    H    ASP  93           H        ASP  93  79.240   9.142  -6.975
  750    HA   ASP  93           HA       ASP  93  76.972   7.506  -7.254
  751    HB2  ASP  93           HB2      ASP  93  79.408   7.742  -9.040
  752    HB3  ASP  93           HB1      ASP  93  77.882   6.991  -9.504
  753    H    LEU  94           H        LEU  94  80.431   6.634  -7.255
  754    HA   LEU  94           HA       LEU  94  80.163   3.863  -7.470
  755    HB2  LEU  94           HB2      LEU  94  82.340   4.939  -7.656
  756    HB3  LEU  94           HB3      LEU  94  82.233   5.497  -5.988
  757    HG   LEU  94           HG       LEU  94  82.298   3.227  -5.154
  758   HD11  LEU  94          HD11      LEU  94  81.121   1.925  -6.702
  759   HD12  LEU  94          HD12      LEU  94  82.785   1.416  -6.975
  760   HD13  LEU  94          HD13      LEU  94  82.023   2.566  -8.074
  761   HD21  LEU  94          HD21      LEU  94  84.427   4.509  -6.075
  762   HD22  LEU  94          HD22      LEU  94  84.446   3.190  -7.245
  763   HD23  LEU  94          HD23      LEU  94  84.554   2.842  -5.522
  764    H    ILE  95           H        ILE  95  79.994   5.982  -4.675
  765    HA   ILE  95           HA       ILE  95  79.853   3.853  -2.772
  766    HB   ILE  95           HB       ILE  95  79.380   6.825  -2.602
  767   HG12  ILE  95          HG12      ILE  95  81.428   5.121  -1.177
  768   HG13  ILE  95          HG13      ILE  95  81.689   5.669  -2.827
  769   HG21  ILE  95          HG21      ILE  95  77.924   6.119  -0.917
  770   HG22  ILE  95          HG22      ILE  95  79.447   6.197  -0.032
  771   HG23  ILE  95          HG23      ILE  95  78.838   4.644  -0.605
  772   HD11  ILE  95          HD11      ILE  95  80.899   7.641  -0.706
  773   HD12  ILE  95          HD12      ILE  95  81.771   7.922  -2.212
  774   HD13  ILE  95          HD13      ILE  95  82.579   7.136  -0.860
  775    H    ALA  96           H        ALA  96  77.584   5.708  -4.650
  776    HA   ALA  96           HA       ALA  96  75.245   5.104  -3.156
  777    HB1  ALA  96           HB1      ALA  96  75.332   5.565  -6.135
  778    HB2  ALA  96           HB2      ALA  96  75.542   6.880  -4.979
  779    HB3  ALA  96           HB3      ALA  96  74.038   5.959  -5.003
  780    H    TYR  97           H        TYR  97  77.055   3.462  -5.673
  781    HA   TYR  97           HA       TYR  97  75.083   1.409  -6.104
  782    HB2  TYR  97           HB2      TYR  97  76.612   1.857  -7.907
  783    HB3  TYR  97           HB3      TYR  97  78.007   1.629  -6.854
  784    HD1  TYR  97           HD1      TYR  97  75.096  -0.121  -8.385
  785    HD2  TYR  97           HD2      TYR  97  78.898  -0.541  -6.434
  786    HE1  TYR  97           HE1      TYR  97  75.090  -2.545  -8.897
  787    HE2  TYR  97           HE2      TYR  97  78.891  -2.966  -6.945
  788    HH   TYR  97           HH       TYR  97  77.879  -4.515  -8.492
  789    H    LEU  98           H        LEU  98  77.924   1.886  -4.100
  790    HA   LEU  98           HA       LEU  98  78.290  -0.744  -3.171
  791    HB2  LEU  98           HB2      LEU  98  78.857   1.965  -1.985
  792    HB3  LEU  98           HB3      LEU  98  79.216   0.490  -1.094
  793    HG   LEU  98           HG       LEU  98  80.211   0.947  -3.915
  794   HD11  LEU  98          HD11      LEU  98  81.043   2.285  -1.488
  795   HD12  LEU  98          HD12      LEU  98  81.636   2.499  -3.133
  796   HD13  LEU  98          HD13      LEU  98  82.347   1.268  -2.096
  797   HD21  LEU  98          HD21      LEU  98  81.007  -1.144  -3.655
  798   HD22  LEU  98          HD22      LEU  98  80.325  -1.232  -2.033
  799   HD23  LEU  98          HD23      LEU  98  81.957  -0.609  -2.272
  800    H    LYS  99           H        LYS  99  76.274   1.926  -2.000
  801    HA   LYS  99           HA       LYS  99  75.287   0.673   0.322
  802    HB2  LYS  99           HB2      LYS  99  74.092   2.837  -1.418
  803    HB3  LYS  99           HB3      LYS  99  73.449   2.360   0.154
  804    HG2  LYS  99           HG2      LYS  99  75.463   3.023   1.277
  805    HG3  LYS  99           HG3      LYS  99  76.320   3.225  -0.250
  806    HD2  LYS  99           HD2      LYS  99  75.675   5.420   0.572
  807    HD3  LYS  99           HD3      LYS  99  74.713   5.045  -0.857
  808    HE2  LYS  99           HE2      LYS  99  72.780   4.578   0.420
  809    HE3  LYS  99           HE3      LYS  99  73.702   4.407   1.914
  810    HZ1  LYS  99           HZ1      LYS  99  74.102   6.714   1.988
  811    HZ2  LYS  99           HZ2      LYS  99  72.448   6.544   1.646
  812    HZ3  LYS  99           HZ3      LYS  99  73.537   6.953   0.407
  813    H    LYS 100           H        LYS 100  73.805   0.990  -2.912
  814    HA   LYS 100           HA       LYS 100  71.568  -0.670  -2.241
  815    HB2  LYS 100           HB2      LYS 100  72.648   0.392  -4.851
  816    HB3  LYS 100           HB3      LYS 100  71.218  -0.638  -4.764
  817    HG2  LYS 100           HG2      LYS 100  70.128   0.967  -3.258
  818    HG3  LYS 100           HG3      LYS 100  71.565   1.990  -3.289
  819    HD2  LYS 100           HD2      LYS 100  71.297   2.402  -5.662
  820    HD3  LYS 100           HD3      LYS 100  69.976   1.237  -5.757
  821    HE2  LYS 100           HE2      LYS 100  69.939   3.781  -4.106
  822    HE3  LYS 100           HE3      LYS 100  69.132   3.567  -5.659
  823    HZ1  LYS 100           HZ1      LYS 100  67.495   3.129  -4.084
  824    HZ2  LYS 100           HZ2      LYS 100  68.545   2.244  -3.084
  825    HZ3  LYS 100           HZ3      LYS 100  68.014   1.585  -4.557
  826    H    ALA 101           H        ALA 101  74.786  -1.279  -3.329
  827    HA   ALA 101           HA       ALA 101  74.172  -3.923  -4.383
  828    HB1  ALA 101           HB1      ALA 101  76.812  -2.519  -3.910
  829    HB2  ALA 101           HB2      ALA 101  75.945  -2.623  -5.443
  830    HB3  ALA 101           HB3      ALA 101  76.621  -4.079  -4.711
  831    H    THR 102           H        THR 102  75.337  -2.458  -1.440
  832    HA   THR 102           HA       THR 102  76.133  -5.022  -0.292
  833    HB   THR 102           HB       THR 102  76.657  -3.604   1.718
  834    HG1  THR 102           HG1      THR 102  75.348  -1.795   0.120
  835   HG21  THR 102          HG21      THR 102  77.823  -2.964  -0.991
  836   HG22  THR 102          HG22      THR 102  78.453  -4.062   0.234
  837   HG23  THR 102          HG23      THR 102  78.507  -2.318   0.500
  838    H    ASN 103           H        ASN 103  73.316  -3.410  -0.797
  839    HA   ASN 103           HA       ASN 103  72.046  -4.157   1.741
  840    HB2  ASN 103           HB2      ASN 103  71.263  -2.460  -0.612
  841    HB3  ASN 103           HB1      ASN 103  70.041  -3.041   0.512
  842   HD21  ASN 103          HD21      ASN 103  73.294  -2.349   1.657
  843   HD22  ASN 103          HD22      ASN 103  72.883  -0.951   2.525
  844    H    GLU 104           H        GLU 104  72.338  -5.142  -1.565
  845    HA   GLU 104           HA       GLU 104  70.700  -7.510  -1.008
  846    HB2  GLU 104           HB2      GLU 104  69.592  -7.224  -3.277
  847    HB3  GLU 104           HB3      GLU 104  69.049  -6.115  -2.018
  848    HG2  GLU 104           HG2      GLU 104  70.319  -4.315  -2.903
  849    HG3  GLU 104           HG3      GLU 104  71.279  -5.388  -3.921
  850    HHA  HEC 201           HA       HEC 105  89.465  -3.468   3.126
  851    HHB  HEC 201           HB       HEC 105  85.596  -0.017  -0.495
  852    HHC  HEC 201           HC       HEC 105  88.913  -1.719  -5.612
  853    HHD  HEC 201           HD       HEC 105  92.267  -5.745  -2.068
  854   HMA1  HEC 201          HMA1      HEC 105  85.825   0.867   2.240
  855   HMA2  HEC 201          HMA2      HEC 105  85.217  -0.465   3.222
  856   HMA3  HEC 201          HMA3      HEC 105  84.673  -0.281   1.558
  857   HAA1  HEC 201          HAA1      HEC 105  87.105  -0.857   4.414
  858   HAA2  HEC 201          HAA2      HEC 105  88.517  -1.893   4.369
  859   HBA1  HEC 201          HBA1      HEC 105  87.293  -3.817   4.687
  860   HBA2  HEC 201          HBA2      HEC 105  85.851  -3.161   3.918
  861   HMB1  HEC 201          HMB1      HEC 105  85.064   1.377  -2.220
  862   HMB2  HEC 201          HMB2      HEC 105  84.155   0.067  -2.971
  863   HMB3  HEC 201          HMB3      HEC 105  84.947   1.277  -3.973
  864    HAB  HEC 201           HAB      HEC 105  87.411  -0.522  -6.264
  865   HBB1  HEC 201          HBB1      HEC 105  86.391   1.908  -6.539
  866   HBB2  HEC 201          HBB2      HEC 105  86.789   2.029  -4.827
  867   HBB3  HEC 201          HBB3      HEC 105  88.055   1.686  -5.999
  868   HMC1  HEC 201          HMC1      HEC 105  91.323  -4.270  -6.986
  869   HMC2  HEC 201          HMC2      HEC 105  91.413  -2.530  -6.723
  870   HMC3  HEC 201          HMC3      HEC 105  89.850  -3.306  -6.965
  871    HAC  HEC 201           HAC      HEC 105  92.694  -6.172  -4.001
  872   HBC1  HEC 201          HBC1      HEC 105  94.415  -5.481  -5.293
  873   HBC2  HEC 201          HBC2      HEC 105  93.539  -3.972  -5.550
  874   HBC3  HEC 201          HBC3      HEC 105  93.359  -5.302  -6.693
  875   HMD1  HEC 201          HMD1      HEC 105  93.754  -6.079   0.284
  876   HMD2  HEC 201          HMD2      HEC 105  92.555  -7.231  -0.296
  877   HMD3  HEC 201          HMD3      HEC 105  92.841  -7.056   1.431
  878   HAD1  HEC 201          HAD1      HEC 105  92.001  -6.268   3.108
  879   HAD2  HEC 201          HAD2      HEC 105  90.507  -5.506   3.608
  880   HBD1  HEC 201          HBD1      HEC 105  91.702  -3.340   3.804
  881   HBD2  HEC 201          HBD2      HEC 105  93.203  -4.156   3.375
  882    H1   HOH 301           H2       HOH 200  82.715   3.504  -1.706
  883    H2   HOH 301           H1       HOH 200  83.908   2.823  -1.068
  884    H1   HOH 302           H2       HOH 201  86.534   4.671   6.221
  885    H2   HOH 302           H1       HOH 201  85.976   5.549   5.122
  886    H1   HOH 303           H2       HOH 202  83.118  -5.079   6.466
  887    H2   HOH 303           H1       HOH 202  83.348  -4.841   4.990
  888    H1   HOH 304           H2       HOH 203  81.085 -10.543  -0.010
  889    H2   HOH 304           H1       HOH 203  82.489 -10.886   0.428
  Start of MODEL   22
    1    H1   GLY   1           H1       GLY   1  73.851  11.891  -6.958
    2    H2   GLY   1           H2       GLY   1  73.249  11.148  -5.554
    3    H3   GLY   1           H3       GLY   1  72.422  10.981  -7.030
    4    HA2  GLY   1           HA2      GLY   1  75.171  10.114  -7.130
    5    HA3  GLY   1           HA3      GLY   1  74.154   9.179  -6.032
    6    H    ASP   2           H        ASP   2  75.277   8.203  -8.476
    7    HA   ASP   2           HA       ASP   2  72.792   7.604  -9.967
    8    HB2  ASP   2           HB2      ASP   2  75.533   8.135 -11.131
    9    HB3  ASP   2           HB1      ASP   2  74.152   7.524 -12.040
   10    H    VAL   3           H        VAL   3  72.616   5.673  -8.755
   11    HA   VAL   3           HA       VAL   3  74.521   3.748  -8.277
   12    HB   VAL   3           HB       VAL   3  72.256   3.552  -7.418
   13   HG11  VAL   3          HG11      VAL   3  71.480   3.074 -10.311
   14   HG12  VAL   3          HG12      VAL   3  71.074   4.501  -9.357
   15   HG13  VAL   3          HG13      VAL   3  70.396   2.930  -8.928
   16   HG21  VAL   3          HG21      VAL   3  72.730   1.251  -9.330
   17   HG22  VAL   3          HG22      VAL   3  71.936   1.194  -7.757
   18   HG23  VAL   3          HG23      VAL   3  73.671   1.485  -7.858
   19    H    GLU   4           H        GLU   4  73.306   4.802 -11.304
   20    HA   GLU   4           HA       GLU   4  73.800   2.387 -12.778
   21    HB2  GLU   4           HB2      GLU   4  73.414   5.262 -13.626
   22    HB3  GLU   4           HB3      GLU   4  73.639   3.935 -14.768
   23    HG2  GLU   4           HG2      GLU   4  71.484   3.952 -12.641
   24    HG3  GLU   4           HG3      GLU   4  71.221   4.515 -14.289
   25    H    LYS   5           H        LYS   5  75.494   5.538 -12.745
   26    HA   LYS   5           HA       LYS   5  77.788   4.454 -14.093
   27    HB2  LYS   5           HB2      LYS   5  77.217   7.081 -12.719
   28    HB3  LYS   5           HB3      LYS   5  78.812   6.699 -13.369
   29    HG2  LYS   5           HG2      LYS   5  77.987   6.518 -15.588
   30    HG3  LYS   5           HG3      LYS   5  76.311   6.438 -15.046
   31    HD2  LYS   5           HD2      LYS   5  77.933   8.874 -14.368
   32    HD3  LYS   5           HD3      LYS   5  77.302   8.702 -16.006
   33    HE2  LYS   5           HE2      LYS   5  75.020   8.355 -15.053
   34    HE3  LYS   5           HE3      LYS   5  75.678   8.651 -13.444
   35    HZ1  LYS   5           HZ1      LYS   5  75.832  10.840 -13.817
   36    HZ2  LYS   5           HZ2      LYS   5  74.690  10.554 -15.041
   37    HZ3  LYS   5           HZ3      LYS   5  76.342  10.651 -15.423
   38    H    GLY   6           H        GLY   6  76.688   4.555 -10.865
   39    HA2  GLY   6           HA2      GLY   6  79.241   4.428  -9.556
   40    HA3  GLY   6           HA3      GLY   6  77.680   4.007  -8.845
   41    H    LYS   7           H        LYS   7  76.916   2.163 -10.877
   42    HA   LYS   7           HA       LYS   7  78.134  -0.216  -9.884
   43    HB2  LYS   7           HB2      LYS   7  75.764  -0.023 -10.718
   44    HB3  LYS   7           HB3      LYS   7  76.412   0.091 -12.353
   45    HG2  LYS   7           HG2      LYS   7  77.661  -2.103 -11.818
   46    HG3  LYS   7           HG3      LYS   7  76.578  -2.235 -10.437
   47    HD2  LYS   7           HD2      LYS   7  75.343  -3.390 -12.025
   48    HD3  LYS   7           HD3      LYS   7  74.713  -1.762 -12.271
   49    HE2  LYS   7           HE2      LYS   7  76.619  -1.503 -14.008
   50    HE3  LYS   7           HE3      LYS   7  76.739  -3.261 -13.931
   51    HZ1  LYS   7           HZ1      LYS   7  75.250  -2.626 -15.687
   52    HZ2  LYS   7           HZ2      LYS   7  74.317  -1.687 -14.620
   53    HZ3  LYS   7           HZ3      LYS   7  74.360  -3.377 -14.454
   54    H    LYS   8           H        LYS   8  78.393   1.660 -12.886
   55    HA   LYS   8           HA       LYS   8  80.015  -0.113 -14.334
   56    HB2  LYS   8           HB2      LYS   8  78.965   1.824 -15.375
   57    HB3  LYS   8           HB3      LYS   8  79.943   2.912 -14.393
   58    HG2  LYS   8           HG2      LYS   8  81.495   0.896 -15.910
   59    HG3  LYS   8           HG3      LYS   8  80.637   2.063 -16.912
   60    HD2  LYS   8           HD2      LYS   8  82.251   3.016 -14.554
   61    HD3  LYS   8           HD3      LYS   8  83.053   2.636 -16.077
   62    HE2  LYS   8           HE2      LYS   8  80.631   4.427 -16.036
   63    HE3  LYS   8           HE3      LYS   8  82.233   5.077 -15.690
   64    HZ1  LYS   8           HZ1      LYS   8  82.939   3.947 -17.822
   65    HZ2  LYS   8           HZ2      LYS   8  81.949   5.317 -17.983
   66    HZ3  LYS   8           HZ3      LYS   8  81.288   3.763 -18.165
   67    H    ILE   9           H        ILE   9  80.966   2.646 -12.287
   68    HA   ILE   9           HA       ILE   9  83.747   2.261 -12.534
   69    HB   ILE   9           HB       ILE   9  82.188   3.511 -10.261
   70   HG12  ILE   9          HG12      ILE   9  83.569   4.914 -12.556
   71   HG13  ILE   9          HG13      ILE   9  81.884   4.404 -12.666
   72   HG21  ILE   9          HG21      ILE   9  84.350   4.752  -9.916
   73   HG22  ILE   9          HG22      ILE   9  85.101   3.670 -11.088
   74   HG23  ILE   9          HG23      ILE   9  84.464   3.026  -9.575
   75   HD11  ILE   9          HD11      ILE   9  82.175   6.777 -11.875
   76   HD12  ILE   9          HD12      ILE   9  82.975   6.142 -10.437
   77   HD13  ILE   9          HD13      ILE   9  81.283   5.753 -10.748
   78    H    PHE  10           H        PHE  10  81.345   0.710 -10.550
   79    HA   PHE  10           HA       PHE  10  83.193  -0.344  -8.619
   80    HB2  PHE  10           HB2      PHE  10  81.057  -0.215  -7.742
   81    HB3  PHE  10           HB1      PHE  10  80.295  -0.733  -9.244
   82    HD1  PHE  10           HD1      PHE  10  80.230  -3.105  -9.878
   83    HD2  PHE  10           HD2      PHE  10  81.949  -1.833  -6.157
   84    HE1  PHE  10           HE1      PHE  10  80.193  -5.445  -9.068
   85    HE2  PHE  10           HE2      PHE  10  81.913  -4.177  -5.342
   86    HZ   PHE  10           HZ       PHE  10  81.036  -5.983  -6.802
   87    H    VAL  11           H        VAL  11  81.387  -1.852 -11.315
   88    HA   VAL  11           HA       VAL  11  82.386  -4.428 -11.050
   89    HB   VAL  11           HB       VAL  11  81.884  -4.704 -13.469
   90   HG11  VAL  11          HG11      VAL  11  79.736  -3.072 -12.119
   91   HG12  VAL  11          HG12      VAL  11  80.147  -4.700 -11.582
   92   HG13  VAL  11          HG13      VAL  11  79.540  -4.436 -13.216
   93   HG21  VAL  11          HG21      VAL  11  81.170  -1.766 -13.344
   94   HG22  VAL  11          HG22      VAL  11  81.069  -2.821 -14.750
   95   HG23  VAL  11          HG23      VAL  11  82.642  -2.377 -14.092
   96    H    GLN  12           H        GLN  12  83.871  -1.597 -12.438
   97    HA   GLN  12           HA       GLN  12  86.068  -3.206 -13.522
   98    HB2  GLN  12           HB2      GLN  12  86.820  -1.164 -14.575
   99    HB3  GLN  12           HB1      GLN  12  85.101  -1.398 -14.884
  100    HG2  GLN  12           HG2      GLN  12  84.602   0.132 -12.964
  101    HG3  GLN  12           HG1      GLN  12  86.331   0.440 -12.816
  102   HE21  GLN  12          HE21      GLN  12  85.865  -0.053 -16.053
  103   HE22  GLN  12          HE22      GLN  12  85.601   1.545 -16.548
  104    H    LYS  13           H        LYS  13  85.436  -1.100 -10.779
  105    HA   LYS  13           HA       LYS  13  88.325  -0.997 -10.202
  106    HB2  LYS  13           HB2      LYS  13  85.984   0.573  -9.158
  107    HB3  LYS  13           HB3      LYS  13  87.549   0.602  -8.358
  108    HG2  LYS  13           HG2      LYS  13  87.819   0.967 -11.247
  109    HG3  LYS  13           HG3      LYS  13  86.785   2.198 -10.527
  110    HD2  LYS  13           HD2      LYS  13  89.509   1.453  -9.432
  111    HD3  LYS  13           HD3      LYS  13  89.241   2.784 -10.557
  112    HE2  LYS  13           HE2      LYS  13  87.360   2.919  -8.344
  113    HE3  LYS  13           HE3      LYS  13  89.022   2.893  -7.757
  114    HZ1  LYS  13           HZ1      LYS  13  88.643   5.118  -8.167
  115    HZ2  LYS  13           HZ2      LYS  13  87.726   4.824  -9.567
  116    HZ3  LYS  13           HZ3      LYS  13  89.413   4.622  -9.595
  117    H    CYS  14           H        CYS  14  85.407  -1.421  -8.148
  118    HA   CYS  14           HA       CYS  14  87.023  -2.760  -6.168
  119    HB2  CYS  14           HB2      CYS  14  84.054  -2.629  -5.984
  120    HB3  CYS  14           HB1      CYS  14  85.261  -2.464  -4.715
  121    H    ALA  15           H        ALA  15  84.512  -3.859  -8.432
  122    HA   ALA  15           HA       ALA  15  83.957  -6.338  -7.383
  123    HB1  ALA  15           HB1      ALA  15  84.249  -5.407 -10.222
  124    HB2  ALA  15           HB2      ALA  15  82.779  -5.800  -9.327
  125    HB3  ALA  15           HB3      ALA  15  83.857  -7.088  -9.864
  126    H    GLN  16           H        GLN  16  86.929  -5.248  -8.823
  127    HA   GLN  16           HA       GLN  16  88.183  -7.552  -9.620
  128    HB2  GLN  16           HB2      GLN  16  89.250  -5.118  -8.210
  129    HB3  GLN  16           HB1      GLN  16  90.312  -6.426  -8.728
  130    HG2  GLN  16           HG2      GLN  16  89.593  -6.167 -11.033
  131    HG3  GLN  16           HG1      GLN  16  88.388  -4.971 -10.561
  132   HE21  GLN  16          HE21      GLN  16  91.853  -5.324  -9.615
  133   HE22  GLN  16          HE22      GLN  16  92.294  -3.762 -10.113
  134    H    CYS  17           H        CYS  17  88.678  -6.210  -6.323
  135    HA   CYS  17           HA       CYS  17  89.042  -8.999  -5.386
  136    HB2  CYS  17           HB2      CYS  17  90.179  -6.829  -3.730
  137    HB3  CYS  17           HB1      CYS  17  90.869  -8.384  -4.184
  138    H    HIS  18           H        HSD  18  86.433  -8.048  -5.434
  139    HA   HIS  18           HA       HSD  18  85.826  -8.121  -2.589
  140    HB2  HIS  18           HB2      HSD  18  85.190  -5.728  -4.300
  141    HB3  HIS  18           HB1      HSD  18  84.218  -6.130  -2.888
  142    HD1  HIS  18           HD1      HSD  18  86.726  -7.210  -1.186
  143    HD2  HIS  18           HD2      HSD  18  86.438  -3.508  -3.078
  144    HE1  HIS  18           HE1      HSD  18  88.345  -5.666   0.006
  145    H    THR  19           H        THR  19  83.257  -7.767  -2.425
  146    HA   THR  19           HA       THR  19  81.942  -9.262  -4.601
  147    HB   THR  19           HB       THR  19  80.830 -10.174  -2.156
  148    HG1  THR  19           HG1      THR  19  83.239 -11.127  -1.787
  149   HG21  THR  19          HG21      THR  19  81.575 -12.336  -2.934
  150   HG22  THR  19          HG22      THR  19  82.805 -11.597  -3.958
  151   HG23  THR  19          HG23      THR  19  81.096 -11.393  -4.343
  152    H    VAL  20           H        VAL  20  81.617  -7.352  -1.647
  153    HA   VAL  20           HA       VAL  20  79.928  -6.026  -0.848
  154    HB   VAL  20           HB       VAL  20  79.249  -4.276  -2.356
  155   HG11  VAL  20          HG11      VAL  20  82.049  -5.204  -3.052
  156   HG12  VAL  20          HG12      VAL  20  81.615  -4.345  -1.576
  157   HG13  VAL  20          HG13      VAL  20  81.442  -3.553  -3.141
  158   HG21  VAL  20          HG21      VAL  20  78.736  -5.930  -4.257
  159   HG22  VAL  20          HG22      VAL  20  80.456  -5.850  -4.630
  160   HG23  VAL  20          HG23      VAL  20  79.468  -4.396  -4.716
  161    H    GLU  21           H        GLU  21  79.127  -8.756  -1.953
  162    HA   GLU  21           HA       GLU  21  76.262  -8.146  -2.402
  163    HB2  GLU  21           HB2      GLU  21  76.222 -10.563  -3.277
  164    HB3  GLU  21           HB3      GLU  21  76.986  -9.344  -4.295
  165    HG2  GLU  21           HG2      GLU  21  79.154 -10.081  -3.770
  166    HG3  GLU  21           HG3      GLU  21  78.622 -10.914  -2.314
  167    H    LYS  22           H        LYS  22  75.160  -8.326  -0.568
  168    HA   LYS  22           HA       LYS  22  75.991  -9.665   1.741
  169    HB2  LYS  22           HB2      LYS  22  74.225  -7.924   1.672
  170    HB3  LYS  22           HB3      LYS  22  73.149  -9.075   0.884
  171    HG2  LYS  22           HG2      LYS  22  74.416 -10.067   3.377
  172    HG3  LYS  22           HG3      LYS  22  73.298  -8.724   3.602
  173    HD2  LYS  22           HD2      LYS  22  72.490 -11.061   1.883
  174    HD3  LYS  22           HD3      LYS  22  72.375 -11.180   3.638
  175    HE2  LYS  22           HE2      LYS  22  70.953  -9.190   3.714
  176    HE3  LYS  22           HE3      LYS  22  71.114  -8.983   1.969
  177    HZ1  LYS  22           HZ1      LYS  22  69.045 -10.135   2.717
  178    HZ2  LYS  22           HZ2      LYS  22  70.013 -11.436   3.221
  179    HZ3  LYS  22           HZ3      LYS  22  69.963 -10.995   1.580
  180    H    GLY  23           H        GLY  23  76.318 -11.764   2.015
  181    HA2  GLY  23           HA2      GLY  23  75.560 -13.985   2.269
  182    HA3  GLY  23           HA3      GLY  23  74.298 -13.676   1.083
  183    H    GLY  24           H        GLY  24  77.385 -12.514   0.196
  184    HA2  GLY  24           HA2      GLY  24  77.598 -14.609  -1.849
  185    HA3  GLY  24           HA3      GLY  24  78.468 -13.081  -1.828
  186    H    LYS  25           H        LYS  25  80.548 -13.771  -1.977
  187    HA   LYS  25           HA       LYS  25  81.640 -15.156   0.360
  188    HB2  LYS  25           HB2      LYS  25  83.017 -16.614  -1.234
  189    HB3  LYS  25           HB3      LYS  25  81.325 -17.053  -1.016
  190    HG2  LYS  25           HG2      LYS  25  81.871 -15.112  -3.203
  191    HG3  LYS  25           HG3      LYS  25  82.483 -16.745  -3.460
  192    HD2  LYS  25           HD2      LYS  25  80.248 -17.671  -3.032
  193    HD3  LYS  25           HD3      LYS  25  79.623 -16.050  -2.729
  194    HE2  LYS  25           HE2      LYS  25  80.085 -15.375  -5.007
  195    HE3  LYS  25           HE3      LYS  25  80.917 -16.896  -5.334
  196    HZ1  LYS  25           HZ1      LYS  25  78.062 -16.695  -4.551
  197    HZ2  LYS  25           HZ2      LYS  25  78.887 -18.090  -5.059
  198    HZ3  LYS  25           HZ3      LYS  25  78.600 -16.823  -6.155
  199    H    HIS  26           H        HIS  26  83.266 -13.948   1.049
  200    HA   HIS  26           HA       HIS  26  84.411 -11.796  -0.293
  201    HB2  HIS  26           HB2      HIS  26  86.390 -12.363   1.405
  202    HB3  HIS  26           HB1      HIS  26  84.849 -11.714   1.969
  203    HD1  HIS  26           HD1      HIS  26  85.922 -15.261   1.019
  204    HD2  HIS  26           HD2      HIS  26  84.141 -13.202   4.177
  205    HE1  HIS  26           HE1      HIS  26  85.326 -16.999   2.762
  206    HE2  HIS  26           HE2      HIS  26  84.240 -15.760   4.694
  207    H    LYS  27           H        LYS  27  85.848 -11.626  -1.891
  208    HA   LYS  27           HA       LYS  27  87.552 -13.967  -2.532
  209    HB2  LYS  27           HB2      LYS  27  85.683 -13.476  -4.182
  210    HB3  LYS  27           HB3      LYS  27  86.513 -11.960  -4.537
  211    HG2  LYS  27           HG2      LYS  27  88.613 -13.458  -4.905
  212    HG3  LYS  27           HG3      LYS  27  87.454 -14.782  -5.030
  213    HD2  LYS  27           HD2      LYS  27  87.557 -12.283  -6.742
  214    HD3  LYS  27           HD3      LYS  27  87.868 -13.939  -7.261
  215    HE2  LYS  27           HE2      LYS  27  85.654 -13.650  -7.943
  216    HE3  LYS  27           HE3      LYS  27  85.433 -14.376  -6.351
  217    HZ1  LYS  27           HZ1      LYS  27  85.711 -11.512  -6.299
  218    HZ2  LYS  27           HZ2      LYS  27  84.560 -12.506  -5.543
  219    HZ3  LYS  27           HZ3      LYS  27  84.349 -12.040  -7.162
  220    H    THR  28           H        THR  28  89.671 -13.585  -2.456
  221    HA   THR  28           HA       THR  28  91.612 -12.399  -2.006
  222    HB   THR  28           HB       THR  28  90.642 -10.773  -4.364
  223    HG1  THR  28           HG1      THR  28  91.283 -13.426  -4.105
  224   HG21  THR  28          HG21      THR  28  93.234 -11.116  -4.819
  225   HG22  THR  28          HG22      THR  28  93.290 -11.328  -3.071
  226   HG23  THR  28          HG23      THR  28  92.672  -9.826  -3.757
  227    H    GLY  29           H        GLY  29  89.160 -11.415  -0.669
  228    HA2  GLY  29           HA2      GLY  29  90.131  -9.248   0.721
  229    HA3  GLY  29           HA3      GLY  29  89.226  -8.553  -0.621
  230    HA   PRO  30           HA       PRO  30  86.438 -10.113   2.957
  231    HB2  PRO  30           HB2      PRO  30  86.018  -7.757   4.297
  232    HB3  PRO  30           HB1      PRO  30  87.303  -8.904   4.718
  233    HG2  PRO  30           HG2      PRO  30  87.463  -6.378   3.144
  234    HG3  PRO  30           HG1      PRO  30  88.588  -7.031   4.349
  235    HD2  PRO  30           HD2      PRO  30  89.036  -7.225   1.659
  236    HD3  PRO  30           HD1      PRO  30  89.623  -8.434   2.823
  237    H    ASN  31           H        ASN  31  84.194  -9.089   3.508
  238    HA   ASN  31           HA       ASN  31  83.054  -8.081   0.984
  239    HB2  ASN  31           HB2      ASN  31  80.975  -8.959   1.725
  240    HB3  ASN  31           HB1      ASN  31  82.174 -10.178   2.158
  241   HD21  ASN  31          HD21      ASN  31  82.317 -10.755   4.352
  242   HD22  ASN  31          HD22      ASN  31  81.509  -9.940   5.603
  243    H    LEU  32           H        LEU  32  81.360  -6.415   1.136
  244    HA   LEU  32           HA       LEU  32  81.896  -4.512   3.345
  245    HB2  LEU  32           HB2      LEU  32  80.883  -3.810   0.583
  246    HB3  LEU  32           HB3      LEU  32  81.425  -2.702   1.838
  247    HG   LEU  32           HG       LEU  32  83.099  -4.624   0.206
  248   HD11  LEU  32          HD11      LEU  32  82.988  -1.624   0.593
  249   HD12  LEU  32          HD12      LEU  32  82.810  -2.536  -0.906
  250   HD13  LEU  32          HD13      LEU  32  84.386  -2.424  -0.125
  251   HD21  LEU  32          HD21      LEU  32  83.686  -3.285   2.836
  252   HD22  LEU  32          HD22      LEU  32  84.984  -3.515   1.671
  253   HD23  LEU  32          HD23      LEU  32  84.110  -4.906   2.300
  254    H    HIS  33           H        HIS  33  80.003  -6.591   3.612
  255    HA   HIS  33           HA       HIS  33  77.360  -5.769   2.964
  256    HB2  HIS  33           HB2      HIS  33  78.280  -7.570   5.219
  257    HB3  HIS  33           HB1      HIS  33  76.650  -7.478   4.555
  258    HD1  HIS  33           HD1      HIS  33  78.440 -10.089   4.470
  259    HD2  HIS  33           HD2      HIS  33  77.976  -7.388   1.327
  260    HE1  HIS  33           HE1      HIS  33  78.975 -11.362   2.346
  261    HE2  HIS  33           HE2      HIS  33  78.688  -9.733   0.421
  262    H    GLY  34           H        GLY  34  75.826  -4.655   4.163
  263    HA2  GLY  34           HA2      GLY  34  75.257  -2.791   5.459
  264    HA3  GLY  34           HA3      GLY  34  75.643  -3.935   6.745
  265    H    LEU  35           H        LEU  35  77.980  -2.717   4.464
  266    HA   LEU  35           HA       LEU  35  79.980  -2.101   6.234
  267    HB2  LEU  35           HB2      LEU  35  80.339  -2.190   3.839
  268    HB3  LEU  35           HB3      LEU  35  79.301  -0.791   3.596
  269    HG   LEU  35           HG       LEU  35  81.052   0.310   5.321
  270   HD11  LEU  35          HD11      LEU  35  82.869  -1.482   3.740
  271   HD12  LEU  35          HD12      LEU  35  82.246  -2.016   5.300
  272   HD13  LEU  35          HD13      LEU  35  83.223  -0.552   5.193
  273   HD21  LEU  35          HD21      LEU  35  80.465   1.001   2.951
  274   HD22  LEU  35          HD22      LEU  35  81.755  -0.068   2.402
  275   HD23  LEU  35          HD23      LEU  35  82.133   1.317   3.426
  276    H    PHE  36           H        PHE  36  77.759   0.296   4.800
  277    HA   PHE  36           HA       PHE  36  78.614   2.495   6.269
  278    HB2  PHE  36           HB2      PHE  36  75.758   2.021   5.394
  279    HB3  PHE  36           HB1      PHE  36  76.566   3.570   5.632
  280    HD1  PHE  36           HD2      PHE  36  76.576   0.477   3.548
  281    HD2  PHE  36           HD1      PHE  36  77.868   4.565   3.887
  282    HE1  PHE  36           HE2      PHE  36  77.370   0.424   1.203
  283    HE2  PHE  36           HE1      PHE  36  78.651   4.509   1.546
  284    HZ   PHE  36           HZ       PHE  36  78.404   2.442   0.198
  285    H    GLY  37           H        GLY  37  78.988   1.949   8.453
  286    HA2  GLY  37           HA2      GLY  37  77.464   2.691  10.434
  287    HA3  GLY  37           HA3      GLY  37  76.628   1.195  10.050
  288    H    ARG  38           H        ARG  38  79.285  -0.111   9.362
  289    HA   ARG  38           HA       ARG  38  79.898  -0.890  12.119
  290    HB2  ARG  38           HB2      ARG  38  80.121  -2.133   9.463
  291    HB3  ARG  38           HB3      ARG  38  81.490  -2.457  10.524
  292    HG2  ARG  38           HG2      ARG  38  79.828  -3.125  12.314
  293    HG3  ARG  38           HG3      ARG  38  78.568  -3.016  11.086
  294    HD2  ARG  38           HD2      ARG  38  81.005  -4.643  10.471
  295    HD3  ARG  38           HD3      ARG  38  79.812  -5.319  11.572
  296    HE   ARG  38           HE       ARG  38  78.222  -4.605   9.569
  297   HH11  ARG  38          HH21      ARG  38  81.360  -6.093   9.507
  298   HH12  ARG  38          HH22      ARG  38  81.075  -6.932   8.020
  299   HH21  ARG  38          HH11      ARG  38  77.853  -5.720   7.634
  300   HH22  ARG  38          HH12      ARG  38  79.092  -6.729   6.968
  301    H    LYS  39           H        LYS  39  81.923  -0.840  13.058
  302    HA   LYS  39           HA       LYS  39  83.601   1.345  12.404
  303    HB2  LYS  39           HB2      LYS  39  83.756  -0.933  14.341
  304    HB3  LYS  39           HB3      LYS  39  85.169   0.089  14.088
  305    HG2  LYS  39           HG2      LYS  39  82.506   1.389  14.577
  306    HG3  LYS  39           HG3      LYS  39  83.390   0.715  15.944
  307    HD2  LYS  39           HD2      LYS  39  85.389   2.064  15.258
  308    HD3  LYS  39           HD3      LYS  39  84.405   2.813  14.000
  309    HE2  LYS  39           HE2      LYS  39  84.195   3.093  16.984
  310    HE3  LYS  39           HE3      LYS  39  84.181   4.349  15.745
  311    HZ1  LYS  39           HZ1      LYS  39  82.016   2.500  16.523
  312    HZ2  LYS  39           HZ2      LYS  39  82.016   3.251  14.999
  313    HZ3  LYS  39           HZ3      LYS  39  81.979   4.192  16.414
  314    H    THR  40           H        THR  40  86.047   1.040  12.159
  315    HA   THR  40           HA       THR  40  86.538  -0.318   9.713
  316    HB   THR  40           HB       THR  40  88.941   0.344  10.188
  317    HG1  THR  40           HG1      THR  40  87.800   1.831  12.287
  318   HG21  THR  40          HG21      THR  40  86.652   2.306  10.175
  319   HG22  THR  40          HG22      THR  40  87.674   1.811   8.827
  320   HG23  THR  40          HG23      THR  40  88.330   2.843  10.098
  321    H    GLY  41           H        GLY  41  87.721  -2.129   9.242
  322    HA2  GLY  41           HA2      GLY  41  88.396  -4.304   9.541
  323    HA3  GLY  41           HA3      GLY  41  89.332  -3.651  10.882
  324    H    GLN  42           H        GLN  42  85.833  -4.126  10.341
  325    HA   GLN  42           HA       GLN  42  85.737  -5.561  12.934
  326    HB2  GLN  42           HB2      GLN  42  84.503  -3.342  12.723
  327    HB3  GLN  42           HB1      GLN  42  83.411  -4.171  11.612
  328    HG2  GLN  42           HG2      GLN  42  82.900  -5.843  13.345
  329    HG3  GLN  42           HG1      GLN  42  84.006  -5.039  14.457
  330   HE21  GLN  42          HE21      GLN  42  82.522  -2.664  12.582
  331   HE22  GLN  42          HE22      GLN  42  81.261  -2.256  13.640
  332    H    ALA  43           H        ALA  43  85.128  -5.796   9.547
  333    HA   ALA  43           HA       ALA  43  83.123  -7.774   9.550
  334    HB1  ALA  43           HB1      ALA  43  84.902  -8.185   7.344
  335    HB2  ALA  43           HB2      ALA  43  84.744  -6.452   7.628
  336    HB3  ALA  43           HB3      ALA  43  83.308  -7.433   7.345
  337    HA   PRO  44           HA       PRO  44  85.748 -11.078  11.105
  338    HB2  PRO  44           HB2      PRO  44  83.850 -12.987  11.349
  339    HB3  PRO  44           HB1      PRO  44  83.926 -11.597  12.451
  340    HG2  PRO  44           HG2      PRO  44  82.137 -12.060  10.111
  341    HG3  PRO  44           HG1      PRO  44  81.764 -11.354  11.693
  342    HD2  PRO  44           HD2      PRO  44  82.235  -9.862   9.408
  343    HD3  PRO  44           HD1      PRO  44  82.461  -9.253  11.064
  344    H    GLY  45           H        GLY  45  87.037 -11.440   9.235
  345    HA2  GLY  45           HA2      GLY  45  86.648 -13.892   7.897
  346    HA3  GLY  45           HA3      GLY  45  86.162 -12.582   6.825
  347    H    PHE  46           H        PHE  46  87.752 -10.938   6.301
  348    HA   PHE  46           HA       PHE  46  90.311 -12.067   5.725
  349    HB2  PHE  46           HB2      PHE  46  89.102 -10.358   4.319
  350    HB3  PHE  46           HB1      PHE  46  89.518  -9.157   5.542
  351    HD1  PHE  46           HD2      PHE  46  91.004 -11.694   3.237
  352    HD2  PHE  46           HD1      PHE  46  91.656  -8.144   5.568
  353    HE1  PHE  46           HE2      PHE  46  93.252 -11.440   2.221
  354    HE2  PHE  46           HE1      PHE  46  93.903  -7.890   4.551
  355    HZ   PHE  46           HZ       PHE  46  94.701  -9.537   2.879
  356    H    THR  47           H        THR  47  92.354 -11.407   6.471
  357    HA   THR  47           HA       THR  47  92.457 -10.815   9.282
  358    HB   THR  47           HB       THR  47  94.695 -11.017   7.256
  359    HG1  THR  47           HG1      THR  47  94.439 -13.077   7.455
  360   HG21  THR  47          HG21      THR  47  95.515  -9.887   9.191
  361   HG22  THR  47          HG22      THR  47  96.000 -11.573   9.377
  362   HG23  THR  47          HG23      THR  47  94.616 -10.950  10.276
  363    H    TYR  48           H        TYR  48  91.459  -8.728   9.334
  364    HA   TYR  48           HA       TYR  48  92.330  -6.475   7.911
  365    HB2  TYR  48           HB2      TYR  48  90.880  -6.894  10.495
  366    HB3  TYR  48           HB3      TYR  48  91.420  -5.272  10.077
  367    HD1  TYR  48           HD2      TYR  48  90.948  -4.574   7.562
  368    HD2  TYR  48           HD1      TYR  48  88.771  -7.568   9.732
  369    HE1  TYR  48           HE2      TYR  48  89.034  -4.293   6.017
  370    HE2  TYR  48           HE1      TYR  48  86.852  -7.287   8.188
  371    HH   TYR  48           HH       TYR  48  86.420  -4.717   6.252
  372    H    THR  49           H        THR  49  93.728  -4.797   8.420
  373    HA   THR  49           HA       THR  49  96.094  -5.598   9.888
  374    HB   THR  49           HB       THR  49  97.023  -3.470   9.099
  375    HG1  THR  49           HG1      THR  49  94.530  -2.998   7.867
  376   HG21  THR  49          HG21      THR  49  96.068  -3.914   6.550
  377   HG22  THR  49          HG22      THR  49  95.756  -5.459   7.336
  378   HG23  THR  49          HG23      THR  49  97.393  -4.805   7.298
  379    H    ASP  50           H        ASP  50  97.010  -4.433  11.653
  380    HA   ASP  50           HA       ASP  50  95.365  -3.906  13.792
  381    HB2  ASP  50           HB2      ASP  50  97.893  -2.323  13.473
  382    HB3  ASP  50           HB1      ASP  50  97.241  -3.107  14.911
  383    H    ALA  51           H        ALA  51  96.505  -1.637  11.327
  384    HA   ALA  51           HA       ALA  51  95.546   0.740  12.475
  385    HB1  ALA  51           HB1      ALA  51  97.060   0.516  10.456
  386    HB2  ALA  51           HB2      ALA  51  95.770   1.708  10.302
  387    HB3  ALA  51           HB3      ALA  51  95.616   0.138   9.516
  388    H    ASN  52           H        ASN  52  93.952  -1.669  10.437
  389    HA   ASN  52           HA       ASN  52  91.486  -0.156  10.295
  390    HB2  ASN  52           HB2      ASN  52  92.618  -2.548   9.062
  391    HB3  ASN  52           HB1      ASN  52  90.940  -2.790   9.531
  392   HD21  ASN  52          HD21      ASN  52  90.312  -2.782   7.228
  393   HD22  ASN  52          HD22      ASN  52  90.238  -1.321   6.365
  394    H    LYS  53           H        LYS  53  92.895  -2.583  12.328
  395    HA   LYS  53           HA       LYS  53  90.372  -3.311  13.576
  396    HB2  LYS  53           HB2      LYS  53  91.682  -5.183  13.676
  397    HB3  LYS  53           HB3      LYS  53  93.179  -4.260  13.633
  398    HG2  LYS  53           HG2      LYS  53  92.942  -3.685  15.995
  399    HG3  LYS  53           HG3      LYS  53  91.372  -4.490  16.057
  400    HD2  LYS  53           HD2      LYS  53  92.679  -6.588  15.227
  401    HD3  LYS  53           HD3      LYS  53  94.111  -5.712  15.766
  402    HE2  LYS  53           HE2      LYS  53  91.761  -6.651  17.410
  403    HE3  LYS  53           HE3      LYS  53  93.474  -6.985  17.656
  404    HZ1  LYS  53           HZ1      LYS  53  93.455  -4.326  17.779
  405    HZ2  LYS  53           HZ2      LYS  53  93.291  -5.329  19.140
  406    HZ3  LYS  53           HZ3      LYS  53  91.914  -4.658  18.404
  407    H    ASN  54           H        ASN  54  92.656  -0.862  13.790
  408    HA   ASN  54           HA       ASN  54  92.730  -0.369  16.577
  409    HB2  ASN  54           HB2      ASN  54  93.819   1.588  16.022
  410    HB3  ASN  54           HB1      ASN  54  94.113   0.640  14.570
  411   HD21  ASN  54          HD21      ASN  54  91.446   0.904  13.433
  412   HD22  ASN  54          HD22      ASN  54  91.246   2.527  12.980
  413    H    LYS  55           H        LYS  55  90.324   0.034  14.203
  414    HA   LYS  55           HA       LYS  55  88.210   0.962  14.229
  415    HB2  LYS  55           HB2      LYS  55  88.624   0.553  17.197
  416    HB3  LYS  55           HB3      LYS  55  87.081   0.982  16.458
  417    HG2  LYS  55           HG2      LYS  55  87.029  -1.067  15.193
  418    HG3  LYS  55           HG3      LYS  55  88.686  -1.458  15.657
  419    HD2  LYS  55           HD2      LYS  55  87.924  -1.525  18.054
  420    HD3  LYS  55           HD3      LYS  55  86.268  -1.331  17.480
  421    HE2  LYS  55           HE2      LYS  55  86.369  -3.406  16.256
  422    HE3  LYS  55           HE3      LYS  55  88.101  -3.558  16.555
  423    HZ1  LYS  55           HZ1      LYS  55  87.265  -4.892  18.186
  424    HZ2  LYS  55           HZ2      LYS  55  85.851  -3.973  18.388
  425    HZ3  LYS  55           HZ3      LYS  55  87.324  -3.421  19.027
  426    H    GLY  56           H        GLY  56  89.677   2.913  13.573
  427    HA2  GLY  56           HA2      GLY  56  89.776   5.049  15.542
  428    HA3  GLY  56           HA3      GLY  56  90.328   5.140  13.873
  429    H    ILE  57           H        ILE  57  87.989   4.306  12.567
  430    HA   ILE  57           HA       ILE  57  85.914   6.212  13.414
  431    HB   ILE  57           HB       ILE  57  85.762   7.216  11.228
  432   HG12  ILE  57          HG12      ILE  57  87.738   6.567   9.599
  433   HG13  ILE  57          HG13      ILE  57  87.754   5.065  10.521
  434   HG21  ILE  57          HG21      ILE  57  87.452   8.105  12.842
  435   HG22  ILE  57          HG22      ILE  57  87.883   8.403  11.159
  436   HG23  ILE  57          HG23      ILE  57  88.676   7.108  12.056
  437   HD11  ILE  57          HD11      ILE  57  85.794   4.344   9.607
  438   HD12  ILE  57          HD12      ILE  57  86.162   5.513   8.344
  439   HD13  ILE  57          HD13      ILE  57  85.063   5.948   9.649
  440    H    THR  58           H        THR  58  84.017   5.985  11.695
  441    HA   THR  58           HA       THR  58  83.582   3.085  11.301
  442    HB   THR  58           HB       THR  58  81.645   5.251  12.127
  443    HG1  THR  58           HG1      THR  58  82.332   4.475  13.954
  444   HG21  THR  58          HG21      THR  58  81.152   2.412  11.210
  445   HG22  THR  58          HG22      THR  58  80.467   3.888  10.536
  446   HG23  THR  58          HG23      THR  58  79.979   3.340  12.140
  447    H    TRP  59           H        TRP  59  82.734   2.375   9.400
  448    HA   TRP  59           HA       TRP  59  83.089   3.958   7.088
  449    HB2  TRP  59           HB2      TRP  59  81.278   1.554   7.213
  450    HB3  TRP  59           HB1      TRP  59  82.245   2.131   5.857
  451    HD1  TRP  59           HD1      TRP  59  85.016   2.504   7.239
  452    HE1  TRP  59           HE1      TRP  59  86.363   0.447   8.027
  453    HE3  TRP  59           HE3      TRP  59  81.266  -0.931   7.619
  454    HZ2  TRP  59           HZ2      TRP  59  85.894  -2.285   8.755
  455    HZ3  TRP  59           HZ3      TRP  59  81.739  -3.247   8.350
  456    HH2  TRP  59           HH2      TRP  59  84.049  -3.927   8.920
  457    H    LYS  60           H        LYS  60  81.731   5.201   5.934
  458    HA   LYS  60           HA       LYS  60  78.864   5.171   6.390
  459    HB2  LYS  60           HB2      LYS  60  80.561   7.575   7.112
  460    HB3  LYS  60           HB3      LYS  60  78.809   7.618   6.928
  461    HG2  LYS  60           HG2      LYS  60  78.714   5.737   8.654
  462    HG3  LYS  60           HG3      LYS  60  80.414   6.074   8.973
  463    HD2  LYS  60           HD2      LYS  60  78.327   8.257   9.053
  464    HD3  LYS  60           HD3      LYS  60  78.691   7.269  10.467
  465    HE2  LYS  60           HE2      LYS  60  81.104   7.905  10.223
  466    HE3  LYS  60           HE3      LYS  60  80.638   9.006   8.925
  467    HZ1  LYS  60           HZ1      LYS  60  80.271   9.256  11.784
  468    HZ2  LYS  60           HZ2      LYS  60  78.921   9.697  10.852
  469    HZ3  LYS  60           HZ3      LYS  60  80.418  10.459  10.598
  470    H    GLU  61           H        GLU  61  78.367   7.707   5.204
  471    HA   GLU  61           HA       GLU  61  78.824   7.022   2.448
  472    HB2  GLU  61           HB2      GLU  61  76.756   8.178   3.464
  473    HB3  GLU  61           HB3      GLU  61  77.728   9.649   3.437
  474    HG2  GLU  61           HG2      GLU  61  76.621   9.715   1.365
  475    HG3  GLU  61           HG3      GLU  61  78.193   9.032   0.953
  476    H    GLU  62           H        GLU  62  79.652   9.917   4.381
  477    HA   GLU  62           HA       GLU  62  81.440  10.948   2.414
  478    HB2  GLU  62           HB2      GLU  62  81.115  11.584   5.355
  479    HB3  GLU  62           HB3      GLU  62  82.145  12.495   4.248
  480    HG2  GLU  62           HG2      GLU  62  79.193  12.034   3.764
  481    HG3  GLU  62           HG3      GLU  62  79.824  13.462   4.581
  482    H    THR  63           H        THR  63  81.923   9.137   5.432
  483    HA   THR  63           HA       THR  63  84.695   9.204   5.576
  484    HB   THR  63           HB       THR  63  84.529   7.058   6.779
  485    HG1  THR  63           HG1      THR  63  82.900   6.214   5.332
  486   HG21  THR  63          HG21      THR  63  83.998   8.966   8.089
  487   HG22  THR  63          HG22      THR  63  82.715   7.799   8.413
  488   HG23  THR  63          HG23      THR  63  82.424   9.149   7.316
  489    H    LEU  64           H        LEU  64  82.572   7.217   3.594
  490    HA   LEU  64           HA       LEU  64  84.633   5.528   2.575
  491    HB2  LEU  64           HB2      LEU  64  81.771   5.921   2.127
  492    HB3  LEU  64           HB3      LEU  64  82.646   5.554   0.647
  493    HG   LEU  64           HG       LEU  64  82.968   3.935   3.178
  494   HD11  LEU  64          HD11      LEU  64  81.568   2.352   1.405
  495   HD12  LEU  64          HD12      LEU  64  80.825   3.930   1.156
  496   HD13  LEU  64          HD13      LEU  64  80.856   3.218   2.766
  497   HD21  LEU  64          HD21      LEU  64  83.427   2.633   0.601
  498   HD22  LEU  64          HD22      LEU  64  84.500   2.763   1.993
  499   HD23  LEU  64          HD23      LEU  64  84.453   4.054   0.796
  500    H    MET  65           H        MET  65  83.230   8.611   1.595
  501    HA   MET  65           HA       MET  65  84.325   8.752  -0.994
  502    HB2  MET  65           HB2      MET  65  83.675  10.970   0.953
  503    HB3  MET  65           HB1      MET  65  84.047  11.210  -0.755
  504    HG2  MET  65           HG2      MET  65  82.126   9.966  -1.444
  505    HG3  MET  65           HG1      MET  65  81.845   9.371   0.190
  506    HE1  MET  65           HE1      MET  65  80.361  11.400  -2.287
  507    HE2  MET  65           HE2      MET  65  81.858  12.327  -2.227
  508    HE3  MET  65           HE3      MET  65  80.337  13.093  -1.772
  509    H    GLU  66           H        GLU  66  85.567  10.236   2.013
  510    HA   GLU  66           HA       GLU  66  87.997  11.130   0.912
  511    HB2  GLU  66           HB2      GLU  66  87.226  10.381   3.739
  512    HB3  GLU  66           HB3      GLU  66  88.795  11.069   3.320
  513    HG2  GLU  66           HG2      GLU  66  86.178  12.383   2.563
  514    HG3  GLU  66           HG3      GLU  66  87.031  12.748   4.062
  515    H    TYR  67           H        TYR  67  86.951   8.042   2.129
  516    HA   TYR  67           HA       TYR  67  89.584   6.862   2.213
  517    HB2  TYR  67           HB2      TYR  67  87.977   5.948   3.711
  518    HB3  TYR  67           HB3      TYR  67  86.782   5.777   2.434
  519    HD1  TYR  67           HD2      TYR  67  86.915   3.972   0.797
  520    HD2  TYR  67           HD1      TYR  67  89.850   4.377   3.906
  521    HE1  TYR  67           HE2      TYR  67  87.721   1.672   0.336
  522    HE2  TYR  67           HE1      TYR  67  90.655   2.078   3.446
  523    HH   TYR  67           HH       TYR  67  90.274   0.483   0.845
  524    H    LEU  68           H        LEU  68  87.030   7.253  -0.114
  525    HA   LEU  68           HA       LEU  68  88.008   5.222  -1.923
  526    HB2  LEU  68           HB2      LEU  68  85.736   7.120  -1.822
  527    HB3  LEU  68           HB3      LEU  68  86.307   6.717  -3.433
  528    HG   LEU  68           HG       LEU  68  85.618   4.654  -1.324
  529   HD11  LEU  68          HD11      LEU  68  83.978   5.929  -3.510
  530   HD12  LEU  68          HD12      LEU  68  83.547   5.635  -1.826
  531   HD13  LEU  68          HD13      LEU  68  83.630   4.288  -2.960
  532   HD21  LEU  68          HD21      LEU  68  85.386   3.392  -3.685
  533   HD22  LEU  68          HD22      LEU  68  86.909   3.466  -2.807
  534   HD23  LEU  68          HD23      LEU  68  86.605   4.577  -4.138
  535    H    GLU  69           H        GLU  69  88.913   8.394  -1.185
  536    HA   GLU  69           HA       GLU  69  90.003   8.884  -3.879
  537    HB2  GLU  69           HB2      GLU  69  89.943  11.123  -3.407
  538    HB3  GLU  69           HB3      GLU  69  88.700  10.600  -2.275
  539    HG2  GLU  69           HG2      GLU  69  90.619  10.319  -0.576
  540    HG3  GLU  69           HG3      GLU  69  91.589  11.264  -1.702
  541    H    ASN  70           H        ASN  70  90.881   7.662  -0.864
  542    HA   ASN  70           HA       ASN  70  93.575   7.198  -1.614
  543    HB2  ASN  70           HB2      ASN  70  93.437   9.743  -0.943
  544    HB3  ASN  70           HB1      ASN  70  93.451   9.105   0.697
  545   HD21  ASN  70          HD21      ASN  70  95.206   6.903   0.399
  546   HD22  ASN  70          HD22      ASN  70  96.743   7.475  -0.039
  547    HA   PRO  71           HA       PRO  71  91.343   4.526   1.582
  548    HB2  PRO  71           HB2      PRO  71  93.015   2.619  -0.011
  549    HB3  PRO  71           HB1      PRO  71  91.366   2.425   0.609
  550    HG2  PRO  71           HG2      PRO  71  91.826   2.959  -1.958
  551    HG3  PRO  71           HG1      PRO  71  90.434   3.646  -1.104
  552    HD2  PRO  71           HD2      PRO  71  92.947   4.985  -1.982
  553    HD3  PRO  71           HD1      PRO  71  91.321   5.669  -1.757
  554    H    LYS  72           H        LYS  72  94.718   4.561   0.479
  555    HA   LYS  72           HA       LYS  72  95.765   3.257   2.793
  556    HB2  LYS  72           HB2      LYS  72  96.906   3.307   0.586
  557    HB3  LYS  72           HB3      LYS  72  97.201   5.029   0.810
  558    HG2  LYS  72           HG2      LYS  72  99.070   4.532   1.975
  559    HG3  LYS  72           HG3      LYS  72  98.070   3.760   3.203
  560    HD2  LYS  72           HD2      LYS  72  98.972   2.344   0.679
  561    HD3  LYS  72           HD3      LYS  72  99.871   2.280   2.194
  562    HE2  LYS  72           HE2      LYS  72  97.029   1.330   1.731
  563    HE3  LYS  72           HE3      LYS  72  98.437   0.330   2.083
  564    HZ1  LYS  72           HZ1      LYS  72  97.372   0.573   4.120
  565    HZ2  LYS  72           HZ2      LYS  72  97.032   2.218   3.868
  566    HZ3  LYS  72           HZ3      LYS  72  98.623   1.716   4.189
  567    H    LYS  73           H        LYS  73  95.683   6.664   1.768
  568    HA   LYS  73           HA       LYS  73  97.063   7.686   3.991
  569    HB2  LYS  73           HB2      LYS  73  96.615   8.881   1.819
  570    HB3  LYS  73           HB3      LYS  73  94.970   9.151   2.390
  571    HG2  LYS  73           HG2      LYS  73  96.046  10.165   4.498
  572    HG3  LYS  73           HG3      LYS  73  97.547  10.185   3.574
  573    HD2  LYS  73           HD2      LYS  73  96.729  12.291   3.049
  574    HD3  LYS  73           HD3      LYS  73  96.013  11.351   1.741
  575    HE2  LYS  73           HE2      LYS  73  93.962  11.056   3.189
  576    HE3  LYS  73           HE3      LYS  73  94.678  12.200   4.325
  577    HZ1  LYS  73           HZ1      LYS  73  94.930  13.605   2.133
  578    HZ2  LYS  73           HZ2      LYS  73  93.494  13.625   3.040
  579    HZ3  LYS  73           HZ3      LYS  73  93.607  12.663   1.644
  580    H    TYR  74           H        TYR  74  93.633   6.987   3.498
  581    HA   TYR  74           HA       TYR  74  92.670   8.408   5.745
  582    HB2  TYR  74           HB2      TYR  74  91.461   7.128   3.705
  583    HB3  TYR  74           HB3      TYR  74  91.267   5.906   4.960
  584    HD1  TYR  74           HD1      TYR  74  91.024   9.643   4.624
  585    HD2  TYR  74           HD2      TYR  74  89.329   6.049   6.256
  586    HE1  TYR  74           HE1      TYR  74  89.176  10.964   5.616
  587    HE2  TYR  74           HE2      TYR  74  87.482   7.372   7.248
  588    HH   TYR  74           HH       TYR  74  87.118   9.758   7.977
  589    H    ILE  75           H        ILE  75  93.260   4.901   5.391
  590    HA   ILE  75           HA       ILE  75  93.870   4.805   8.284
  591    HB   ILE  75           HB       ILE  75  92.371   2.658   6.769
  592   HG12  ILE  75          HG12      ILE  75  91.217   4.560   8.821
  593   HG13  ILE  75          HG13      ILE  75  91.146   4.900   7.093
  594   HG21  ILE  75          HG21      ILE  75  91.877   1.937   9.156
  595   HG22  ILE  75          HG22      ILE  75  93.076   3.119   9.681
  596   HG23  ILE  75          HG23      ILE  75  93.560   1.763   8.661
  597   HD11  ILE  75          HD11      ILE  75  89.904   2.869   6.674
  598   HD12  ILE  75          HD12      ILE  75  89.099   3.738   7.981
  599   HD13  ILE  75          HD13      ILE  75  90.116   2.342   8.343
  600    HA   PRO  76           HA       PRO  76  97.456   3.423   5.547
  601    HB2  PRO  76           HB2      PRO  76  98.586   4.017   8.268
  602    HB3  PRO  76           HB1      PRO  76  99.289   4.324   6.667
  603    HG2  PRO  76           HG2      PRO  76  98.136   6.272   8.079
  604    HG3  PRO  76           HG1      PRO  76  98.011   6.201   6.313
  605    HD2  PRO  76           HD2      PRO  76  95.919   5.695   8.350
  606    HD3  PRO  76           HD1      PRO  76  95.739   6.141   6.640
  607    H    GLY  77           H        GLY  77  98.801   1.529   5.795
  608    HA2  GLY  77           HA2      GLY  77  99.425  -0.535   6.701
  609    HA3  GLY  77           HA3      GLY  77  98.327  -0.250   8.049
  610    H    THR  78           H        THR  78  96.113   0.452   6.201
  611    HA   THR  78           HA       THR  78  94.812  -2.006   6.040
  612    HB   THR  78           HB       THR  78  93.710   0.232   5.920
  613    HG1  THR  78           HG1      THR  78  92.621  -1.659   5.252
  614   HG21  THR  78          HG21      THR  78  94.533   0.177   3.014
  615   HG22  THR  78          HG22      THR  78  95.409   1.098   4.236
  616   HG23  THR  78          HG23      THR  78  93.724   1.480   3.886
  617    H    LYS  79           H        LYS  79  94.756  -3.633   4.571
  618    HA   LYS  79           HA       LYS  79  96.756  -3.610   2.470
  619    HB2  LYS  79           HB2      LYS  79  94.722  -5.698   3.283
  620    HB3  LYS  79           HB3      LYS  79  95.960  -5.930   2.049
  621    HG2  LYS  79           HG2      LYS  79  97.588  -5.120   3.976
  622    HG3  LYS  79           HG3      LYS  79  96.274  -5.658   5.020
  623    HD2  LYS  79           HD2      LYS  79  96.308  -7.858   3.777
  624    HD3  LYS  79           HD3      LYS  79  97.778  -7.304   2.973
  625    HE2  LYS  79           HE2      LYS  79  98.944  -7.121   5.082
  626    HE3  LYS  79           HE3      LYS  79  97.462  -7.439   5.984
  627    HZ1  LYS  79           HZ1      LYS  79  98.084  -9.559   5.922
  628    HZ2  LYS  79           HZ2      LYS  79  99.268  -9.279   4.735
  629    HZ3  LYS  79           HZ3      LYS  79  97.653  -9.550   4.282
  630    H    MET  80           H        MET  80  96.057  -2.062   0.986
  631    HA   MET  80           HA       MET  80  94.389  -2.972  -1.091
  632    HB2  MET  80           HB2      MET  80  92.490  -2.549   0.311
  633    HB3  MET  80           HB1      MET  80  93.126  -0.978   0.802
  634    HG2  MET  80           HG2      MET  80  92.696  -0.005  -1.293
  635    HG3  MET  80           HG1      MET  80  92.613  -1.566  -2.109
  636    HE1  MET  80           HE1      MET  80  90.901   0.660  -2.602
  637    HE2  MET  80           HE2      MET  80  90.289   1.317  -1.088
  638    HE3  MET  80           HE3      MET  80  89.192   0.485  -2.183
  639    H    ILE  81           H        ILE  81  96.036  -2.279  -2.403
  640    HA   ILE  81           HA       ILE  81  96.308   0.649  -2.693
  641    HB   ILE  81           HB       ILE  81  98.574  -1.357  -2.861
  642   HG12  ILE  81          HG12      ILE  81  99.321   0.297  -0.894
  643   HG13  ILE  81          HG13      ILE  81  97.578   0.480  -0.706
  644   HG21  ILE  81          HG21      ILE  81  99.900   0.845  -2.925
  645   HG22  ILE  81          HG22      ILE  81  98.365   1.624  -3.306
  646   HG23  ILE  81          HG23      ILE  81  99.026   0.401  -4.391
  647   HD11  ILE  81          HD11      ILE  81  97.847  -1.361   0.638
  648   HD12  ILE  81          HD12      ILE  81  99.304  -1.889  -0.199
  649   HD13  ILE  81          HD13      ILE  81  97.718  -2.217  -0.896
  650    H    PHE  82           H        PHE  82  94.886   0.599  -4.460
  651    HA   PHE  82           HA       PHE  82  95.978  -0.705  -6.888
  652    HB2  PHE  82           HB2      PHE  82  93.929  -1.840  -6.223
  653    HB3  PHE  82           HB1      PHE  82  93.077  -0.299  -6.120
  654    HD1  PHE  82           HD1      PHE  82  95.201  -2.214  -8.556
  655    HD2  PHE  82           HD2      PHE  82  91.812   0.360  -7.970
  656    HE1  PHE  82           HE1      PHE  82  94.685  -2.343 -10.977
  657    HE2  PHE  82           HE2      PHE  82  91.296   0.229 -10.392
  658    HZ   PHE  82           HZ       PHE  82  92.732  -1.123 -11.895
  659    H    ALA  83           H        ALA  83  93.383   1.647  -6.242
  660    HA   ALA  83           HA       ALA  83  94.817   3.879  -7.289
  661    HB1  ALA  83           HB1      ALA  83  93.377   4.154  -9.340
  662    HB2  ALA  83           HB2      ALA  83  92.839   2.491  -9.107
  663    HB3  ALA  83           HB3      ALA  83  94.539   2.829  -9.432
  664    H    GLY  84           H        GLY  84  93.897   5.670  -6.499
  665    HA2  GLY  84           HA2      GLY  84  91.375   5.468  -5.083
  666    HA3  GLY  84           HA3      GLY  84  92.439   6.870  -5.135
  667    H    ILE  85           H        ILE  85  89.860   7.451  -5.333
  668    HA   ILE  85           HA       ILE  85  89.026   7.528  -8.131
  669    HB   ILE  85           HB       ILE  85  87.756   8.554  -5.588
  670   HG12  ILE  85          HG12      ILE  85  87.962   5.992  -6.270
  671   HG13  ILE  85          HG13      ILE  85  86.458   6.624  -5.610
  672   HG21  ILE  85          HG21      ILE  85  86.933   9.995  -7.271
  673   HG22  ILE  85          HG22      ILE  85  85.717   8.722  -7.170
  674   HG23  ILE  85          HG23      ILE  85  86.899   8.708  -8.476
  675   HD11  ILE  85          HD11      ILE  85  86.320   5.189  -7.762
  676   HD12  ILE  85          HD12      ILE  85  86.949   6.617  -8.584
  677   HD13  ILE  85          HD13      ILE  85  85.413   6.701  -7.719
  678    H    LYS  86           H        LYS  86  88.391   9.597  -9.132
  679    HA   LYS  86           HA       LYS  86  90.339  11.702  -8.453
  680    HB2  LYS  86           HB2      LYS  86  88.817  11.929 -10.978
  681    HB3  LYS  86           HB3      LYS  86  90.545  12.115 -10.678
  682    HG2  LYS  86           HG2      LYS  86  90.652   9.591 -10.395
  683    HG3  LYS  86           HG3      LYS  86  88.999   9.534 -11.007
  684    HD2  LYS  86           HD2      LYS  86  89.917  10.946 -12.990
  685    HD3  LYS  86           HD3      LYS  86  91.503  10.406 -12.438
  686    HE2  LYS  86           HE2      LYS  86  90.853   8.786 -14.045
  687    HE3  LYS  86           HE3      LYS  86  90.517   8.026 -12.490
  688    HZ1  LYS  86           HZ1      LYS  86  88.525   7.686 -13.469
  689    HZ2  LYS  86           HZ2      LYS  86  88.670   9.020 -14.513
  690    HZ3  LYS  86           HZ3      LYS  86  88.217   9.252 -12.891
  691    H    LYS  87           H        LYS  87  87.116  11.762 -10.003
  692    HA   LYS  87           HA       LYS  87  86.553  14.339  -8.820
  693    HB2  LYS  87           HB2      LYS  87  84.924  12.484 -10.563
  694    HB3  LYS  87           HB3      LYS  87  84.353  14.057 -10.010
  695    HG2  LYS  87           HG2      LYS  87  87.034  13.878 -11.356
  696    HG3  LYS  87           HG3      LYS  87  85.577  13.828 -12.349
  697    HD2  LYS  87           HD2      LYS  87  84.812  15.942 -11.229
  698    HD3  LYS  87           HD3      LYS  87  86.373  16.019 -10.410
  699    HE2  LYS  87           HE2      LYS  87  86.497  17.403 -12.394
  700    HE3  LYS  87           HE3      LYS  87  87.483  15.966 -12.665
  701    HZ1  LYS  87           HZ1      LYS  87  86.245  15.482 -14.415
  702    HZ2  LYS  87           HZ2      LYS  87  85.308  16.877 -14.164
  703    HZ3  LYS  87           HZ3      LYS  87  84.853  15.405 -13.448
  704    H    LYS  88           H        LYS  88  84.567  14.784  -7.619
  705    HA   LYS  88           HA       LYS  88  84.280  13.017  -5.385
  706    HB2  LYS  88           HB2      LYS  88  84.021  15.559  -5.367
  707    HB3  LYS  88           HB3      LYS  88  82.428  15.298  -6.082
  708    HG2  LYS  88           HG2      LYS  88  82.009  13.662  -4.138
  709    HG3  LYS  88           HG3      LYS  88  83.437  14.373  -3.387
  710    HD2  LYS  88           HD2      LYS  88  81.525  15.576  -2.550
  711    HD3  LYS  88           HD3      LYS  88  82.360  16.640  -3.681
  712    HE2  LYS  88           HE2      LYS  88  80.314  14.924  -4.945
  713    HE3  LYS  88           HE3      LYS  88  79.670  16.076  -3.777
  714    HZ1  LYS  88           HZ1      LYS  88  80.212  17.815  -5.058
  715    HZ2  LYS  88           HZ2      LYS  88  80.223  16.674  -6.317
  716    HZ3  LYS  88           HZ3      LYS  88  81.678  17.135  -5.571
  717    H    THR  89           H        THR  89  82.188  13.914  -8.127
  718    HA   THR  89           HA       THR  89  79.945  12.402  -7.414
  719    HB   THR  89           HB       THR  89  79.437  12.368  -9.857
  720    HG1  THR  89           HG1      THR  89  81.731  12.262 -10.416
  721   HG21  THR  89          HG21      THR  89  78.943  14.320  -8.332
  722   HG22  THR  89          HG22      THR  89  79.127  14.753 -10.032
  723   HG23  THR  89          HG23      THR  89  80.441  15.059  -8.896
  724    H    GLU  90           H        GLU  90  83.030  11.425  -8.687
  725    HA   GLU  90           HA       GLU  90  82.236   8.870  -9.672
  726    HB2  GLU  90           HB2      GLU  90  84.870  10.058  -8.819
  727    HB3  GLU  90           HB3      GLU  90  84.742   8.356  -9.252
  728    HG2  GLU  90           HG2      GLU  90  84.054   8.862 -11.467
  729    HG3  GLU  90           HG3      GLU  90  83.705  10.541 -11.058
  730    H    ARG  91           H        ARG  91  83.366  10.101  -6.567
  731    HA   ARG  91           HA       ARG  91  83.386   7.540  -5.264
  732    HB2  ARG  91           HB2      ARG  91  83.216  10.281  -3.984
  733    HB3  ARG  91           HB3      ARG  91  83.784   8.790  -3.239
  734    HG2  ARG  91           HG2      ARG  91  85.636   8.699  -4.887
  735    HG3  ARG  91           HG3      ARG  91  85.098  10.244  -5.546
  736    HD2  ARG  91           HD2      ARG  91  85.253  10.790  -2.845
  737    HD3  ARG  91           HD3      ARG  91  86.604   9.684  -3.077
  738    HE   ARG  91           HE       ARG  91  86.847  11.476  -5.138
  739   HH11  ARG  91          HH21      ARG  91  86.554  11.669  -1.694
  740   HH12  ARG  91          HH22      ARG  91  87.474  13.130  -1.560
  741   HH21  ARG  91          HH11      ARG  91  88.056  13.391  -4.969
  742   HH22  ARG  91          HH12      ARG  91  88.325  14.104  -3.413
  743    H    GLU  92           H        GLU  92  81.221  10.377  -5.191
  744    HA   GLU  92           HA       GLU  92  79.290   9.366  -3.449
  745    HB2  GLU  92           HB2      GLU  92  79.456  11.725  -4.407
  746    HB3  GLU  92           HB3      GLU  92  78.656  11.091  -5.847
  747    HG2  GLU  92           HG2      GLU  92  76.791  10.273  -4.405
  748    HG3  GLU  92           HG3      GLU  92  77.570  11.032  -3.017
  749    H    ASP  93           H        ASP  93  79.305   9.267  -7.023
  750    HA   ASP  93           HA       ASP  93  76.995   7.699  -7.324
  751    HB2  ASP  93           HB2      ASP  93  79.458   7.934  -9.068
  752    HB3  ASP  93           HB1      ASP  93  77.985   7.096  -9.552
  753    H    LEU  94           H        LEU  94  80.423   6.744  -7.199
  754    HA   LEU  94           HA       LEU  94  80.077   3.979  -7.441
  755    HB2  LEU  94           HB2      LEU  94  82.285   5.018  -7.577
  756    HB3  LEU  94           HB3      LEU  94  82.166   5.520  -5.892
  757    HG   LEU  94           HG       LEU  94  82.125   3.210  -5.145
  758   HD11  LEU  94          HD11      LEU  94  82.644   1.480  -7.049
  759   HD12  LEU  94          HD12      LEU  94  81.907   2.692  -8.096
  760   HD13  LEU  94          HD13      LEU  94  80.980   1.988  -6.770
  761   HD21  LEU  94          HD21      LEU  94  84.319   3.436  -7.213
  762   HD22  LEU  94          HD22      LEU  94  84.381   2.635  -5.644
  763   HD23  LEU  94          HD23      LEU  94  84.318   4.394  -5.731
  764    H    ILE  95           H        ILE  95  79.841   6.108  -4.662
  765    HA   ILE  95           HA       ILE  95  79.641   3.974  -2.770
  766    HB   ILE  95           HB       ILE  95  79.328   6.951  -2.636
  767   HG12  ILE  95          HG12      ILE  95  80.989   5.397  -0.730
  768   HG13  ILE  95          HG13      ILE  95  81.476   5.259  -2.412
  769   HG21  ILE  95          HG21      ILE  95  77.628   6.433  -1.117
  770   HG22  ILE  95          HG22      ILE  95  79.043   6.414  -0.065
  771   HG23  ILE  95          HG23      ILE  95  78.365   4.899  -0.661
  772   HD11  ILE  95          HD11      ILE  95  80.881   8.018  -1.519
  773   HD12  ILE  95          HD12      ILE  95  82.203   7.408  -2.509
  774   HD13  ILE  95          HD13      ILE  95  82.281   7.269  -0.760
  775    H    ALA  96           H        ALA  96  77.429   5.866  -4.684
  776    HA   ALA  96           HA       ALA  96  75.038   5.303  -3.298
  777    HB1  ALA  96           HB1      ALA  96  73.909   5.900  -5.343
  778    HB2  ALA  96           HB2      ALA  96  75.361   5.592  -6.294
  779    HB3  ALA  96           HB3      ALA  96  75.310   6.959  -5.180
  780    H    TYR  97           H        TYR  97  76.919   3.532  -5.686
  781    HA   TYR  97           HA       TYR  97  75.012   1.406  -5.992
  782    HB2  TYR  97           HB2      TYR  97  76.538   1.764  -7.808
  783    HB3  TYR  97           HB3      TYR  97  77.933   1.664  -6.733
  784    HD1  TYR  97           HD1      TYR  97  75.072  -0.306  -8.100
  785    HD2  TYR  97           HD2      TYR  97  78.922  -0.429  -6.200
  786    HE1  TYR  97           HE1      TYR  97  75.154  -2.762  -8.425
  787    HE2  TYR  97           HE2      TYR  97  79.004  -2.884  -6.526
  788    HH   TYR  97           HH       TYR  97  77.849  -4.543  -8.286
  789    H    LEU  98           H        LEU  98  78.218   1.626  -4.414
  790    HA   LEU  98           HA       LEU  98  78.368  -0.835  -3.236
  791    HB2  LEU  98           HB2      LEU  98  79.260   1.885  -2.341
  792    HB3  LEU  98           HB3      LEU  98  79.485   0.509  -1.271
  793    HG   LEU  98           HG       LEU  98  80.355   0.261  -4.137
  794   HD11  LEU  98          HD11      LEU  98  82.438   1.300  -3.775
  795   HD12  LEU  98          HD12      LEU  98  82.202   1.371  -2.031
  796   HD13  LEU  98          HD13      LEU  98  81.280   2.435  -3.091
  797   HD21  LEU  98          HD21      LEU  98  80.360  -1.654  -2.508
  798   HD22  LEU  98          HD22      LEU  98  81.526  -0.759  -1.537
  799   HD23  LEU  98          HD23      LEU  98  81.954  -1.286  -3.165
  800    H    LYS  99           H        LYS  99  76.135   1.708  -2.525
  801    HA   LYS  99           HA       LYS  99  75.399   0.726   0.093
  802    HB2  LYS  99           HB2      LYS  99  74.451   2.897  -1.733
  803    HB3  LYS  99           HB3      LYS  99  73.365   2.342  -0.460
  804    HG2  LYS  99           HG2      LYS  99  75.337   2.666   1.153
  805    HG3  LYS  99           HG3      LYS  99  76.123   3.546  -0.158
  806    HD2  LYS  99           HD2      LYS  99  73.365   4.218   0.903
  807    HD3  LYS  99           HD3      LYS  99  74.843   5.014   1.442
  808    HE2  LYS  99           HE2      LYS  99  75.298   5.579  -0.991
  809    HE3  LYS  99           HE3      LYS  99  73.666   5.016  -1.347
  810    HZ1  LYS  99           HZ1      LYS  99  74.099   6.987   0.791
  811    HZ2  LYS  99           HZ2      LYS  99  72.715   6.717  -0.158
  812    HZ3  LYS  99           HZ3      LYS  99  74.069   7.498  -0.825
  813    H    LYS 100           H        LYS 100  73.728   0.876  -3.063
  814    HA   LYS 100           HA       LYS 100  71.582  -0.811  -2.206
  815    HB2  LYS 100           HB2      LYS 100  72.511   0.054  -4.950
  816    HB3  LYS 100           HB3      LYS 100  71.055  -0.899  -4.665
  817    HG2  LYS 100           HG2      LYS 100  70.179   0.878  -3.190
  818    HG3  LYS 100           HG3      LYS 100  71.628   1.838  -3.494
  819    HD2  LYS 100           HD2      LYS 100  71.083   2.128  -5.791
  820    HD3  LYS 100           HD3      LYS 100  69.859   0.859  -5.739
  821    HE2  LYS 100           HE2      LYS 100  69.677   3.416  -4.127
  822    HE3  LYS 100           HE3      LYS 100  68.929   3.211  -5.711
  823    HZ1  LYS 100           HZ1      LYS 100  67.990   1.065  -4.582
  824    HZ2  LYS 100           HZ2      LYS 100  67.231   2.568  -4.359
  825    HZ3  LYS 100           HZ3      LYS 100  68.256   1.945  -3.156
  826    H    ALA 101           H        ALA 101  74.765  -1.409  -3.320
  827    HA   ALA 101           HA       ALA 101  74.215  -4.106  -4.257
  828    HB1  ALA 101           HB1      ALA 101  76.022  -2.477  -5.161
  829    HB2  ALA 101           HB2      ALA 101  76.454  -4.172  -4.944
  830    HB3  ALA 101           HB3      ALA 101  76.956  -2.975  -3.751
  831    H    THR 102           H        THR 102  75.428  -2.475  -1.402
  832    HA   THR 102           HA       THR 102  76.207  -5.004  -0.146
  833    HB   THR 102           HB       THR 102  76.905  -3.551   1.742
  834    HG1  THR 102           HG1      THR 102  75.282  -1.853   0.508
  835   HG21  THR 102          HG21      THR 102  77.845  -2.983  -1.061
  836   HG22  THR 102          HG22      THR 102  78.633  -3.929   0.199
  837   HG23  THR 102          HG23      THR 102  78.587  -2.171   0.318
  838    H    ASN 103           H        ASN 103  73.418  -3.347  -0.656
  839    HA   ASN 103           HA       ASN 103  72.221  -3.959   1.959
  840    HB2  ASN 103           HB2      ASN 103  71.388  -2.282  -0.396
  841    HB3  ASN 103           HB1      ASN 103  70.234  -2.746   0.848
  842   HD21  ASN 103          HD21      ASN 103  73.604  -2.222   1.700
  843   HD22  ASN 103          HD22      ASN 103  73.352  -0.769   2.539
  844    H    GLU 104           H        GLU 104  72.346  -5.028  -1.327
  845    HA   GLU 104           HA       GLU 104  69.925  -6.630  -1.148
  846    HB2  GLU 104           HB2      GLU 104  72.064  -6.333  -3.259
  847    HB3  GLU 104           HB3      GLU 104  70.733  -7.480  -3.401
  848    HG2  GLU 104           HG2      GLU 104  70.316  -4.526  -2.890
  849    HG3  GLU 104           HG3      GLU 104  70.332  -5.230  -4.507
  850    HHA  HEC 201           HA       HEC 105  89.370  -3.485   3.202
  851    HHB  HEC 201           HB       HEC 105  85.603   0.052  -0.438
  852    HHC  HEC 201           HC       HEC 105  88.844  -1.790  -5.554
  853    HHD  HEC 201           HD       HEC 105  92.195  -5.785  -1.968
  854   HMA1  HEC 201          HMA1      HEC 105  84.676  -0.165   1.582
  855   HMA2  HEC 201          HMA2      HEC 105  85.842   0.912   2.352
  856   HMA3  HEC 201          HMA3      HEC 105  85.152  -0.435   3.256
  857   HAA1  HEC 201          HAA1      HEC 105  86.981  -0.893   4.488
  858   HAA2  HEC 201          HAA2      HEC 105  88.423  -1.885   4.454
  859   HBA1  HEC 201          HBA1      HEC 105  87.244  -3.860   4.680
  860   HBA2  HEC 201          HBA2      HEC 105  85.789  -3.206   3.936
  861   HMB1  HEC 201          HMB1      HEC 105  84.174   0.186  -2.701
  862   HMB2  HEC 201          HMB2      HEC 105  84.863   1.190  -3.971
  863   HMB3  HEC 201          HMB3      HEC 105  85.196   1.561  -2.283
  864    HAB  HEC 201           HAB      HEC 105  87.343  -0.586  -6.217
  865   HBB1  HEC 201          HBB1      HEC 105  86.761   1.996  -4.820
  866   HBB2  HEC 201          HBB2      HEC 105  87.987   1.628  -6.029
  867   HBB3  HEC 201          HBB3      HEC 105  86.309   1.846  -6.517
  868   HMC1  HEC 201          HMC1      HEC 105  91.361  -2.594  -6.641
  869   HMC2  HEC 201          HMC2      HEC 105  89.802  -3.372  -6.892
  870   HMC3  HEC 201          HMC3      HEC 105  91.274  -4.334  -6.901
  871    HAC  HEC 201           HAC      HEC 105  92.666  -6.196  -3.893
  872   HBC1  HEC 201          HBC1      HEC 105  94.405  -5.499  -5.166
  873   HBC2  HEC 201          HBC2      HEC 105  93.554  -3.963  -5.313
  874   HBC3  HEC 201          HBC3      HEC 105  93.364  -5.201  -6.555
  875   HMD1  HEC 201          HMD1      HEC 105  93.311  -6.498   1.528
  876   HMD2  HEC 201          HMD2      HEC 105  93.389  -6.347  -0.223
  877   HMD3  HEC 201          HMD3      HEC 105  92.284  -7.509   0.512
  878   HAD1  HEC 201          HAD1      HEC 105  91.932  -6.259   3.209
  879   HAD2  HEC 201          HAD2      HEC 105  90.419  -5.521   3.699
  880   HBD1  HEC 201          HBD1      HEC 105  91.558  -3.335   3.906
  881   HBD2  HEC 201          HBD2      HEC 105  93.078  -4.096   3.449
  882    H1   HOH 301           H2       HOH 200  81.981   3.454  -1.548
  883    H2   HOH 301           H1       HOH 200  80.553   3.008  -1.311
  884    H1   HOH 302           H2       HOH 201  86.288   6.612   5.649
  885    H2   HOH 302           H1       HOH 201  85.650   5.241   5.574
  886    H1   HOH 303           H2       HOH 202  82.371  -7.004   5.394
  887    H2   HOH 303           H1       HOH 202  82.699  -5.545   5.156
  888    H1   HOH 304           H2       HOH 203  82.265 -10.862  -0.016
  889    H2   HOH 304           H1       HOH 203  80.814 -11.151   0.304
  Start of MODEL   23
    1    H1   GLY   1           H1       GLY   1  72.233   9.924  -6.329
    2    H2   GLY   1           H2       GLY   1  73.267  11.227  -5.986
    3    H3   GLY   1           H3       GLY   1  73.256   9.860  -4.978
    4    HA2  GLY   1           HA2      GLY   1  74.907  10.334  -7.147
    5    HA3  GLY   1           HA3      GLY   1  74.779   8.849  -6.202
    6    H    ASP   2           H        ASP   2  75.390   8.208  -8.592
    7    HA   ASP   2           HA       ASP   2  72.873   7.571 -10.025
    8    HB2  ASP   2           HB2      ASP   2  75.633   7.979 -11.199
    9    HB3  ASP   2           HB1      ASP   2  74.176   7.556 -12.095
   10    H    VAL   3           H        VAL   3  72.645   5.644  -8.840
   11    HA   VAL   3           HA       VAL   3  74.464   3.656  -8.348
   12    HB   VAL   3           HB       VAL   3  72.128   3.563  -7.607
   13   HG11  VAL   3          HG11      VAL   3  71.262   4.425  -9.856
   14   HG12  VAL   3          HG12      VAL   3  70.322   3.134  -9.105
   15   HG13  VAL   3          HG13      VAL   3  71.419   2.766 -10.436
   16   HG21  VAL   3          HG21      VAL   3  71.778   1.187  -7.933
   17   HG22  VAL   3          HG22      VAL   3  73.514   1.470  -7.815
   18   HG23  VAL   3          HG23      VAL   3  72.772   1.196  -9.390
   19    H    GLU   4           H        GLU   4  73.335   4.759 -11.404
   20    HA   GLU   4           HA       GLU   4  73.852   2.361 -12.889
   21    HB2  GLU   4           HB2      GLU   4  73.649   5.237 -13.811
   22    HB3  GLU   4           HB3      GLU   4  73.659   3.825 -14.867
   23    HG2  GLU   4           HG2      GLU   4  71.644   4.166 -12.640
   24    HG3  GLU   4           HG3      GLU   4  71.355   4.758 -14.275
   25    H    LYS   5           H        LYS   5  75.591   5.486 -12.769
   26    HA   LYS   5           HA       LYS   5  77.904   4.395 -14.068
   27    HB2  LYS   5           HB2      LYS   5  77.278   7.001 -12.694
   28    HB3  LYS   5           HB3      LYS   5  78.932   6.616 -13.170
   29    HG2  LYS   5           HG2      LYS   5  78.354   6.471 -15.470
   30    HG3  LYS   5           HG3      LYS   5  76.629   6.401 -15.114
   31    HD2  LYS   5           HD2      LYS   5  78.170   8.809 -14.208
   32    HD3  LYS   5           HD3      LYS   5  77.760   8.671 -15.917
   33    HE2  LYS   5           HE2      LYS   5  75.435   8.647 -15.478
   34    HE3  LYS   5           HE3      LYS   5  75.674   8.276 -13.771
   35    HZ1  LYS   5           HZ1      LYS   5  75.093  10.642 -14.302
   36    HZ2  LYS   5           HZ2      LYS   5  76.625  10.789 -15.020
   37    HZ3  LYS   5           HZ3      LYS   5  76.490  10.433 -13.364
   38    H    GLY   6           H        GLY   6  76.723   4.437 -10.862
   39    HA2  GLY   6           HA2      GLY   6  79.230   4.236  -9.493
   40    HA3  GLY   6           HA3      GLY   6  77.649   3.801  -8.839
   41    H    LYS   7           H        LYS   7  76.943   2.017 -10.954
   42    HA   LYS   7           HA       LYS   7  78.135  -0.391  -9.993
   43    HB2  LYS   7           HB2      LYS   7  75.787  -0.177 -10.880
   44    HB3  LYS   7           HB3      LYS   7  76.475  -0.010 -12.495
   45    HG2  LYS   7           HG2      LYS   7  77.738  -2.228 -11.923
   46    HG3  LYS   7           HG3      LYS   7  76.517  -2.403 -10.665
   47    HD2  LYS   7           HD2      LYS   7  75.471  -3.499 -12.431
   48    HD3  LYS   7           HD3      LYS   7  74.842  -1.866 -12.645
   49    HE2  LYS   7           HE2      LYS   7  75.571  -2.396 -14.806
   50    HE3  LYS   7           HE3      LYS   7  76.964  -1.532 -14.155
   51    HZ1  LYS   7           HZ1      LYS   7  77.125  -3.935 -15.268
   52    HZ2  LYS   7           HZ2      LYS   7  76.885  -4.391 -13.649
   53    HZ3  LYS   7           HZ3      LYS   7  78.196  -3.395 -14.069
   54    H    LYS   8           H        LYS   8  78.447   1.537 -12.968
   55    HA   LYS   8           HA       LYS   8  80.132  -0.214 -14.378
   56    HB2  LYS   8           HB2      LYS   8  79.082   1.693 -15.460
   57    HB3  LYS   8           HB3      LYS   8  79.996   2.808 -14.446
   58    HG2  LYS   8           HG2      LYS   8  81.649   0.827 -15.905
   59    HG3  LYS   8           HG3      LYS   8  80.803   1.978 -16.936
   60    HD2  LYS   8           HD2      LYS   8  82.299   2.975 -14.521
   61    HD3  LYS   8           HD3      LYS   8  83.180   2.591 -15.998
   62    HE2  LYS   8           HE2      LYS   8  81.738   4.124 -17.273
   63    HE3  LYS   8           HE3      LYS   8  80.832   4.501 -15.808
   64    HZ1  LYS   8           HZ1      LYS   8  83.716   4.806 -15.645
   65    HZ2  LYS   8           HZ2      LYS   8  82.480   5.780 -15.005
   66    HZ3  LYS   8           HZ3      LYS   8  82.913   5.919 -16.642
   67    H    ILE   9           H        ILE   9  80.951   2.499 -12.219
   68    HA   ILE   9           HA       ILE   9  83.755   2.190 -12.433
   69    HB   ILE   9           HB       ILE   9  82.125   3.398 -10.190
   70   HG12  ILE   9          HG12      ILE   9  83.524   4.825 -12.458
   71   HG13  ILE   9          HG13      ILE   9  81.846   4.301 -12.588
   72   HG21  ILE   9          HG21      ILE   9  84.241   4.660  -9.760
   73   HG22  ILE   9          HG22      ILE   9  85.047   3.656 -10.964
   74   HG23  ILE   9          HG23      ILE   9  84.415   2.926  -9.489
   75   HD11  ILE   9          HD11      ILE   9  82.047   6.659 -11.798
   76   HD12  ILE   9          HD12      ILE   9  82.928   6.080 -10.384
   77   HD13  ILE   9          HD13      ILE   9  81.243   5.619 -10.623
   78    H    PHE  10           H        PHE  10  81.336   0.549 -10.566
   79    HA   PHE  10           HA       PHE  10  83.155  -0.480  -8.588
   80    HB2  PHE  10           HB2      PHE  10  80.971  -0.395  -7.793
   81    HB3  PHE  10           HB1      PHE  10  80.289  -0.984  -9.310
   82    HD1  PHE  10           HD2      PHE  10  82.079  -1.949  -6.228
   83    HD2  PHE  10           HD1      PHE  10  80.205  -3.345  -9.827
   84    HE1  PHE  10           HE2      PHE  10  82.171  -4.276  -5.374
   85    HE2  PHE  10           HE1      PHE  10  80.291  -5.671  -8.974
   86    HZ   PHE  10           HZ       PHE  10  81.275  -6.138  -6.747
   87    H    VAL  11           H        VAL  11  81.444  -1.978 -11.345
   88    HA   VAL  11           HA       VAL  11  82.512  -4.535 -11.102
   89    HB   VAL  11           HB       VAL  11  81.986  -4.805 -13.506
   90   HG11  VAL  11          HG11      VAL  11  79.631  -4.519 -13.252
   91   HG12  VAL  11          HG12      VAL  11  79.847  -3.188 -12.118
   92   HG13  VAL  11          HG13      VAL  11  80.254  -4.832 -11.632
   93   HG21  VAL  11          HG21      VAL  11  82.727  -2.512 -14.182
   94   HG22  VAL  11          HG22      VAL  11  81.310  -1.856 -13.361
   95   HG23  VAL  11          HG23      VAL  11  81.108  -2.906 -14.762
   96    H    GLN  12           H        GLN  12  83.920  -1.642 -12.448
   97    HA   GLN  12           HA       GLN  12  86.155  -3.175 -13.566
   98    HB2  GLN  12           HB2      GLN  12  86.834  -1.129 -14.618
   99    HB3  GLN  12           HB1      GLN  12  85.100  -1.340 -14.864
  100    HG2  GLN  12           HG2      GLN  12  84.704   0.142 -12.874
  101    HG3  GLN  12           HG1      GLN  12  86.439   0.451 -12.821
  102   HE21  GLN  12          HE21      GLN  12  85.808   0.025 -16.033
  103   HE22  GLN  12          HE22      GLN  12  85.504   1.630 -16.481
  104    H    LYS  13           H        LYS  13  85.470  -1.118 -10.798
  105    HA   LYS  13           HA       LYS  13  88.356  -0.949 -10.224
  106    HB2  LYS  13           HB2      LYS  13  86.011   0.512  -9.013
  107    HB3  LYS  13           HB3      LYS  13  87.671   0.671  -8.454
  108    HG2  LYS  13           HG2      LYS  13  87.999   1.058 -11.150
  109    HG3  LYS  13           HG3      LYS  13  86.402   1.755 -10.901
  110    HD2  LYS  13           HD2      LYS  13  87.262   3.223  -9.158
  111    HD3  LYS  13           HD3      LYS  13  88.851   2.463  -9.261
  112    HE2  LYS  13           HE2      LYS  13  89.056   3.208 -11.607
  113    HE3  LYS  13           HE3      LYS  13  87.475   3.982 -11.495
  114    HZ1  LYS  13           HZ1      LYS  13  88.537   5.763 -10.748
  115    HZ2  LYS  13           HZ2      LYS  13  90.007   4.923 -10.607
  116    HZ3  LYS  13           HZ3      LYS  13  88.888   4.902  -9.329
  117    H    CYS  14           H        CYS  14  85.451  -1.490  -8.176
  118    HA   CYS  14           HA       CYS  14  87.120  -2.792  -6.207
  119    HB2  CYS  14           HB2      CYS  14  84.152  -2.746  -5.996
  120    HB3  CYS  14           HB1      CYS  14  85.367  -2.535  -4.739
  121    H    ALA  15           H        ALA  15  84.685  -3.930  -8.520
  122    HA   ALA  15           HA       ALA  15  84.138  -6.420  -7.491
  123    HB1  ALA  15           HB1      ALA  15  83.005  -5.991  -9.464
  124    HB2  ALA  15           HB2      ALA  15  84.217  -7.144 -10.021
  125    HB3  ALA  15           HB3      ALA  15  84.451  -5.417 -10.291
  126    H    GLN  16           H        GLN  16  87.130  -5.262  -8.833
  127    HA   GLN  16           HA       GLN  16  88.462  -7.561  -9.546
  128    HB2  GLN  16           HB2      GLN  16  89.452  -5.087  -8.138
  129    HB3  GLN  16           HB1      GLN  16  90.537  -6.369  -8.673
  130    HG2  GLN  16           HG2      GLN  16  89.870  -6.084 -10.967
  131    HG3  GLN  16           HG1      GLN  16  88.564  -4.993 -10.508
  132   HE21  GLN  16          HE21      GLN  16  89.398  -3.155 -11.687
  133   HE22  GLN  16          HE22      GLN  16  90.832  -2.371 -11.232
  134    H    CYS  17           H        CYS  17  88.614  -6.107  -6.264
  135    HA   CYS  17           HA       CYS  17  89.013  -8.846  -5.205
  136    HB2  CYS  17           HB2      CYS  17  90.172  -6.611  -3.650
  137    HB3  CYS  17           HB1      CYS  17  90.823  -8.212  -3.981
  138    H    HIS  18           H        HSD  18  86.439  -7.956  -5.344
  139    HA   HIS  18           HA       HSD  18  85.738  -7.841  -2.531
  140    HB2  HIS  18           HB2      HSD  18  85.239  -5.508  -4.361
  141    HB3  HIS  18           HB1      HSD  18  84.140  -5.848  -3.029
  142    HD1  HIS  18           HD1      HSD  18  85.134  -5.694  -0.589
  143    HD2  HIS  18           HD2      HSD  18  87.730  -4.465  -3.600
  144    HE1  HIS  18           HE1      HSD  18  87.011  -4.431   0.555
  145    H    THR  19           H        THR  19  83.146  -7.420  -2.517
  146    HA   THR  19           HA       THR  19  81.895  -8.947  -4.688
  147    HB   THR  19           HB       THR  19  81.040  -9.730  -1.961
  148    HG1  THR  19           HG1      THR  19  82.877 -11.193  -1.885
  149   HG21  THR  19          HG21      THR  19  80.574 -11.745  -2.995
  150   HG22  THR  19          HG22      THR  19  81.920 -11.596  -4.124
  151   HG23  THR  19          HG23      THR  19  80.450 -10.657  -4.376
  152    H    VAL  20           H        VAL  20  81.544  -7.034  -1.747
  153    HA   VAL  20           HA       VAL  20  79.814  -5.754  -0.935
  154    HB   VAL  20           HB       VAL  20  79.135  -3.992  -2.445
  155   HG11  VAL  20          HG11      VAL  20  81.452  -3.410  -3.379
  156   HG12  VAL  20          HG12      VAL  20  81.988  -4.949  -2.708
  157   HG13  VAL  20          HG13      VAL  20  81.349  -3.697  -1.644
  158   HG21  VAL  20          HG21      VAL  20  80.436  -5.568  -4.672
  159   HG22  VAL  20          HG22      VAL  20  79.516  -4.074  -4.807
  160   HG23  VAL  20          HG23      VAL  20  78.698  -5.575  -4.389
  161    H    GLU  21           H        GLU  21  78.952  -8.432  -1.708
  162    HA   GLU  21           HA       GLU  21  76.112  -7.795  -2.215
  163    HB2  GLU  21           HB2      GLU  21  75.835  -9.596  -3.710
  164    HB3  GLU  21           HB3      GLU  21  77.324  -8.812  -4.233
  165    HG2  GLU  21           HG2      GLU  21  78.515 -10.509  -2.671
  166    HG3  GLU  21           HG3      GLU  21  76.990 -11.394  -2.716
  167    H    LYS  22           H        LYS  22  74.982  -8.318  -0.488
  168    HA   LYS  22           HA       LYS  22  75.818  -9.684   1.742
  169    HB2  LYS  22           HB2      LYS  22  73.010  -9.575   0.617
  170    HB3  LYS  22           HB3      LYS  22  73.429 -10.020   2.272
  171    HG2  LYS  22           HG2      LYS  22  74.753  -7.671   2.121
  172    HG3  LYS  22           HG3      LYS  22  73.464  -7.341   0.964
  173    HD2  LYS  22           HD2      LYS  22  73.096  -8.259   3.830
  174    HD3  LYS  22           HD3      LYS  22  72.768  -6.643   3.207
  175    HE2  LYS  22           HE2      LYS  22  71.186  -7.850   1.532
  176    HE3  LYS  22           HE3      LYS  22  71.288  -9.208   2.651
  177    HZ1  LYS  22           HZ1      LYS  22  69.716  -6.912   2.868
  178    HZ2  LYS  22           HZ2      LYS  22  70.857  -6.867   4.126
  179    HZ3  LYS  22           HZ3      LYS  22  69.830  -8.209   3.954
  180    H    GLY  23           H        GLY  23  75.583 -11.789   2.534
  181    HA2  GLY  23           HA2      GLY  23  75.785 -14.079   2.384
  182    HA3  GLY  23           HA3      GLY  23  74.387 -13.969   1.318
  183    H    GLY  24           H        GLY  24  77.369 -12.364   0.497
  184    HA2  GLY  24           HA2      GLY  24  77.578 -13.936  -1.934
  185    HA3  GLY  24           HA3      GLY  24  78.554 -12.536  -1.500
  186    H    LYS  25           H        LYS  25  80.558 -13.345  -1.840
  187    HA   LYS  25           HA       LYS  25  81.520 -15.333   0.079
  188    HB2  LYS  25           HB2      LYS  25  82.342 -15.676  -2.786
  189    HB3  LYS  25           HB3      LYS  25  82.350 -16.854  -1.474
  190    HG2  LYS  25           HG2      LYS  25  79.867 -16.865  -1.492
  191    HG3  LYS  25           HG3      LYS  25  79.885 -15.738  -2.848
  192    HD2  LYS  25           HD2      LYS  25  81.399 -18.338  -3.017
  193    HD3  LYS  25           HD3      LYS  25  79.668 -18.295  -3.344
  194    HE2  LYS  25           HE2      LYS  25  80.091 -16.472  -5.022
  195    HE3  LYS  25           HE3      LYS  25  81.821 -16.706  -4.769
  196    HZ1  LYS  25           HZ1      LYS  25  81.227 -18.006  -6.623
  197    HZ2  LYS  25           HZ2      LYS  25  79.865 -18.653  -5.841
  198    HZ3  LYS  25           HZ3      LYS  25  81.426 -19.097  -5.341
  199    H    HIS  26           H        HIS  26  82.877 -13.913   1.083
  200    HA   HIS  26           HA       HIS  26  84.328 -11.841  -0.072
  201    HB2  HIS  26           HB2      HIS  26  85.954 -12.375   1.935
  202    HB3  HIS  26           HB1      HIS  26  84.331 -11.762   2.243
  203    HD1  HIS  26           HD1      HIS  26  85.550 -15.292   1.438
  204    HD2  HIS  26           HD2      HIS  26  83.380 -13.259   4.360
  205    HE1  HIS  26           HE1      HIS  26  84.744 -17.043   3.081
  206    HE2  HIS  26           HE2      HIS  26  83.420 -15.819   4.869
  207    H    LYS  27           H        LYS  27  85.931 -11.807  -1.484
  208    HA   LYS  27           HA       LYS  27  87.853 -14.041  -1.561
  209    HB2  LYS  27           HB2      LYS  27  87.751 -14.155  -3.974
  210    HB3  LYS  27           HB3      LYS  27  86.121 -14.373  -3.336
  211    HG2  LYS  27           HG2      LYS  27  85.852 -11.825  -3.646
  212    HG3  LYS  27           HG3      LYS  27  87.305 -11.921  -4.642
  213    HD2  LYS  27           HD2      LYS  27  86.088 -13.819  -5.904
  214    HD3  LYS  27           HD3      LYS  27  84.626 -13.231  -5.109
  215    HE2  LYS  27           HE2      LYS  27  84.699 -12.080  -7.189
  216    HE3  LYS  27           HE3      LYS  27  85.269 -10.909  -5.999
  217    HZ1  LYS  27           HZ1      LYS  27  87.093 -10.724  -7.218
  218    HZ2  LYS  27           HZ2      LYS  27  86.641 -12.017  -8.224
  219    HZ3  LYS  27           HZ3      LYS  27  87.499 -12.313  -6.787
  220    H    THR  28           H        THR  28  89.888 -13.343  -1.564
  221    HA   THR  28           HA       THR  28  91.647 -11.857  -1.462
  222    HB   THR  28           HB       THR  28  90.525 -10.580  -3.939
  223    HG1  THR  28           HG1      THR  28  91.832 -12.626  -4.742
  224   HG21  THR  28          HG21      THR  28  93.299 -11.539  -3.182
  225   HG22  THR  28          HG22      THR  28  92.727  -9.882  -2.988
  226   HG23  THR  28          HG23      THR  28  92.871 -10.582  -4.600
  227    H    GLY  29           H        GLY  29  89.089 -11.046  -0.183
  228    HA2  GLY  29           HA2      GLY  29  89.757  -8.586   0.835
  229    HA3  GLY  29           HA3      GLY  29  88.761  -8.223  -0.569
  230    HA   PRO  30           HA       PRO  30  86.156  -9.586   3.196
  231    HB2  PRO  30           HB2      PRO  30  85.647  -7.231   4.450
  232    HB3  PRO  30           HB1      PRO  30  87.081  -8.211   4.818
  233    HG2  PRO  30           HG2      PRO  30  86.841  -5.781   3.104
  234    HG3  PRO  30           HG1      PRO  30  88.107  -6.221   4.264
  235    HD2  PRO  30           HD2      PRO  30  88.370  -6.559   1.547
  236    HD3  PRO  30           HD1      PRO  30  89.218  -7.560   2.746
  237    H    ASN  31           H        ASN  31  83.851  -9.055   3.539
  238    HA   ASN  31           HA       ASN  31  82.631  -8.029   1.082
  239    HB2  ASN  31           HB2      ASN  31  80.614  -9.072   1.852
  240    HB3  ASN  31           HB1      ASN  31  81.928 -10.211   2.134
  241   HD21  ASN  31          HD21      ASN  31  82.337 -10.847   4.298
  242   HD22  ASN  31          HD22      ASN  31  81.491 -10.227   5.632
  243    H    LEU  32           H        LEU  32  81.856  -6.030   0.941
  244    HA   LEU  32           HA       LEU  32  81.847  -4.284   3.232
  245    HB2  LEU  32           HB2      LEU  32  80.708  -3.575   0.541
  246    HB3  LEU  32           HB3      LEU  32  81.482  -2.524   1.721
  247    HG   LEU  32           HG       LEU  32  82.792  -4.595  -0.052
  248   HD11  LEU  32          HD11      LEU  32  84.031  -1.964   0.166
  249   HD12  LEU  32          HD12      LEU  32  82.346  -1.833  -0.331
  250   HD13  LEU  32          HD13      LEU  32  83.467  -2.815  -1.270
  251   HD21  LEU  32          HD21      LEU  32  84.908  -3.743   1.196
  252   HD22  LEU  32          HD22      LEU  32  83.904  -4.946   2.000
  253   HD23  LEU  32          HD23      LEU  32  83.784  -3.249   2.458
  254    H    HIS  33           H        HIS  33  79.967  -6.496   3.381
  255    HA   HIS  33           HA       HIS  33  77.318  -5.699   2.809
  256    HB2  HIS  33           HB2      HIS  33  78.340  -7.499   5.021
  257    HB3  HIS  33           HB1      HIS  33  76.662  -7.383   4.495
  258    HD1  HIS  33           HD1      HIS  33  78.004 -10.089   4.219
  259    HD2  HIS  33           HD2      HIS  33  78.115  -7.213   1.202
  260    HE1  HIS  33           HE1      HIS  33  78.457 -11.333   2.060
  261    HE2  HIS  33           HE2      HIS  33  78.528  -9.594   0.211
  262    H    GLY  34           H        GLY  34  75.853  -4.454   3.914
  263    HA2  GLY  34           HA2      GLY  34  75.298  -2.608   5.231
  264    HA3  GLY  34           HA3      GLY  34  75.619  -3.770   6.516
  265    H    LEU  35           H        LEU  35  78.112  -2.727   4.344
  266    HA   LEU  35           HA       LEU  35  80.085  -2.154   6.107
  267    HB2  LEU  35           HB2      LEU  35  80.432  -2.148   3.708
  268    HB3  LEU  35           HB3      LEU  35  79.423  -0.718   3.527
  269    HG   LEU  35           HG       LEU  35  81.174   0.332   5.227
  270   HD11  LEU  35          HD11      LEU  35  82.962  -1.614   3.782
  271   HD12  LEU  35          HD12      LEU  35  82.294  -2.007   5.364
  272   HD13  LEU  35          HD13      LEU  35  83.340  -0.600   5.173
  273   HD21  LEU  35          HD21      LEU  35  82.029  -0.150   2.366
  274   HD22  LEU  35          HD22      LEU  35  82.339   1.271   3.362
  275   HD23  LEU  35          HD23      LEU  35  80.706   0.936   2.788
  276    H    PHE  36           H        PHE  36  77.894   0.320   4.789
  277    HA   PHE  36           HA       PHE  36  78.770   2.460   6.332
  278    HB2  PHE  36           HB2      PHE  36  75.904   2.047   5.469
  279    HB3  PHE  36           HB1      PHE  36  76.753   3.575   5.706
  280    HD1  PHE  36           HD2      PHE  36  76.573   0.531   3.572
  281    HD2  PHE  36           HD1      PHE  36  78.153   4.505   3.996
  282    HE1  PHE  36           HE2      PHE  36  77.351   0.478   1.220
  283    HE2  PHE  36           HE1      PHE  36  78.923   4.451   1.650
  284    HZ   PHE  36           HZ       PHE  36  78.523   2.439   0.257
  285    H    GLY  37           H        GLY  37  79.128   1.938   8.502
  286    HA2  GLY  37           HA2      GLY  37  77.599   2.592  10.495
  287    HA3  GLY  37           HA3      GLY  37  76.783   1.096  10.080
  288    H    ARG  38           H        ARG  38  79.399  -0.216   9.369
  289    HA   ARG  38           HA       ARG  38  80.036  -1.036  12.099
  290    HB2  ARG  38           HB2      ARG  38  80.377  -2.173   9.391
  291    HB3  ARG  38           HB3      ARG  38  81.655  -2.561  10.542
  292    HG2  ARG  38           HG2      ARG  38  79.804  -3.233  12.171
  293    HG3  ARG  38           HG3      ARG  38  78.692  -3.120  10.807
  294    HD2  ARG  38           HD2      ARG  38  81.160  -4.703  10.332
  295    HD3  ARG  38           HD3      ARG  38  80.014  -5.398  11.468
  296    HE   ARG  38           HE       ARG  38  78.311  -5.054   9.606
  297   HH11  ARG  38          HH21      ARG  38  81.709  -5.527   8.998
  298   HH12  ARG  38          HH22      ARG  38  81.457  -6.230   7.438
  299   HH21  ARG  38          HH11      ARG  38  78.006  -5.992   7.576
  300   HH22  ARG  38          HH12      ARG  38  79.372  -6.500   6.640
  301    H    LYS  39           H        LYS  39  82.078  -1.045  13.023
  302    HA   LYS  39           HA       LYS  39  83.723   1.211  12.458
  303    HB2  LYS  39           HB2      LYS  39  83.811  -1.079  14.376
  304    HB3  LYS  39           HB3      LYS  39  85.267  -0.113  14.148
  305    HG2  LYS  39           HG2      LYS  39  82.664   1.313  14.590
  306    HG3  LYS  39           HG3      LYS  39  83.455   0.563  15.975
  307    HD2  LYS  39           HD2      LYS  39  85.559   1.801  15.365
  308    HD3  LYS  39           HD3      LYS  39  84.641   2.647  14.118
  309    HE2  LYS  39           HE2      LYS  39  83.046   3.409  15.905
  310    HE3  LYS  39           HE3      LYS  39  84.129   2.702  17.104
  311    HZ1  LYS  39           HZ1      LYS  39  85.644   4.319  16.824
  312    HZ2  LYS  39           HZ2      LYS  39  84.312   5.213  16.263
  313    HZ3  LYS  39           HZ3      LYS  39  85.365   4.466  15.158
  314    H    THR  40           H        THR  40  86.136   1.002  12.182
  315    HA   THR  40           HA       THR  40  86.730  -0.299   9.757
  316    HB   THR  40           HB       THR  40  89.157   0.260  10.480
  317    HG1  THR  40           HG1      THR  40  87.978   2.018  12.263
  318   HG21  THR  40          HG21      THR  40  87.938   1.628   8.898
  319   HG22  THR  40          HG22      THR  40  88.719   2.692  10.068
  320   HG23  THR  40          HG23      THR  40  86.993   2.356  10.197
  321    H    GLY  41           H        GLY  41  87.937  -2.079   9.247
  322    HA2  GLY  41           HA2      GLY  41  88.495  -4.301   9.467
  323    HA3  GLY  41           HA3      GLY  41  89.491  -3.704  10.791
  324    H    GLN  42           H        GLN  42  85.973  -4.052  10.356
  325    HA   GLN  42           HA       GLN  42  85.895  -5.574  12.899
  326    HB2  GLN  42           HB2      GLN  42  84.776  -3.376  13.010
  327    HB3  GLN  42           HB1      GLN  42  83.734  -3.849  11.668
  328    HG2  GLN  42           HG2      GLN  42  82.697  -5.571  12.946
  329    HG3  GLN  42           HG1      GLN  42  83.930  -5.484  14.203
  330   HE21  GLN  42          HE21      GLN  42  81.822  -3.024  12.587
  331   HE22  GLN  42          HE22      GLN  42  81.274  -2.341  14.041
  332    H    ALA  43           H        ALA  43  85.209  -5.641   9.536
  333    HA   ALA  43           HA       ALA  43  83.090  -7.502   9.494
  334    HB1  ALA  43           HB1      ALA  43  84.780  -7.894   7.217
  335    HB2  ALA  43           HB2      ALA  43  84.744  -6.173   7.598
  336    HB3  ALA  43           HB3      ALA  43  83.239  -7.041   7.304
  337    HA   PRO  44           HA       PRO  44  85.549 -11.031  10.806
  338    HB2  PRO  44           HB2      PRO  44  83.562 -12.866  10.902
  339    HB3  PRO  44           HB1      PRO  44  83.699 -11.567  12.105
  340    HG2  PRO  44           HG2      PRO  44  81.903 -11.767   9.733
  341    HG3  PRO  44           HG1      PRO  44  81.553 -11.169  11.365
  342    HD2  PRO  44           HD2      PRO  44  82.098  -9.525   9.209
  343    HD3  PRO  44           HD1      PRO  44  82.362  -9.061  10.905
  344    H    GLY  45           H        GLY  45  86.901 -11.618   9.128
  345    HA2  GLY  45           HA2      GLY  45  86.398 -13.846   7.563
  346    HA3  GLY  45           HA3      GLY  45  85.977 -12.463   6.561
  347    H    PHE  46           H        PHE  46  87.625 -10.907   6.058
  348    HA   PHE  46           HA       PHE  46  90.157 -12.104   5.504
  349    HB2  PHE  46           HB2      PHE  46  88.993 -10.326   4.118
  350    HB3  PHE  46           HB1      PHE  46  89.495  -9.163   5.346
  351    HD1  PHE  46           HD2      PHE  46  91.906  -8.748   5.777
  352    HD2  PHE  46           HD1      PHE  46  90.582 -11.292   2.581
  353    HE1  PHE  46           HE2      PHE  46  94.157  -8.619   4.742
  354    HE2  PHE  46           HE1      PHE  46  92.832 -11.164   1.546
  355    HZ   PHE  46           HZ       PHE  46  94.620  -9.828   2.627
  356    H    THR  47           H        THR  47  92.230 -11.382   6.214
  357    HA   THR  47           HA       THR  47  92.315 -10.853   9.056
  358    HB   THR  47           HB       THR  47  94.603 -11.075   7.093
  359    HG1  THR  47           HG1      THR  47  94.585 -13.259   8.165
  360   HG21  THR  47          HG21      THR  47  95.213 -10.069   9.240
  361   HG22  THR  47          HG22      THR  47  95.868 -11.702   9.131
  362   HG23  THR  47          HG23      THR  47  94.427 -11.392  10.101
  363    H    TYR  48           H        TYR  48  91.373  -8.726   9.062
  364    HA   TYR  48           HA       TYR  48  92.333  -6.501   7.665
  365    HB2  TYR  48           HB2      TYR  48  90.902  -6.871  10.274
  366    HB3  TYR  48           HB3      TYR  48  91.474  -5.269   9.823
  367    HD1  TYR  48           HD2      TYR  48  90.981  -4.628   7.276
  368    HD2  TYR  48           HD1      TYR  48  88.750  -7.466   9.597
  369    HE1  TYR  48           HE2      TYR  48  89.037  -4.320   5.776
  370    HE2  TYR  48           HE1      TYR  48  86.801  -7.155   8.097
  371    HH   TYR  48           HH       TYR  48  86.346  -4.665   6.179
  372    H    THR  49           H        THR  49  93.769  -4.834   8.232
  373    HA   THR  49           HA       THR  49  96.105  -5.745   9.697
  374    HB   THR  49           HB       THR  49  97.105  -3.625   8.966
  375    HG1  THR  49           HG1      THR  49  94.448  -3.131   8.141
  376   HG21  THR  49          HG21      THR  49  95.607  -4.516   6.544
  377   HG22  THR  49          HG22      THR  49  96.559  -5.730   7.398
  378   HG23  THR  49          HG23      THR  49  97.340  -4.280   6.768
  379    H    ASP  50           H        ASP  50  97.023  -4.659  11.508
  380    HA   ASP  50           HA       ASP  50  95.401  -4.141  13.649
  381    HB2  ASP  50           HB2      ASP  50  97.805  -4.402  13.893
  382    HB3  ASP  50           HB1      ASP  50  98.084  -2.882  13.045
  383    H    ALA  51           H        ALA  51  96.579  -1.791  11.272
  384    HA   ALA  51           HA       ALA  51  95.648   0.557  12.430
  385    HB1  ALA  51           HB1      ALA  51  97.039   0.659  10.481
  386    HB2  ALA  51           HB2      ALA  51  95.493   1.398  10.061
  387    HB3  ALA  51           HB3      ALA  51  95.862  -0.241   9.524
  388    H    ASN  52           H        ASN  52  93.936  -1.565  10.126
  389    HA   ASN  52           HA       ASN  52  91.496  -0.078  10.301
  390    HB2  ASN  52           HB2      ASN  52  92.529  -2.044   8.619
  391    HB3  ASN  52           HB1      ASN  52  91.218  -2.870   9.454
  392   HD21  ASN  52          HD21      ASN  52  90.306  -2.792   7.112
  393   HD22  ASN  52          HD22      ASN  52  89.407  -1.414   6.689
  394    H    LYS  53           H        LYS  53  92.932  -2.660  12.103
  395    HA   LYS  53           HA       LYS  53  90.451  -3.444  13.397
  396    HB2  LYS  53           HB2      LYS  53  91.717  -5.334  13.395
  397    HB3  LYS  53           HB3      LYS  53  93.222  -4.437  13.245
  398    HG2  LYS  53           HG2      LYS  53  93.224  -3.949  15.634
  399    HG3  LYS  53           HG3      LYS  53  91.639  -4.703  15.817
  400    HD2  LYS  53           HD2      LYS  53  92.646  -6.848  14.967
  401    HD3  LYS  53           HD3      LYS  53  94.226  -6.064  15.028
  402    HE2  LYS  53           HE2      LYS  53  94.006  -5.698  17.422
  403    HE3  LYS  53           HE3      LYS  53  92.358  -6.327  17.401
  404    HZ1  LYS  53           HZ1      LYS  53  93.517  -8.172  18.031
  405    HZ2  LYS  53           HZ2      LYS  53  94.903  -7.761  17.138
  406    HZ3  LYS  53           HZ3      LYS  53  93.535  -8.386  16.348
  407    H    ASN  54           H        ASN  54  92.768  -1.027  13.709
  408    HA   ASN  54           HA       ASN  54  92.902  -0.719  16.522
  409    HB2  ASN  54           HB2      ASN  54  94.064   1.202  16.066
  410    HB3  ASN  54           HB1      ASN  54  94.233   0.402  14.510
  411   HD21  ASN  54          HD21      ASN  54  91.535   0.888  13.549
  412   HD22  ASN  54          HD22      ASN  54  91.379   2.557  13.288
  413    H    LYS  55           H        LYS  55  90.461  -0.119  14.228
  414    HA   LYS  55           HA       LYS  55  88.335   0.761  14.385
  415    HB2  LYS  55           HB2      LYS  55  88.614   0.803  17.377
  416    HB3  LYS  55           HB3      LYS  55  87.183   0.474  16.401
  417    HG2  LYS  55           HG2      LYS  55  88.601  -1.573  15.533
  418    HG3  LYS  55           HG3      LYS  55  89.502  -1.328  17.030
  419    HD2  LYS  55           HD2      LYS  55  87.344  -1.429  18.292
  420    HD3  LYS  55           HD3      LYS  55  86.521  -1.820  16.781
  421    HE2  LYS  55           HE2      LYS  55  88.204  -3.754  16.562
  422    HE3  LYS  55           HE3      LYS  55  88.585  -3.457  18.258
  423    HZ1  LYS  55           HZ1      LYS  55  86.529  -4.983  17.306
  424    HZ2  LYS  55           HZ2      LYS  55  85.771  -3.540  17.788
  425    HZ3  LYS  55           HZ3      LYS  55  86.707  -4.424  18.897
  426    H    GLY  56           H        GLY  56  89.775   2.691  13.606
  427    HA2  GLY  56           HA2      GLY  56  89.953   4.870  15.531
  428    HA3  GLY  56           HA3      GLY  56  90.493   4.908  13.857
  429    H    ILE  57           H        ILE  57  88.140   4.115  12.564
  430    HA   ILE  57           HA       ILE  57  86.116   6.091  13.386
  431    HB   ILE  57           HB       ILE  57  85.960   6.996  11.134
  432   HG12  ILE  57          HG12      ILE  57  88.072   6.300   9.645
  433   HG13  ILE  57          HG13      ILE  57  87.944   4.811  10.575
  434   HG21  ILE  57          HG21      ILE  57  88.829   6.970  12.114
  435   HG22  ILE  57          HG22      ILE  57  87.553   8.011  12.744
  436   HG23  ILE  57          HG23      ILE  57  88.096   8.191  11.075
  437   HD11  ILE  57          HD11      ILE  57  85.837   4.289   9.695
  438   HD12  ILE  57          HD12      ILE  57  86.626   5.043   8.316
  439   HD13  ILE  57          HD13      ILE  57  85.480   5.965   9.285
  440    H    THR  58           H        THR  58  84.242   5.904  11.609
  441    HA   THR  58           HA       THR  58  83.665   3.017  11.306
  442    HB   THR  58           HB       THR  58  81.770   5.283  11.953
  443    HG1  THR  58           HG1      THR  58  82.418   4.730  13.868
  444   HG21  THR  58          HG21      THR  58  81.306   2.353  11.376
  445   HG22  THR  58          HG22      THR  58  80.633   3.731  10.510
  446   HG23  THR  58          HG23      THR  58  80.113   3.385  12.159
  447    H    TRP  59           H        TRP  59  82.828   2.308   9.390
  448    HA   TRP  59           HA       TRP  59  83.245   3.883   7.068
  449    HB2  TRP  59           HB2      TRP  59  81.437   1.473   7.163
  450    HB3  TRP  59           HB1      TRP  59  82.443   2.048   5.831
  451    HD1  TRP  59           HD1      TRP  59  85.161   2.452   7.301
  452    HE1  TRP  59           HE1      TRP  59  86.503   0.417   8.144
  453    HE3  TRP  59           HE3      TRP  59  81.439  -1.035   7.566
  454    HZ2  TRP  59           HZ2      TRP  59  86.045  -2.315   8.868
  455    HZ3  TRP  59           HZ3      TRP  59  81.922  -3.340   8.328
  456    HH2  TRP  59           HH2      TRP  59  84.221  -3.983   8.980
  457    H    LYS  60           H        LYS  60  81.901   5.117   5.888
  458    HA   LYS  60           HA       LYS  60  79.030   5.081   6.288
  459    HB2  LYS  60           HB2      LYS  60  80.709   7.464   7.106
  460    HB3  LYS  60           HB3      LYS  60  78.971   7.542   6.826
  461    HG2  LYS  60           HG2      LYS  60  78.773   5.617   8.517
  462    HG3  LYS  60           HG3      LYS  60  80.445   5.972   8.946
  463    HD2  LYS  60           HD2      LYS  60  78.300   8.105   8.928
  464    HD3  LYS  60           HD3      LYS  60  78.650   7.131  10.355
  465    HE2  LYS  60           HE2      LYS  60  81.056   7.849  10.164
  466    HE3  LYS  60           HE3      LYS  60  80.568   8.955   8.881
  467    HZ1  LYS  60           HZ1      LYS  60  80.598  10.124  10.952
  468    HZ2  LYS  60           HZ2      LYS  60  79.611   8.956  11.691
  469    HZ3  LYS  60           HZ3      LYS  60  78.983   9.950  10.465
  470    H    GLU  61           H        GLU  61  78.303   7.369   5.038
  471    HA   GLU  61           HA       GLU  61  78.953   6.810   2.322
  472    HB2  GLU  61           HB2      GLU  61  76.771   7.743   3.080
  473    HB3  GLU  61           HB3      GLU  61  77.587   9.260   3.457
  474    HG2  GLU  61           HG2      GLU  61  78.186   9.609   1.161
  475    HG3  GLU  61           HG3      GLU  61  77.689   7.977   0.719
  476    H    GLU  62           H        GLU  62  79.552   9.737   4.292
  477    HA   GLU  62           HA       GLU  62  81.317  10.890   2.376
  478    HB2  GLU  62           HB2      GLU  62  81.153  11.518   5.331
  479    HB3  GLU  62           HB3      GLU  62  81.752  12.569   4.047
  480    HG2  GLU  62           HG2      GLU  62  79.435  12.375   2.993
  481    HG3  GLU  62           HG3      GLU  62  78.911  11.644   4.509
  482    H    THR  63           H        THR  63  81.856   9.081   5.389
  483    HA   THR  63           HA       THR  63  84.627   9.327   5.547
  484    HB   THR  63           HB       THR  63  84.596   7.239   6.825
  485    HG1  THR  63           HG1      THR  63  82.804   5.964   6.837
  486   HG21  THR  63          HG21      THR  63  82.319   9.164   7.252
  487   HG22  THR  63          HG22      THR  63  83.864   9.086   8.099
  488   HG23  THR  63          HG23      THR  63  82.643   7.845   8.377
  489    H    LEU  64           H        LEU  64  82.614   7.192   3.610
  490    HA   LEU  64           HA       LEU  64  84.720   5.564   2.625
  491    HB2  LEU  64           HB2      LEU  64  81.867   5.943   2.067
  492    HB3  LEU  64           HB3      LEU  64  82.802   5.542   0.633
  493    HG   LEU  64           HG       LEU  64  82.921   3.983   3.229
  494   HD11  LEU  64          HD11      LEU  64  81.812   2.324   1.329
  495   HD12  LEU  64          HD12      LEU  64  81.070   3.873   0.936
  496   HD13  LEU  64          HD13      LEU  64  80.901   3.201   2.557
  497   HD21  LEU  64          HD21      LEU  64  84.441   3.946   0.701
  498   HD22  LEU  64          HD22      LEU  64  83.794   2.369   1.153
  499   HD23  LEU  64          HD23      LEU  64  84.843   3.243   2.266
  500    H    MET  65           H        MET  65  83.288   8.617   1.544
  501    HA   MET  65           HA       MET  65  84.453   8.789  -0.996
  502    HB2  MET  65           HB2      MET  65  83.976  11.039   0.974
  503    HB3  MET  65           HB1      MET  65  84.247  11.228  -0.758
  504    HG2  MET  65           HG2      MET  65  82.228   9.977  -1.260
  505    HG3  MET  65           HG1      MET  65  81.983   9.624   0.447
  506    HE1  MET  65           HE1      MET  65  81.774  12.116  -2.423
  507    HE2  MET  65           HE2      MET  65  80.333  12.973  -1.879
  508    HE3  MET  65           HE3      MET  65  80.301  11.218  -2.031
  509    H    GLU  66           H        GLU  66  85.719  10.165   2.050
  510    HA   GLU  66           HA       GLU  66  88.191  10.997   1.008
  511    HB2  GLU  66           HB2      GLU  66  87.470  10.130   3.819
  512    HB3  GLU  66           HB3      GLU  66  88.951  10.979   3.377
  513    HG2  GLU  66           HG2      GLU  66  86.151  12.029   2.877
  514    HG3  GLU  66           HG3      GLU  66  87.179  12.519   4.223
  515    H    TYR  67           H        TYR  67  87.036   7.894   2.068
  516    HA   TYR  67           HA       TYR  67  89.637   6.654   2.207
  517    HB2  TYR  67           HB2      TYR  67  87.834   5.773   3.569
  518    HB3  TYR  67           HB3      TYR  67  86.836   5.521   2.141
  519    HD1  TYR  67           HD1      TYR  67  89.818   4.357   3.982
  520    HD2  TYR  67           HD2      TYR  67  87.207   3.658   0.643
  521    HE1  TYR  67           HE1      TYR  67  90.801   2.100   3.686
  522    HE2  TYR  67           HE2      TYR  67  88.192   1.402   0.346
  523    HH   TYR  67           HH       TYR  67  90.616   0.350   1.017
  524    H    LEU  68           H        LEU  68  87.168   7.150  -0.202
  525    HA   LEU  68           HA       LEU  68  88.166   5.190  -2.048
  526    HB2  LEU  68           HB2      LEU  68  86.129   7.397  -2.180
  527    HB3  LEU  68           HB3      LEU  68  86.648   6.591  -3.650
  528    HG   LEU  68           HG       LEU  68  85.397   5.272  -1.224
  529   HD11  LEU  68          HD11      LEU  68  84.441   5.653  -4.075
  530   HD12  LEU  68          HD12      LEU  68  83.815   6.490  -2.656
  531   HD13  LEU  68          HD13      LEU  68  83.590   4.747  -2.825
  532   HD21  LEU  68          HD21      LEU  68  86.838   4.173  -3.593
  533   HD22  LEU  68          HD22      LEU  68  85.346   3.365  -3.122
  534   HD23  LEU  68          HD23      LEU  68  86.668   3.510  -1.968
  535    H    GLU  69           H        GLU  69  88.900   8.524  -1.356
  536    HA   GLU  69           HA       GLU  69  90.345   8.816  -3.902
  537    HB2  GLU  69           HB2      GLU  69  90.446  11.124  -3.466
  538    HB3  GLU  69           HB3      GLU  69  88.851  10.644  -2.894
  539    HG2  GLU  69           HG2      GLU  69  89.942  10.342  -0.595
  540    HG3  GLU  69           HG3      GLU  69  91.319  11.221  -1.256
  541    H    ASN  70           H        ASN  70  90.926   7.653  -0.867
  542    HA   ASN  70           HA       ASN  70  93.727   7.428  -1.277
  543    HB2  ASN  70           HB2      ASN  70  94.518   8.825   0.569
  544    HB3  ASN  70           HB1      ASN  70  93.701   9.804  -0.645
  545   HD21  ASN  70          HD21      ASN  70  93.375   8.455   2.631
  546   HD22  ASN  70          HD22      ASN  70  92.066   9.439   3.083
  547    HA   PRO  71           HA       PRO  71  91.317   4.482   1.557
  548    HB2  PRO  71           HB2      PRO  71  93.128   2.692  -0.012
  549    HB3  PRO  71           HB1      PRO  71  91.439   2.447   0.466
  550    HG2  PRO  71           HG2      PRO  71  92.119   3.120  -2.031
  551    HG3  PRO  71           HG1      PRO  71  90.624   3.696  -1.276
  552    HD2  PRO  71           HD2      PRO  71  93.118   5.198  -1.879
  553    HD3  PRO  71           HD1      PRO  71  91.451   5.793  -1.718
  554    H    LYS  72           H        LYS  72  94.720   4.751   0.631
  555    HA   LYS  72           HA       LYS  72  95.700   3.388   2.970
  556    HB2  LYS  72           HB2      LYS  72  96.878   3.415   0.770
  557    HB3  LYS  72           HB3      LYS  72  97.207   5.128   1.013
  558    HG2  LYS  72           HG2      LYS  72  99.041   4.575   2.206
  559    HG3  LYS  72           HG3      LYS  72  97.993   3.841   3.417
  560    HD2  LYS  72           HD2      LYS  72  98.900   2.381   0.920
  561    HD3  LYS  72           HD3      LYS  72  99.765   2.298   2.453
  562    HE2  LYS  72           HE2      LYS  72  96.896   1.452   1.955
  563    HE3  LYS  72           HE3      LYS  72  98.262   0.395   2.307
  564    HZ1  LYS  72           HZ1      LYS  72  98.473   1.864   4.403
  565    HZ2  LYS  72           HZ2      LYS  72  97.297   0.638   4.360
  566    HZ3  LYS  72           HZ3      LYS  72  96.852   2.256   4.094
  567    H    LYS  73           H        LYS  73  95.692   6.792   1.888
  568    HA   LYS  73           HA       LYS  73  97.013   7.797   4.172
  569    HB2  LYS  73           HB2      LYS  73  96.464   8.903   1.838
  570    HB3  LYS  73           HB3      LYS  73  95.035   9.485   2.689
  571    HG2  LYS  73           HG2      LYS  73  96.612  10.310   4.517
  572    HG3  LYS  73           HG3      LYS  73  97.934   9.974   3.398
  573    HD2  LYS  73           HD2      LYS  73  97.515  12.197   2.873
  574    HD3  LYS  73           HD3      LYS  73  96.444  11.400   1.723
  575    HE2  LYS  73           HE2      LYS  73  94.686  11.547   3.670
  576    HE3  LYS  73           HE3      LYS  73  95.752  12.809   4.287
  577    HZ1  LYS  73           HZ1      LYS  73  95.464  14.084   2.367
  578    HZ2  LYS  73           HZ2      LYS  73  93.904  13.521   2.733
  579    HZ3  LYS  73           HZ3      LYS  73  94.802  12.796   1.487
  580    H    TYR  74           H        TYR  74  93.687   6.913   3.619
  581    HA   TYR  74           HA       TYR  74  92.563   8.459   5.735
  582    HB2  TYR  74           HB2      TYR  74  91.436   7.163   3.708
  583    HB3  TYR  74           HB3      TYR  74  91.320   5.870   4.901
  584    HD1  TYR  74           HD1      TYR  74  90.807   9.594   4.743
  585    HD2  TYR  74           HD2      TYR  74  89.363   5.809   6.174
  586    HE1  TYR  74           HE1      TYR  74  88.860  10.726   5.776
  587    HE2  TYR  74           HE2      TYR  74  87.417   6.944   7.207
  588    HH   TYR  74           HH       TYR  74  86.810  10.385   6.695
  589    H    ILE  75           H        ILE  75  93.284   4.966   5.520
  590    HA   ILE  75           HA       ILE  75  93.748   4.977   8.444
  591    HB   ILE  75           HB       ILE  75  92.390   2.783   6.853
  592   HG12  ILE  75          HG12      ILE  75  91.142   4.431   9.053
  593   HG13  ILE  75          HG13      ILE  75  91.132   5.016   7.391
  594   HG21  ILE  75          HG21      ILE  75  93.244   3.082   9.735
  595   HG22  ILE  75          HG22      ILE  75  93.534   1.732   8.639
  596   HG23  ILE  75          HG23      ILE  75  91.919   2.008   9.288
  597   HD11  ILE  75          HD11      ILE  75  89.075   3.712   8.002
  598   HD12  ILE  75          HD12      ILE  75  90.099   2.294   8.229
  599   HD13  ILE  75          HD13      ILE  75  89.958   3.035   6.635
  600    HA   PRO  76           HA       PRO  76  97.553   3.734   5.958
  601    HB2  PRO  76           HB2      PRO  76  98.541   4.547   8.675
  602    HB3  PRO  76           HB1      PRO  76  99.263   4.842   7.080
  603    HG2  PRO  76           HG2      PRO  76  97.928   6.752   8.373
  604    HG3  PRO  76           HG1      PRO  76  97.847   6.589   6.610
  605    HD2  PRO  76           HD2      PRO  76  95.766   5.980   8.641
  606    HD3  PRO  76           HD1      PRO  76  95.578   6.391   6.923
  607    H    GLY  77           H        GLY  77  98.190   1.660   5.910
  608    HA2  GLY  77           HA2      GLY  77  99.222  -0.206   7.163
  609    HA3  GLY  77           HA3      GLY  77  97.968   0.030   8.378
  610    H    THR  78           H        THR  78  95.867   0.531   6.429
  611    HA   THR  78           HA       THR  78  94.817  -2.030   6.103
  612    HB   THR  78           HB       THR  78  93.540   0.129   5.994
  613    HG1  THR  78           HG1      THR  78  93.288  -1.741   3.881
  614   HG21  THR  78          HG21      THR  78  93.548   1.430   4.010
  615   HG22  THR  78          HG22      THR  78  94.426   0.191   3.111
  616   HG23  THR  78          HG23      THR  78  95.250   1.124   4.360
  617    H    LYS  79           H        LYS  79  94.757  -3.500   4.412
  618    HA   LYS  79           HA       LYS  79  96.910  -3.193   2.441
  619    HB2  LYS  79           HB2      LYS  79  95.206  -5.534   3.287
  620    HB3  LYS  79           HB3      LYS  79  96.274  -5.604   1.890
  621    HG2  LYS  79           HG2      LYS  79  97.408  -4.590   4.469
  622    HG3  LYS  79           HG3      LYS  79  97.124  -6.323   4.316
  623    HD2  LYS  79           HD2      LYS  79  98.525  -6.454   2.355
  624    HD3  LYS  79           HD3      LYS  79  98.672  -4.699   2.281
  625    HE2  LYS  79           HE2      LYS  79  99.663  -6.421   4.571
  626    HE3  LYS  79           HE3      LYS  79 100.681  -5.762   3.291
  627    HZ1  LYS  79           HZ1      LYS  79  99.237  -3.627   4.221
  628    HZ2  LYS  79           HZ2      LYS  79 100.870  -3.962   4.550
  629    HZ3  LYS  79           HZ3      LYS  79  99.660  -4.483   5.623
  630    H    MET  80           H        MET  80  96.054  -1.700   1.005
  631    HA   MET  80           HA       MET  80  94.487  -2.750  -1.113
  632    HB2  MET  80           HB2      MET  80  92.564  -2.425   0.289
  633    HB3  MET  80           HB1      MET  80  93.109  -0.815   0.760
  634    HG2  MET  80           HG2      MET  80  92.694   0.081  -1.398
  635    HG3  MET  80           HG1      MET  80  92.579  -1.519  -2.129
  636    HE1  MET  80           HE1      MET  80  90.316   1.427  -1.240
  637    HE2  MET  80           HE2      MET  80  89.170   0.536  -2.233
  638    HE3  MET  80           HE3      MET  80  90.856   0.649  -2.732
  639    H    ILE  81           H        ILE  81  96.107  -1.967  -2.415
  640    HA   ILE  81           HA       ILE  81  96.208   0.970  -2.710
  641    HB   ILE  81           HB       ILE  81  98.601  -0.878  -2.882
  642   HG12  ILE  81          HG12      ILE  81  99.217   0.742  -0.850
  643   HG13  ILE  81          HG13      ILE  81  97.465   0.822  -0.681
  644   HG21  ILE  81          HG21      ILE  81  99.828   1.307  -2.969
  645   HG22  ILE  81          HG22      ILE  81  98.271   2.129  -3.090
  646   HG23  ILE  81          HG23      ILE  81  98.792   1.032  -4.369
  647   HD11  ILE  81          HD11      ILE  81  97.788  -1.050   0.592
  648   HD12  ILE  81          HD12      ILE  81  99.313  -1.448  -0.194
  649   HD13  ILE  81          HD13      ILE  81  97.787  -1.864  -0.970
  650    H    PHE  82           H        PHE  82  94.664   0.559  -4.430
  651    HA   PHE  82           HA       PHE  82  95.883  -0.636  -6.850
  652    HB2  PHE  82           HB2      PHE  82  93.884  -1.825  -6.290
  653    HB3  PHE  82           HB1      PHE  82  92.994  -0.329  -6.014
  654    HD1  PHE  82           HD1      PHE  82  95.150  -1.763  -8.744
  655    HD2  PHE  82           HD2      PHE  82  91.488   0.230  -7.702
  656    HE1  PHE  82           HE1      PHE  82  94.497  -1.711 -11.135
  657    HE2  PHE  82           HE2      PHE  82  90.837   0.281 -10.094
  658    HZ   PHE  82           HZ       PHE  82  92.341  -0.689 -11.810
  659    H    ALA  83           H        ALA  83  93.109   1.535  -6.591
  660    HA   ALA  83           HA       ALA  83  94.575   3.822  -7.586
  661    HB1  ALA  83           HB1      ALA  83  92.444   2.644  -9.374
  662    HB2  ALA  83           HB2      ALA  83  94.165   2.346  -9.613
  663    HB3  ALA  83           HB3      ALA  83  93.531   3.987  -9.726
  664    H    GLY  84           H        GLY  84  93.735   5.311  -6.264
  665    HA2  GLY  84           HA2      GLY  84  91.156   5.202  -5.106
  666    HA3  GLY  84           HA3      GLY  84  92.207   6.614  -5.138
  667    H    ILE  85           H        ILE  85  89.752   7.357  -5.346
  668    HA   ILE  85           HA       ILE  85  88.898   7.390  -8.156
  669    HB   ILE  85           HB       ILE  85  87.598   8.327  -5.596
  670   HG12  ILE  85          HG12      ILE  85  87.766   5.813  -6.370
  671   HG13  ILE  85          HG13      ILE  85  86.230   6.440  -5.783
  672   HG21  ILE  85          HG21      ILE  85  86.775   8.665  -8.478
  673   HG22  ILE  85          HG22      ILE  85  86.819   9.879  -7.199
  674   HG23  ILE  85          HG23      ILE  85  85.581   8.623  -7.181
  675   HD11  ILE  85          HD11      ILE  85  86.317   5.087  -8.040
  676   HD12  ILE  85          HD12      ILE  85  86.842   6.628  -8.716
  677   HD13  ILE  85          HD13      ILE  85  85.282   6.505  -7.903
  678    H    LYS  86           H        LYS  86  88.352   9.429  -9.193
  679    HA   LYS  86           HA       LYS  86  90.266  11.536  -8.455
  680    HB2  LYS  86           HB2      LYS  86  88.847  10.794 -11.001
  681    HB3  LYS  86           HB3      LYS  86  89.586  12.383 -10.808
  682    HG2  LYS  86           HG2      LYS  86  91.219   9.975 -10.086
  683    HG3  LYS  86           HG3      LYS  86  90.974  10.331 -11.796
  684    HD2  LYS  86           HD2      LYS  86  91.958  12.501 -11.586
  685    HD3  LYS  86           HD3      LYS  86  91.931  12.417  -9.824
  686    HE2  LYS  86           HE2      LYS  86  93.589  10.645  -9.824
  687    HE3  LYS  86           HE3      LYS  86  93.532  10.540 -11.584
  688    HZ1  LYS  86           HZ1      LYS  86  95.217  12.107 -10.116
  689    HZ2  LYS  86           HZ2      LYS  86  94.040  13.199 -10.673
  690    HZ3  LYS  86           HZ3      LYS  86  94.913  12.250 -11.780
  691    H    LYS  87           H        LYS  87  87.047  11.609 -10.014
  692    HA   LYS  87           HA       LYS  87  86.507  14.192  -8.817
  693    HB2  LYS  87           HB2      LYS  87  84.537  12.530 -10.375
  694    HB3  LYS  87           HB3      LYS  87  84.622  14.285 -10.228
  695    HG2  LYS  87           HG2      LYS  87  86.855  14.196 -11.397
  696    HG3  LYS  87           HG3      LYS  87  86.566  12.481 -11.694
  697    HD2  LYS  87           HD2      LYS  87  84.449  13.074 -12.868
  698    HD3  LYS  87           HD3      LYS  87  84.830  14.781 -12.641
  699    HE2  LYS  87           HE2      LYS  87  85.616  14.273 -14.824
  700    HE3  LYS  87           HE3      LYS  87  87.061  14.269 -13.812
  701    HZ1  LYS  87           HZ1      LYS  87  86.764  12.326 -15.377
  702    HZ2  LYS  87           HZ2      LYS  87  85.511  11.808 -14.353
  703    HZ3  LYS  87           HZ3      LYS  87  87.097  11.944 -13.759
  704    H    LYS  88           H        LYS  88  84.456  14.638  -7.703
  705    HA   LYS  88           HA       LYS  88  84.124  12.903  -5.457
  706    HB2  LYS  88           HB2      LYS  88  83.829  15.428  -5.469
  707    HB3  LYS  88           HB3      LYS  88  82.278  15.150  -6.265
  708    HG2  LYS  88           HG2      LYS  88  81.738  13.551  -4.340
  709    HG3  LYS  88           HG3      LYS  88  83.147  14.223  -3.520
  710    HD2  LYS  88           HD2      LYS  88  81.507  15.646  -2.707
  711    HD3  LYS  88           HD3      LYS  88  81.986  16.536  -4.152
  712    HE2  LYS  88           HE2      LYS  88  80.144  15.410  -5.407
  713    HE3  LYS  88           HE3      LYS  88  79.636  14.632  -3.908
  714    HZ1  LYS  88           HZ1      LYS  88  78.333  16.475  -3.856
  715    HZ2  LYS  88           HZ2      LYS  88  79.442  17.439  -4.711
  716    HZ3  LYS  88           HZ3      LYS  88  79.695  17.102  -3.065
  717    H    THR  89           H        THR  89  81.958  13.826  -8.149
  718    HA   THR  89           HA       THR  89  79.778  12.250  -7.503
  719    HB   THR  89           HB       THR  89  79.320  12.157  -9.953
  720    HG1  THR  89           HG1      THR  89  81.804  13.520 -10.090
  721   HG21  THR  89          HG21      THR  89  78.735  14.126  -8.517
  722   HG22  THR  89          HG22      THR  89  79.029  14.555 -10.204
  723   HG23  THR  89          HG23      THR  89  80.265  14.869  -8.986
  724    H    GLU  90           H        GLU  90  82.888  11.303  -8.767
  725    HA   GLU  90           HA       GLU  90  82.138   8.702  -9.655
  726    HB2  GLU  90           HB2      GLU  90  84.762   9.958  -8.864
  727    HB3  GLU  90           HB3      GLU  90  84.650   8.249  -9.273
  728    HG2  GLU  90           HG2      GLU  90  83.781   8.773 -11.471
  729    HG3  GLU  90           HG3      GLU  90  83.686  10.486 -11.069
  730    H    ARG  91           H        ARG  91  83.188  10.086  -6.594
  731    HA   ARG  91           HA       ARG  91  83.324   7.547  -5.223
  732    HB2  ARG  91           HB2      ARG  91  83.177  10.359  -4.098
  733    HB3  ARG  91           HB3      ARG  91  83.613   8.902  -3.203
  734    HG2  ARG  91           HG2      ARG  91  85.512   8.567  -4.815
  735    HG3  ARG  91           HG3      ARG  91  85.131  10.141  -5.513
  736    HD2  ARG  91           HD2      ARG  91  85.339  10.259  -2.597
  737    HD3  ARG  91           HD3      ARG  91  86.824   9.684  -3.345
  738    HE   ARG  91           HE       ARG  91  86.145  11.863  -4.849
  739   HH11  ARG  91          HH21      ARG  91  86.567  11.229  -1.471
  740   HH12  ARG  91          HH22      ARG  91  87.085  12.838  -1.094
  741   HH21  ARG  91          HH11      ARG  91  86.823  13.975  -4.358
  742   HH22  ARG  91          HH12      ARG  91  87.231  14.391  -2.727
  743    H    GLU  92           H        GLU  92  81.046  10.286  -5.305
  744    HA   GLU  92           HA       GLU  92  79.187   9.252  -3.462
  745    HB2  GLU  92           HB2      GLU  92  79.279  11.610  -4.446
  746    HB3  GLU  92           HB3      GLU  92  78.466  10.941  -5.862
  747    HG2  GLU  92           HG2      GLU  92  76.747  11.801  -4.422
  748    HG3  GLU  92           HG3      GLU  92  76.690  10.044  -4.293
  749    H    ASP  93           H        ASP  93  79.178   9.119  -7.033
  750    HA   ASP  93           HA       ASP  93  76.914   7.472  -7.295
  751    HB2  ASP  93           HB2      ASP  93  79.341   7.780  -9.076
  752    HB3  ASP  93           HB1      ASP  93  77.879   6.909  -9.538
  753    H    LEU  94           H        LEU  94  80.377   6.641  -7.208
  754    HA   LEU  94           HA       LEU  94  80.120   3.858  -7.429
  755    HB2  LEU  94           HB2      LEU  94  82.293   4.943  -7.624
  756    HB3  LEU  94           HB3      LEU  94  82.181   5.511  -5.960
  757    HG   LEU  94           HG       LEU  94  82.265   3.249  -5.109
  758   HD11  LEU  94          HD11      LEU  94  81.076   1.933  -6.635
  759   HD12  LEU  94          HD12      LEU  94  82.739   1.423  -6.916
  760   HD13  LEU  94          HD13      LEU  94  81.968   2.561  -8.020
  761   HD21  LEU  94          HD21      LEU  94  84.380   4.540  -6.131
  762   HD22  LEU  94          HD22      LEU  94  84.404   3.130  -7.190
  763   HD23  LEU  94          HD23      LEU  94  84.519   2.924  -5.445
  764    H    ILE  95           H        ILE  95  79.968   6.007  -4.655
  765    HA   ILE  95           HA       ILE  95  79.808   3.889  -2.741
  766    HB   ILE  95           HB       ILE  95  79.390   6.869  -2.585
  767   HG12  ILE  95          HG12      ILE  95  81.400   5.121  -1.155
  768   HG13  ILE  95          HG13      ILE  95  81.677   5.675  -2.801
  769   HG21  ILE  95          HG21      ILE  95  79.452   6.225  -0.005
  770   HG22  ILE  95          HG22      ILE  95  78.766   4.711  -0.594
  771   HG23  ILE  95          HG23      ILE  95  77.927   6.233  -0.890
  772   HD11  ILE  95          HD11      ILE  95  81.731   7.939  -2.164
  773   HD12  ILE  95          HD12      ILE  95  82.619   7.124  -0.880
  774   HD13  ILE  95          HD13      ILE  95  80.947   7.616  -0.620
  775    H    ALA  96           H        ALA  96  77.569   5.713  -4.660
  776    HA   ALA  96           HA       ALA  96  75.218   5.170  -3.149
  777    HB1  ALA  96           HB1      ALA  96  75.467   5.698  -6.119
  778    HB2  ALA  96           HB2      ALA  96  75.396   6.954  -4.883
  779    HB3  ALA  96           HB3      ALA  96  74.016   5.884  -5.134
  780    H    TYR  97           H        TYR  97  77.010   3.485  -5.652
  781    HA   TYR  97           HA       TYR  97  75.024   1.442  -6.062
  782    HB2  TYR  97           HB2      TYR  97  76.539   1.831  -7.877
  783    HB3  TYR  97           HB3      TYR  97  77.943   1.662  -6.823
  784    HD1  TYR  97           HD1      TYR  97  75.030  -0.196  -8.232
  785    HD2  TYR  97           HD2      TYR  97  78.899  -0.466  -6.388
  786    HE1  TYR  97           HE1      TYR  97  75.061  -2.638  -8.657
  787    HE2  TYR  97           HE2      TYR  97  78.929  -2.909  -6.814
  788    HH   TYR  97           HH       TYR  97  76.253  -4.506  -8.544
  789    H    LEU  98           H        LEU  98  77.871   1.914  -4.066
  790    HA   LEU  98           HA       LEU  98  78.219  -0.703  -3.108
  791    HB2  LEU  98           HB2      LEU  98  78.813   2.023  -1.987
  792    HB3  LEU  98           HB3      LEU  98  79.121   0.579  -1.030
  793    HG   LEU  98           HG       LEU  98  80.182   0.881  -3.847
  794   HD11  LEU  98          HD11      LEU  98  81.560   2.496  -3.092
  795   HD12  LEU  98          HD12      LEU  98  82.313   1.268  -2.080
  796   HD13  LEU  98          HD13      LEU  98  81.021   2.277  -1.428
  797   HD21  LEU  98          HD21      LEU  98  80.426  -1.355  -3.222
  798   HD22  LEU  98          HD22      LEU  98  80.627  -0.966  -1.515
  799   HD23  LEU  98          HD23      LEU  98  81.949  -0.682  -2.645
  800    H    LYS  99           H        LYS  99  76.231   1.992  -1.937
  801    HA   LYS  99           HA       LYS  99  75.239   0.761   0.386
  802    HB2  LYS  99           HB2      LYS  99  74.062   2.912  -1.379
  803    HB3  LYS  99           HB3      LYS  99  73.379   2.436   0.176
  804    HG2  LYS  99           HG2      LYS  99  75.398   3.073   1.340
  805    HG3  LYS  99           HG3      LYS  99  76.246   3.343  -0.183
  806    HD2  LYS  99           HD2      LYS  99  75.537   5.492   0.738
  807    HD3  LYS  99           HD3      LYS  99  74.624   5.153  -0.732
  808    HE2  LYS  99           HE2      LYS  99  72.662   4.635   0.454
  809    HE3  LYS  99           HE3      LYS  99  73.536   4.338   1.957
  810    HZ1  LYS  99           HZ1      LYS  99  74.155   6.906   1.388
  811    HZ2  LYS  99           HZ2      LYS  99  72.945   6.408   2.472
  812    HZ3  LYS  99           HZ3      LYS  99  72.543   6.807   0.871
  813    H    LYS 100           H        LYS 100  73.728   1.062  -2.838
  814    HA   LYS 100           HA       LYS 100  71.501  -0.599  -2.149
  815    HB2  LYS 100           HB2      LYS 100  72.554   0.250  -4.856
  816    HB3  LYS 100           HB3      LYS 100  70.988  -0.506  -4.561
  817    HG2  LYS 100           HG2      LYS 100  70.233   1.360  -3.255
  818    HG3  LYS 100           HG3      LYS 100  71.851   2.060  -3.206
  819    HD2  LYS 100           HD2      LYS 100  70.741   3.319  -4.870
  820    HD3  LYS 100           HD3      LYS 100  71.684   2.146  -5.788
  821    HE2  LYS 100           HE2      LYS 100  69.332   2.344  -6.606
  822    HE3  LYS 100           HE3      LYS 100  69.723   0.717  -6.053
  823    HZ1  LYS 100           HZ1      LYS 100  68.672   2.531  -4.044
  824    HZ2  LYS 100           HZ2      LYS 100  68.348   0.883  -4.299
  825    HZ3  LYS 100           HZ3      LYS 100  67.579   2.060  -5.252
  826    H    ALA 101           H        ALA 101  74.708  -1.222  -3.289
  827    HA   ALA 101           HA       ALA 101  74.071  -3.880  -4.293
  828    HB1  ALA 101           HB1      ALA 101  76.731  -2.491  -3.893
  829    HB2  ALA 101           HB2      ALA 101  75.818  -2.569  -5.401
  830    HB3  ALA 101           HB3      ALA 101  76.495  -4.040  -4.704
  831    H    THR 102           H        THR 102  75.226  -2.386  -1.375
  832    HA   THR 102           HA       THR 102  76.099  -4.932  -0.229
  833    HB   THR 102           HB       THR 102  76.627  -3.488   1.764
  834    HG1  THR 102           HG1      THR 102  76.530  -1.235   1.361
  835   HG21  THR 102          HG21      THR 102  78.439  -3.903   0.310
  836   HG22  THR 102          HG22      THR 102  78.417  -2.147   0.473
  837   HG23  THR 102          HG23      THR 102  77.751  -2.908  -0.972
  838    H    ASN 103           H        ASN 103  73.254  -3.333  -0.691
  839    HA   ASN 103           HA       ASN 103  72.033  -4.090   1.867
  840    HB2  ASN 103           HB2      ASN 103  71.141  -2.447  -0.493
  841    HB3  ASN 103           HB1      ASN 103  70.012  -2.964   0.753
  842   HD21  ASN 103          HD21      ASN 103  73.354  -2.269   1.596
  843   HD22  ASN 103          HD22      ASN 103  73.030  -0.828   2.432
  844    H    GLU 104           H        GLU 104  72.316  -5.143  -1.404
  845    HA   GLU 104           HA       GLU 104  70.817  -7.550  -0.817
  846    HB2  GLU 104           HB2      GLU 104  69.363  -7.242  -2.877
  847    HB3  GLU 104           HB3      GLU 104  68.942  -6.237  -1.490
  848    HG2  GLU 104           HG2      GLU 104  70.105  -4.334  -2.448
  849    HG3  GLU 104           HG3      GLU 104  70.710  -5.323  -3.775
  850    HHA  HEC 201           HA       HEC 105  89.410  -3.358   3.204
  851    HHB  HEC 201           HB       HEC 105  85.552  -0.003  -0.504
  852    HHC  HEC 201           HC       HEC 105  88.930  -1.750  -5.567
  853    HHD  HEC 201           HD       HEC 105  92.334  -5.643  -1.915
  854   HMA1  HEC 201          HMA1      HEC 105  85.456   0.821   1.671
  855   HMA2  HEC 201          HMA2      HEC 105  85.502   0.078   3.267
  856   HMA3  HEC 201          HMA3      HEC 105  84.505  -0.626   1.997
  857   HAA1  HEC 201          HAA1      HEC 105  87.007  -0.788   4.442
  858   HAA2  HEC 201          HAA2      HEC 105  88.414  -1.829   4.423
  859   HBA1  HEC 201          HBA1      HEC 105  87.168  -3.760   4.663
  860   HBA2  HEC 201          HBA2      HEC 105  85.728  -3.054   3.938
  861   HMB1  HEC 201          HMB1      HEC 105  84.128   0.021  -3.026
  862   HMB2  HEC 201          HMB2      HEC 105  84.932   1.250  -3.994
  863   HMB3  HEC 201          HMB3      HEC 105  85.001   1.332  -2.237
  864    HAB  HEC 201           HAB      HEC 105  87.371  -0.629  -6.256
  865   HBB1  HEC 201          HBB1      HEC 105  86.835   1.956  -4.881
  866   HBB2  HEC 201          HBB2      HEC 105  87.939   1.593  -6.204
  867   HBB3  HEC 201          HBB3      HEC 105  86.219   1.797  -6.526
  868   HMC1  HEC 201          HMC1      HEC 105  89.930  -3.272  -6.873
  869   HMC2  HEC 201          HMC2      HEC 105  91.354  -4.304  -6.879
  870   HMC3  HEC 201          HMC3      HEC 105  91.526  -2.568  -6.633
  871    HAC  HEC 201           HAC      HEC 105  92.765  -6.116  -3.833
  872   HBC1  HEC 201          HBC1      HEC 105  94.489  -5.506  -5.173
  873   HBC2  HEC 201          HBC2      HEC 105  93.676  -3.949  -5.326
  874   HBC3  HEC 201          HBC3      HEC 105  93.418  -5.202  -6.539
  875   HMD1  HEC 201          HMD1      HEC 105  92.438  -7.328   0.398
  876   HMD2  HEC 201          HMD2      HEC 105  93.309  -6.439   1.646
  877   HMD3  HEC 201          HMD3      HEC 105  93.601  -6.083  -0.055
  878   HAD1  HEC 201          HAD1      HEC 105  91.680  -6.288   3.253
  879   HAD2  HEC 201          HAD2      HEC 105  90.492  -5.120   3.787
  880   HBD1  HEC 201          HBD1      HEC 105  92.931  -3.722   3.161
  881   HBD2  HEC 201          HBD2      HEC 105  93.299  -5.079   4.220
  882    H1   HOH 301           H2       HOH 200  83.881   3.460  -1.148
  883    H2   HOH 301           H1       HOH 200  82.655   3.794  -0.323
  884    H1   HOH 302           H2       HOH 201  85.574   6.035   5.469
  885    H2   HOH 302           H1       HOH 201  86.887   5.463   5.958
  886    H1   HOH 303           H2       HOH 202  82.245  -5.443   5.210
  887    H2   HOH 303           H1       HOH 202  83.663  -5.196   4.748
  888    H1   HOH 304           H2       HOH 203  82.411 -10.839  -0.022
  889    H2   HOH 304           H1       HOH 203  83.449 -10.074   0.772
  Start of MODEL   24
    1    H1   GLY   1           H1       GLY   1  75.356  11.971  -7.598
    2    H2   GLY   1           H2       GLY   1  73.957  12.154  -6.651
    3    H3   GLY   1           H3       GLY   1  73.824  11.825  -8.312
    4    HA2  GLY   1           HA2      GLY   1  75.404   9.841  -7.047
    5    HA3  GLY   1           HA3      GLY   1  73.836   9.993  -6.254
    6    H    ASP   2           H        ASP   2  75.219   8.099  -8.350
    7    HA   ASP   2           HA       ASP   2  72.760   7.625  -9.863
    8    HB2  ASP   2           HB2      ASP   2  75.437   8.165 -11.157
    9    HB3  ASP   2           HB1      ASP   2  74.082   7.402 -11.986
   10    H    VAL   3           H        VAL   3  72.616   5.755  -8.585
   11    HA   VAL   3           HA       VAL   3  74.509   3.835  -8.073
   12    HB   VAL   3           HB       VAL   3  72.312   3.631  -7.130
   13   HG11  VAL   3          HG11      VAL   3  70.975   4.671  -8.843
   14   HG12  VAL   3          HG12      VAL   3  70.372   3.026  -8.644
   15   HG13  VAL   3          HG13      VAL   3  71.407   3.425 -10.014
   16   HG21  VAL   3          HG21      VAL   3  73.634   1.515  -7.812
   17   HG22  VAL   3          HG22      VAL   3  72.459   1.358  -9.116
   18   HG23  VAL   3          HG23      VAL   3  71.924   1.311  -7.437
   19    H    GLU   4           H        GLU   4  73.193   4.742 -11.119
   20    HA   GLU   4           HA       GLU   4  73.680   2.266 -12.490
   21    HB2  GLU   4           HB2      GLU   4  73.255   5.091 -13.480
   22    HB3  GLU   4           HB3      GLU   4  73.429   3.696 -14.546
   23    HG2  GLU   4           HG2      GLU   4  71.474   2.643 -13.606
   24    HG3  GLU   4           HG3      GLU   4  71.360   3.867 -12.343
   25    H    LYS   5           H        LYS   5  75.336   5.434 -12.663
   26    HA   LYS   5           HA       LYS   5  77.592   4.342 -14.046
   27    HB2  LYS   5           HB2      LYS   5  76.923   6.981 -12.784
   28    HB3  LYS   5           HB3      LYS   5  78.604   6.636 -13.197
   29    HG2  LYS   5           HG2      LYS   5  78.145   6.461 -15.490
   30    HG3  LYS   5           HG3      LYS   5  76.431   6.147 -15.225
   31    HD2  LYS   5           HD2      LYS   5  77.552   8.778 -14.318
   32    HD3  LYS   5           HD3      LYS   5  77.263   8.537 -16.041
   33    HE2  LYS   5           HE2      LYS   5  74.945   8.173 -15.720
   34    HE3  LYS   5           HE3      LYS   5  75.143   7.897 -13.990
   35    HZ1  LYS   5           HZ1      LYS   5  74.258  10.082 -14.360
   36    HZ2  LYS   5           HZ2      LYS   5  75.527  10.469 -15.423
   37    HZ3  LYS   5           HZ3      LYS   5  75.842  10.225 -13.771
   38    H    GLY   6           H        GLY   6  76.612   4.491 -10.770
   39    HA2  GLY   6           HA2      GLY   6  79.202   4.351  -9.554
   40    HA3  GLY   6           HA3      GLY   6  77.668   3.923  -8.791
   41    H    LYS   7           H        LYS   7  76.844   2.075 -10.802
   42    HA   LYS   7           HA       LYS   7  78.075  -0.306  -9.849
   43    HB2  LYS   7           HB2      LYS   7  75.704  -0.097 -10.689
   44    HB3  LYS   7           HB3      LYS   7  76.360   0.011 -12.322
   45    HG2  LYS   7           HG2      LYS   7  77.604  -2.187 -11.758
   46    HG3  LYS   7           HG3      LYS   7  76.489  -2.312 -10.400
   47    HD2  LYS   7           HD2      LYS   7  75.197  -3.414 -11.947
   48    HD3  LYS   7           HD3      LYS   7  74.715  -1.772 -12.374
   49    HE2  LYS   7           HE2      LYS   7  76.843  -3.462 -13.717
   50    HE3  LYS   7           HE3      LYS   7  75.322  -2.907 -14.416
   51    HZ1  LYS   7           HZ1      LYS   7  77.221  -1.555 -15.112
   52    HZ2  LYS   7           HZ2      LYS   7  77.520  -1.137 -13.494
   53    HZ3  LYS   7           HZ3      LYS   7  76.081  -0.643 -14.249
   54    H    LYS   8           H        LYS   8  78.306   1.559 -12.868
   55    HA   LYS   8           HA       LYS   8  79.965  -0.206 -14.295
   56    HB2  LYS   8           HB2      LYS   8  78.889   1.659 -15.397
   57    HB3  LYS   8           HB3      LYS   8  79.766   2.810 -14.393
   58    HG2  LYS   8           HG2      LYS   8  81.492   0.881 -15.832
   59    HG3  LYS   8           HG3      LYS   8  80.597   1.978 -16.880
   60    HD2  LYS   8           HD2      LYS   8  82.063   3.064 -14.483
   61    HD3  LYS   8           HD3      LYS   8  82.942   2.715 -15.972
   62    HE2  LYS   8           HE2      LYS   8  80.524   4.532 -15.733
   63    HE3  LYS   8           HE3      LYS   8  82.193   5.059 -15.944
   64    HZ1  LYS   8           HZ1      LYS   8  81.607   5.015 -18.102
   65    HZ2  LYS   8           HZ2      LYS   8  80.358   3.888 -17.869
   66    HZ3  LYS   8           HZ3      LYS   8  81.972   3.365 -17.968
   67    H    ILE   9           H        ILE   9  80.801   2.528 -12.178
   68    HA   ILE   9           HA       ILE   9  83.611   2.263 -12.445
   69    HB   ILE   9           HB       ILE   9  81.958   3.490 -10.230
   70   HG12  ILE   9          HG12      ILE   9  83.397   4.832 -12.535
   71   HG13  ILE   9          HG13      ILE   9  81.689   4.396 -12.594
   72   HG21  ILE   9          HG21      ILE   9  84.096   4.788  -9.835
   73   HG22  ILE   9          HG22      ILE   9  84.905   3.649 -10.911
   74   HG23  ILE   9          HG23      ILE   9  84.184   3.080  -9.407
   75   HD11  ILE   9          HD11      ILE   9  81.344   5.739 -10.494
   76   HD12  ILE   9          HD12      ILE   9  81.843   6.706 -11.881
   77   HD13  ILE   9          HD13      ILE   9  83.014   6.287 -10.632
   78    H    PHE  10           H        PHE  10  81.259   0.563 -10.574
   79    HA   PHE  10           HA       PHE  10  83.139  -0.409  -8.603
   80    HB2  PHE  10           HB2      PHE  10  81.008  -0.314  -7.701
   81    HB3  PHE  10           HB1      PHE  10  80.238  -0.847  -9.194
   82    HD1  PHE  10           HD1      PHE  10  80.209  -3.219  -9.827
   83    HD2  PHE  10           HD2      PHE  10  81.961  -1.915  -6.134
   84    HE1  PHE  10           HE1      PHE  10  80.248  -5.563  -9.023
   85    HE2  PHE  10           HE2      PHE  10  82.003  -4.259  -5.326
   86    HZ   PHE  10           HZ       PHE  10  81.147  -6.086  -6.776
   87    H    VAL  11           H        VAL  11  81.312  -1.928 -11.279
   88    HA   VAL  11           HA       VAL  11  82.349  -4.495 -11.057
   89    HB   VAL  11           HB       VAL  11  81.807  -4.746 -13.468
   90   HG11  VAL  11          HG11      VAL  11  80.096  -4.774 -11.561
   91   HG12  VAL  11          HG12      VAL  11  79.463  -4.484 -13.181
   92   HG13  VAL  11          HG13      VAL  11  79.674  -3.138 -12.064
   93   HG21  VAL  11          HG21      VAL  11  81.189  -1.789 -13.266
   94   HG22  VAL  11          HG22      VAL  11  80.881  -2.811 -14.668
   95   HG23  VAL  11          HG23      VAL  11  82.538  -2.480 -14.164
   96    H    GLN  12           H        GLN  12  83.766  -1.635 -12.487
   97    HA   GLN  12           HA       GLN  12  85.978  -3.221 -13.585
   98    HB2  GLN  12           HB2      GLN  12  86.643  -1.217 -14.726
   99    HB3  GLN  12           HB1      GLN  12  84.904  -1.429 -14.933
  100    HG2  GLN  12           HG2      GLN  12  84.579   0.111 -12.945
  101    HG3  GLN  12           HG1      GLN  12  86.309   0.455 -13.026
  102   HE21  GLN  12          HE21      GLN  12  85.665  -0.084 -16.158
  103   HE22  GLN  12          HE22      GLN  12  85.214   1.470 -16.661
  104    H    LYS  13           H        LYS  13  85.324  -1.090 -10.883
  105    HA   LYS  13           HA       LYS  13  88.213  -0.853 -10.360
  106    HB2  LYS  13           HB2      LYS  13  86.570   1.134 -10.351
  107    HB3  LYS  13           HB3      LYS  13  86.082   0.533  -8.766
  108    HG2  LYS  13           HG2      LYS  13  87.801   1.988  -8.171
  109    HG3  LYS  13           HG3      LYS  13  88.690   0.474  -8.325
  110    HD2  LYS  13           HD2      LYS  13  90.024   1.864  -9.620
  111    HD3  LYS  13           HD3      LYS  13  88.924   1.261 -10.857
  112    HE2  LYS  13           HE2      LYS  13  89.074   3.672 -11.080
  113    HE3  LYS  13           HE3      LYS  13  87.473   3.272 -10.461
  114    HZ1  LYS  13           HZ1      LYS  13  88.750   5.129  -9.313
  115    HZ2  LYS  13           HZ2      LYS  13  89.716   3.901  -8.644
  116    HZ3  LYS  13           HZ3      LYS  13  88.049   3.944  -8.324
  117    H    CYS  14           H        CYS  14  85.346  -1.377  -8.243
  118    HA   CYS  14           HA       CYS  14  87.071  -2.603  -6.269
  119    HB2  CYS  14           HB2      CYS  14  84.095  -2.530  -6.035
  120    HB3  CYS  14           HB1      CYS  14  85.309  -2.394  -4.770
  121    H    ALA  15           H        ALA  15  84.589  -3.811  -8.485
  122    HA   ALA  15           HA       ALA  15  84.072  -6.280  -7.396
  123    HB1  ALA  15           HB1      ALA  15  84.310  -5.333 -10.224
  124    HB2  ALA  15           HB2      ALA  15  82.879  -5.860  -9.339
  125    HB3  ALA  15           HB3      ALA  15  84.052  -7.048  -9.905
  126    H    GLN  16           H        GLN  16  87.028  -5.164  -8.843
  127    HA   GLN  16           HA       GLN  16  88.338  -7.427  -9.623
  128    HB2  GLN  16           HB2      GLN  16  89.336  -5.011  -8.134
  129    HB3  GLN  16           HB1      GLN  16  90.429  -6.288  -8.661
  130    HG2  GLN  16           HG2      GLN  16  89.905  -5.934 -10.953
  131    HG3  GLN  16           HG1      GLN  16  88.489  -4.960 -10.559
  132   HE21  GLN  16          HE21      GLN  16  88.960  -2.844 -11.174
  133   HE22  GLN  16          HE22      GLN  16  90.413  -2.036 -10.832
  134    H    CYS  17           H        CYS  17  88.627  -6.145  -6.279
  135    HA   CYS  17           HA       CYS  17  89.007  -8.943  -5.367
  136    HB2  CYS  17           HB2      CYS  17  90.182  -6.823  -3.684
  137    HB3  CYS  17           HB1      CYS  17  90.857  -8.367  -4.188
  138    H    HIS  18           H        HSD  18  86.434  -8.076  -5.414
  139    HA   HIS  18           HA       HSD  18  85.788  -8.069  -2.587
  140    HB2  HIS  18           HB2      HSD  18  85.204  -5.696  -4.342
  141    HB3  HIS  18           HB1      HSD  18  84.178  -6.079  -2.960
  142    HD1  HIS  18           HD1      HSD  18  86.598  -7.146  -1.143
  143    HD2  HIS  18           HD2      HSD  18  86.434  -3.480  -3.114
  144    HE1  HIS  18           HE1      HSD  18  88.190  -5.599   0.082
  145    H    THR  19           H        THR  19  83.211  -7.705  -2.476
  146    HA   THR  19           HA       THR  19  81.929  -9.211  -4.655
  147    HB   THR  19           HB       THR  19  81.194  -9.944  -1.860
  148    HG1  THR  19           HG1      THR  19  82.965 -11.569  -2.117
  149   HG21  THR  19          HG21      THR  19  80.569 -11.954  -2.850
  150   HG22  THR  19          HG22      THR  19  81.745 -11.793  -4.153
  151   HG23  THR  19          HG23      THR  19  80.280 -10.811  -4.161
  152    H    VAL  20           H        VAL  20  81.610  -7.261  -1.736
  153    HA   VAL  20           HA       VAL  20  79.892  -5.968  -0.921
  154    HB   VAL  20           HB       VAL  20  79.201  -4.225  -2.442
  155   HG11  VAL  20          HG11      VAL  20  82.023  -5.093  -3.136
  156   HG12  VAL  20          HG12      VAL  20  81.578  -4.299  -1.627
  157   HG13  VAL  20          HG13      VAL  20  81.385  -3.450  -3.159
  158   HG21  VAL  20          HG21      VAL  20  78.718  -5.863  -4.344
  159   HG22  VAL  20          HG22      VAL  20  80.446  -5.829  -4.676
  160   HG23  VAL  20          HG23      VAL  20  79.497  -4.353  -4.808
  161    H    GLU  21           H        GLU  21  79.045  -8.674  -1.723
  162    HA   GLU  21           HA       GLU  21  76.188  -8.056  -2.190
  163    HB2  GLU  21           HB2      GLU  21  75.915  -9.894  -3.623
  164    HB3  GLU  21           HB3      GLU  21  77.443  -9.191  -4.147
  165    HG2  GLU  21           HG2      GLU  21  78.580 -10.828  -2.548
  166    HG3  GLU  21           HG3      GLU  21  77.018 -11.637  -2.428
  167    H    LYS  22           H        LYS  22  74.958  -8.628  -0.548
  168    HA   LYS  22           HA       LYS  22  75.829  -9.803   1.800
  169    HB2  LYS  22           HB2      LYS  22  73.626  -8.560   1.303
  170    HB3  LYS  22           HB3      LYS  22  73.004 -10.131   0.802
  171    HG2  LYS  22           HG2      LYS  22  72.432 -10.200   3.043
  172    HG3  LYS  22           HG3      LYS  22  74.051 -10.892   3.138
  173    HD2  LYS  22           HD2      LYS  22  74.856  -8.445   3.439
  174    HD3  LYS  22           HD3      LYS  22  73.167  -8.085   3.799
  175    HE2  LYS  22           HE2      LYS  22  74.242  -8.536   5.901
  176    HE3  LYS  22           HE3      LYS  22  73.248  -9.943   5.525
  177    HZ1  LYS  22           HZ1      LYS  22  76.061  -9.849   4.663
  178    HZ2  LYS  22           HZ2      LYS  22  75.077 -11.200   4.970
  179    HZ3  LYS  22           HZ3      LYS  22  75.682 -10.276   6.261
  180    H    GLY  23           H        GLY  23  75.887 -11.848   2.633
  181    HA2  GLY  23           HA2      GLY  23  76.130 -14.135   2.629
  182    HA3  GLY  23           HA3      GLY  23  74.676 -14.148   1.639
  183    H    GLY  24           H        GLY  24  77.653 -12.575   0.638
  184    HA2  GLY  24           HA2      GLY  24  77.759 -14.295  -1.717
  185    HA3  GLY  24           HA3      GLY  24  78.705 -12.837  -1.441
  186    H    LYS  25           H        LYS  25  80.740 -13.560  -1.755
  187    HA   LYS  25           HA       LYS  25  81.840 -15.359   0.259
  188    HB2  LYS  25           HB2      LYS  25  83.093 -16.557  -1.692
  189    HB3  LYS  25           HB3      LYS  25  81.445 -17.049  -1.305
  190    HG2  LYS  25           HG2      LYS  25  80.535 -15.817  -3.129
  191    HG3  LYS  25           HG3      LYS  25  82.041 -14.935  -3.380
  192    HD2  LYS  25           HD2      LYS  25  83.154 -17.102  -3.965
  193    HD3  LYS  25           HD3      LYS  25  81.583 -17.893  -3.853
  194    HE2  LYS  25           HE2      LYS  25  80.700 -16.570  -5.660
  195    HE3  LYS  25           HE3      LYS  25  82.126 -15.533  -5.670
  196    HZ1  LYS  25           HZ1      LYS  25  83.282 -17.008  -6.856
  197    HZ2  LYS  25           HZ2      LYS  25  81.779 -17.708  -7.229
  198    HZ3  LYS  25           HZ3      LYS  25  82.719 -18.335  -5.960
  199    H    HIS  26           H        HIS  26  83.187 -13.839   1.072
  200    HA   HIS  26           HA       HIS  26  84.535 -11.844  -0.346
  201    HB2  HIS  26           HB2      HIS  26  86.198 -12.105   1.699
  202    HB3  HIS  26           HB1      HIS  26  84.569 -11.474   1.936
  203    HD1  HIS  26           HD1      HIS  26  82.794 -13.093   2.983
  204    HD2  HIS  26           HD2      HIS  26  86.652 -14.664   2.822
  205    HE1  HIS  26           HE1      HIS  26  82.795 -15.143   4.470
  206    HE2  HIS  26           HE2      HIS  26  85.140 -16.111   4.383
  207    H    LYS  27           H        LYS  27  86.158 -11.902  -1.738
  208    HA   LYS  27           HA       LYS  27  88.106 -14.117  -1.610
  209    HB2  LYS  27           HB2      LYS  27  88.100 -14.029  -4.166
  210    HB3  LYS  27           HB3      LYS  27  86.705 -14.793  -3.404
  211    HG2  LYS  27           HG2      LYS  27  85.391 -12.762  -3.656
  212    HG3  LYS  27           HG3      LYS  27  86.793 -11.894  -4.284
  213    HD2  LYS  27           HD2      LYS  27  86.835 -13.200  -6.278
  214    HD3  LYS  27           HD3      LYS  27  85.713 -14.387  -5.611
  215    HE2  LYS  27           HE2      LYS  27  84.607 -12.831  -7.216
  216    HE3  LYS  27           HE3      LYS  27  83.914 -12.737  -5.598
  217    HZ1  LYS  27           HZ1      LYS  27  86.107 -10.938  -6.402
  218    HZ2  LYS  27           HZ2      LYS  27  84.948 -10.729  -5.178
  219    HZ3  LYS  27           HZ3      LYS  27  84.503 -10.572  -6.810
  220    H    THR  28           H        THR  28  90.190 -13.494  -1.883
  221    HA   THR  28           HA       THR  28  91.956 -12.006  -1.837
  222    HB   THR  28           HB       THR  28  90.648 -10.682  -4.200
  223    HG1  THR  28           HG1      THR  28  90.447 -13.033  -4.248
  224   HG21  THR  28          HG21      THR  28  92.885 -10.397  -4.954
  225   HG22  THR  28          HG22      THR  28  93.503 -11.587  -3.809
  226   HG23  THR  28          HG23      THR  28  92.933 -10.022  -3.232
  227    H    GLY  29           H        GLY  29  89.491 -11.271  -0.380
  228    HA2  GLY  29           HA2      GLY  29  90.133  -8.942   0.820
  229    HA3  GLY  29           HA3      GLY  29  89.245  -8.393  -0.598
  230    HA   PRO  30           HA       PRO  30  86.381 -10.062   2.876
  231    HB2  PRO  30           HB2      PRO  30  85.921  -7.828   4.376
  232    HB3  PRO  30           HB1      PRO  30  87.234  -8.969   4.726
  233    HG2  PRO  30           HG2      PRO  30  87.337  -6.335   3.331
  234    HG3  PRO  30           HG1      PRO  30  88.466  -7.036   4.505
  235    HD2  PRO  30           HD2      PRO  30  88.934  -7.042   1.804
  236    HD3  PRO  30           HD1      PRO  30  89.571  -8.284   2.905
  237    H    ASN  31           H        ASN  31  84.102  -9.210   3.342
  238    HA   ASN  31           HA       ASN  31  83.037  -8.027   0.882
  239    HB2  ASN  31           HB2      ASN  31  80.936  -8.889   1.552
  240    HB3  ASN  31           HB1      ASN  31  82.097 -10.133   2.013
  241   HD21  ASN  31          HD21      ASN  31  81.902 -10.852   4.135
  242   HD22  ASN  31          HD22      ASN  31  81.179  -9.975   5.396
  243    H    LEU  32           H        LEU  32  81.357  -6.346   1.054
  244    HA   LEU  32           HA       LEU  32  81.930  -4.476   3.279
  245    HB2  LEU  32           HB2      LEU  32  80.888  -3.745   0.536
  246    HB3  LEU  32           HB3      LEU  32  81.458  -2.650   1.790
  247    HG   LEU  32           HG       LEU  32  83.092  -4.591   0.137
  248   HD11  LEU  32          HD11      LEU  32  83.022  -1.588   0.518
  249   HD12  LEU  32          HD12      LEU  32  82.809  -2.499  -0.976
  250   HD13  LEU  32          HD13      LEU  32  84.397  -2.408  -0.220
  251   HD21  LEU  32          HD21      LEU  32  85.010  -3.534   1.570
  252   HD22  LEU  32          HD22      LEU  32  84.087  -4.867   2.252
  253   HD23  LEU  32          HD23      LEU  32  83.736  -3.215   2.739
  254    H    HIS  33           H        HIS  33  80.005  -6.551   3.530
  255    HA   HIS  33           HA       HIS  33  77.369  -5.697   2.931
  256    HB2  HIS  33           HB2      HIS  33  78.259  -7.480   5.210
  257    HB3  HIS  33           HB1      HIS  33  76.650  -7.407   4.491
  258    HD1  HIS  33           HD1      HIS  33  78.764  -9.898   4.524
  259    HD2  HIS  33           HD2      HIS  33  77.773  -7.461   1.290
  260    HE1  HIS  33           HE1      HIS  33  79.304 -11.225   2.435
  261    HE2  HIS  33           HE2      HIS  33  78.704  -9.754   0.454
  262    H    GLY  34           H        GLY  34  75.848  -4.591   4.156
  263    HA2  GLY  34           HA2      GLY  34  75.301  -2.720   5.453
  264    HA3  GLY  34           HA3      GLY  34  75.696  -3.864   6.733
  265    H    LEU  35           H        LEU  35  78.037  -2.673   4.448
  266    HA   LEU  35           HA       LEU  35  80.044  -2.047   6.196
  267    HB2  LEU  35           HB2      LEU  35  80.363  -2.120   3.789
  268    HB3  LEU  35           HB3      LEU  35  79.334  -0.707   3.579
  269    HG   LEU  35           HG       LEU  35  81.093   0.389   5.260
  270   HD11  LEU  35          HD11      LEU  35  83.264  -0.508   5.172
  271   HD12  LEU  35          HD12      LEU  35  82.887  -1.513   3.777
  272   HD13  LEU  35          HD13      LEU  35  82.249  -1.937   5.364
  273   HD21  LEU  35          HD21      LEU  35  80.563   1.001   2.843
  274   HD22  LEU  35          HD22      LEU  35  81.871  -0.084   2.374
  275   HD23  LEU  35          HD23      LEU  35  82.215   1.334   3.363
  276    H    PHE  36           H        PHE  36  77.802   0.334   4.793
  277    HA   PHE  36           HA       PHE  36  78.644   2.549   6.244
  278    HB2  PHE  36           HB2      PHE  36  75.790   2.045   5.387
  279    HB3  PHE  36           HB1      PHE  36  76.598   3.600   5.582
  280    HD1  PHE  36           HD2      PHE  36  76.578   0.462   3.567
  281    HD2  PHE  36           HD1      PHE  36  77.927   4.536   3.827
  282    HE1  PHE  36           HE2      PHE  36  77.382   0.348   1.228
  283    HE2  PHE  36           HE1      PHE  36  78.717   4.420   1.489
  284    HZ   PHE  36           HZ       PHE  36  78.448   2.329   0.185
  285    H    GLY  37           H        GLY  37  79.018   2.104   8.431
  286    HA2  GLY  37           HA2      GLY  37  77.540   2.823  10.421
  287    HA3  GLY  37           HA3      GLY  37  76.666   1.348  10.049
  288    H    ARG  38           H        ARG  38  79.292  -0.001   9.324
  289    HA   ARG  38           HA       ARG  38  79.908  -0.839  12.058
  290    HB2  ARG  38           HB2      ARG  38  80.240  -1.978   9.340
  291    HB3  ARG  38           HB3      ARG  38  81.473  -2.419  10.522
  292    HG2  ARG  38           HG2      ARG  38  79.537  -3.020  12.096
  293    HG3  ARG  38           HG3      ARG  38  78.489  -2.888  10.683
  294    HD2  ARG  38           HD2      ARG  38  80.934  -4.529  10.306
  295    HD3  ARG  38           HD3      ARG  38  79.739  -5.193  11.413
  296    HE   ARG  38           HE       ARG  38  78.165  -4.603   9.364
  297   HH11  ARG  38          HH21      ARG  38  81.353  -5.983   9.390
  298   HH12  ARG  38          HH22      ARG  38  81.118  -6.878   7.928
  299   HH21  ARG  38          HH11      ARG  38  77.862  -5.793   7.460
  300   HH22  ARG  38          HH12      ARG  38  79.146  -6.777   6.842
  301    H    LYS  39           H        LYS  39  81.890  -0.744  13.037
  302    HA   LYS  39           HA       LYS  39  83.604   1.415  12.418
  303    HB2  LYS  39           HB2      LYS  39  83.668  -0.875  14.338
  304    HB3  LYS  39           HB3      LYS  39  85.141   0.058  14.092
  305    HG2  LYS  39           HG2      LYS  39  82.595   1.570  14.545
  306    HG3  LYS  39           HG3      LYS  39  83.331   0.765  15.930
  307    HD2  LYS  39           HD2      LYS  39  85.501   1.914  15.355
  308    HD3  LYS  39           HD3      LYS  39  84.627   2.830  14.126
  309    HE2  LYS  39           HE2      LYS  39  83.802   2.773  17.038
  310    HE3  LYS  39           HE3      LYS  39  84.874   4.001  16.365
  311    HZ1  LYS  39           HZ1      LYS  39  82.604   4.771  16.347
  312    HZ2  LYS  39           HZ2      LYS  39  82.107   3.407  15.465
  313    HZ3  LYS  39           HZ3      LYS  39  83.142   4.551  14.753
  314    H    THR  40           H        THR  40  86.072   1.048  12.231
  315    HA   THR  40           HA       THR  40  86.573  -0.286   9.765
  316    HB   THR  40           HB       THR  40  88.996   0.288  10.330
  317    HG1  THR  40           HG1      THR  40  87.797   1.818  12.370
  318   HG21  THR  40          HG21      THR  40  88.502   2.784  10.139
  319   HG22  THR  40          HG22      THR  40  86.794   2.352  10.233
  320   HG23  THR  40          HG23      THR  40  87.781   1.756   8.899
  321    H    GLY  41           H        GLY  41  87.790  -2.111   9.324
  322    HA2  GLY  41           HA2      GLY  41  88.360  -4.317   9.644
  323    HA3  GLY  41           HA3      GLY  41  89.276  -3.691  11.014
  324    H    GLN  42           H        GLN  42  85.790  -4.037  10.356
  325    HA   GLN  42           HA       GLN  42  85.516  -5.351  12.991
  326    HB2  GLN  42           HB2      GLN  42  84.200  -3.245  12.525
  327    HB3  GLN  42           HB1      GLN  42  83.310  -4.157  11.304
  328    HG2  GLN  42           HG2      GLN  42  82.580  -5.770  12.984
  329    HG3  GLN  42           HG1      GLN  42  83.547  -4.964  14.217
  330   HE21  GLN  42          HE21      GLN  42  82.397  -2.503  12.302
  331   HE22  GLN  42          HE22      GLN  42  80.975  -2.133  13.152
  332    H    ALA  43           H        ALA  43  85.313  -5.855   9.603
  333    HA   ALA  43           HA       ALA  43  83.545  -8.136   9.754
  334    HB1  ALA  43           HB1      ALA  43  83.374  -7.085   7.694
  335    HB2  ALA  43           HB2      ALA  43  84.496  -8.391   7.314
  336    HB3  ALA  43           HB3      ALA  43  85.104  -6.759   7.600
  337    HA   PRO  44           HA       PRO  44  86.907 -10.900  10.766
  338    HB2  PRO  44           HB2      PRO  44  85.591 -13.265  10.575
  339    HB3  PRO  44           HB1      PRO  44  85.284 -12.118  11.893
  340    HG2  PRO  44           HG2      PRO  44  83.711 -12.583   9.400
  341    HG3  PRO  44           HG1      PRO  44  83.143 -12.337  11.061
  342    HD2  PRO  44           HD2      PRO  44  83.176 -10.338   9.173
  343    HD3  PRO  44           HD1      PRO  44  83.309 -10.036  10.921
  344    H    GLY  45           H        GLY  45  85.415 -13.292   8.814
  345    HA2  GLY  45           HA2      GLY  45  86.429 -14.516   7.095
  346    HA3  GLY  45           HA3      GLY  45  86.007 -13.035   6.247
  347    H    PHE  46           H        PHE  46  87.613 -11.455   5.880
  348    HA   PHE  46           HA       PHE  46  90.232 -12.530   5.429
  349    HB2  PHE  46           HB2      PHE  46  89.004 -10.786   4.016
  350    HB3  PHE  46           HB1      PHE  46  89.458  -9.619   5.259
  351    HD1  PHE  46           HD2      PHE  46  90.793 -12.061   2.793
  352    HD2  PHE  46           HD1      PHE  46  91.694  -8.794   5.431
  353    HE1  PHE  46           HE2      PHE  46  93.051 -11.874   1.788
  354    HE2  PHE  46           HE1      PHE  46  93.953  -8.607   4.426
  355    HZ   PHE  46           HZ       PHE  46  94.632 -10.147   2.605
  356    H    THR  47           H        THR  47  92.220 -11.703   6.263
  357    HA   THR  47           HA       THR  47  92.091 -11.131   9.105
  358    HB   THR  47           HB       THR  47  94.567 -11.289   7.385
  359    HG1  THR  47           HG1      THR  47  92.813 -13.248   8.300
  360   HG21  THR  47          HG21      THR  47  94.894 -10.434   9.651
  361   HG22  THR  47          HG22      THR  47  95.556 -12.064   9.532
  362   HG23  THR  47          HG23      THR  47  94.000 -11.800  10.317
  363    H    TYR  48           H        TYR  48  91.213  -9.037   9.154
  364    HA   TYR  48           HA       TYR  48  92.143  -6.823   7.702
  365    HB2  TYR  48           HB2      TYR  48  90.628  -7.196  10.251
  366    HB3  TYR  48           HB3      TYR  48  91.241  -5.588   9.873
  367    HD1  TYR  48           HD2      TYR  48  88.948  -8.274   8.827
  368    HD2  TYR  48           HD1      TYR  48  90.437  -4.347   7.954
  369    HE1  TYR  48           HE2      TYR  48  87.072  -7.914   7.244
  370    HE2  TYR  48           HE1      TYR  48  88.572  -3.984   6.376
  371    HH   TYR  48           HH       TYR  48  86.321  -4.827   5.983
  372    H    THR  49           H        THR  49  93.479  -5.076   8.319
  373    HA   THR  49           HA       THR  49  95.842  -5.916   9.798
  374    HB   THR  49           HB       THR  49  96.853  -3.886   8.958
  375    HG1  THR  49           HG1      THR  49  94.283  -3.092   8.910
  376   HG21  THR  49          HG21      THR  49  95.066  -4.995   6.781
  377   HG22  THR  49          HG22      THR  49  96.489  -5.836   7.394
  378   HG23  THR  49          HG23      THR  49  96.666  -4.278   6.588
  379    H    ASP  50           H        ASP  50  96.709  -4.776  11.588
  380    HA   ASP  50           HA       ASP  50  94.987  -4.164  13.652
  381    HB2  ASP  50           HB2      ASP  50  97.700  -2.884  13.269
  382    HB3  ASP  50           HB1      ASP  50  96.867  -3.186  14.793
  383    H    ALA  51           H        ALA  51  96.341  -1.985  11.214
  384    HA   ALA  51           HA       ALA  51  95.551   0.466  12.262
  385    HB1  ALA  51           HB1      ALA  51  95.830  -0.527   9.432
  386    HB2  ALA  51           HB2      ALA  51  96.911   0.530  10.342
  387    HB3  ALA  51           HB3      ALA  51  95.351   1.134   9.785
  388    H    ASN  52           H        ASN  52  93.691  -1.856  10.327
  389    HA   ASN  52           HA       ASN  52  91.321  -0.186  10.344
  390    HB2  ASN  52           HB2      ASN  52  92.035  -2.893   9.273
  391    HB3  ASN  52           HB1      ASN  52  90.335  -2.477   9.472
  392   HD21  ASN  52          HD21      ASN  52  90.103  -2.475   7.092
  393   HD22  ASN  52          HD22      ASN  52  90.673  -1.156   6.186
  394    H    LYS  53           H        LYS  53  92.710  -2.709  12.268
  395    HA   LYS  53           HA       LYS  53  90.240  -3.314  13.673
  396    HB2  LYS  53           HB2      LYS  53  91.342  -5.208  14.201
  397    HB3  LYS  53           HB3      LYS  53  92.723  -4.617  13.284
  398    HG2  LYS  53           HG2      LYS  53  93.537  -3.436  15.328
  399    HG3  LYS  53           HG3      LYS  53  92.190  -4.128  16.234
  400    HD2  LYS  53           HD2      LYS  53  93.966  -5.979  14.678
  401    HD3  LYS  53           HD3      LYS  53  94.555  -5.330  16.207
  402    HE2  LYS  53           HE2      LYS  53  91.841  -6.641  15.951
  403    HE3  LYS  53           HE3      LYS  53  93.298  -7.552  16.347
  404    HZ1  LYS  53           HZ1      LYS  53  93.396  -5.413  18.019
  405    HZ2  LYS  53           HZ2      LYS  53  92.879  -6.976  18.439
  406    HZ3  LYS  53           HZ3      LYS  53  91.744  -5.794  17.991
  407    H    ASN  54           H        ASN  54  92.591  -0.937  13.725
  408    HA   ASN  54           HA       ASN  54  92.846  -0.398  16.494
  409    HB2  ASN  54           HB2      ASN  54  93.967   1.503  15.831
  410    HB3  ASN  54           HB1      ASN  54  94.129   0.524  14.379
  411   HD21  ASN  54          HD21      ASN  54  91.423   0.866  13.393
  412   HD22  ASN  54          HD22      ASN  54  91.244   2.490  12.935
  413    H    LYS  55           H        LYS  55  90.322   0.039  14.256
  414    HA   LYS  55           HA       LYS  55  88.236   1.018  14.382
  415    HB2  LYS  55           HB2      LYS  55  88.830   0.628  17.320
  416    HB3  LYS  55           HB3      LYS  55  87.265   1.155  16.700
  417    HG2  LYS  55           HG2      LYS  55  87.213  -0.907  15.263
  418    HG3  LYS  55           HG3      LYS  55  88.680  -1.452  16.078
  419    HD2  LYS  55           HD2      LYS  55  87.540  -1.447  18.232
  420    HD3  LYS  55           HD3      LYS  55  86.087  -0.771  17.494
  421    HE2  LYS  55           HE2      LYS  55  85.648  -3.097  17.649
  422    HE3  LYS  55           HE3      LYS  55  86.109  -2.844  15.966
  423    HZ1  LYS  55           HZ1      LYS  55  88.142  -3.818  16.277
  424    HZ2  LYS  55           HZ2      LYS  55  87.196  -4.734  17.351
  425    HZ3  LYS  55           HZ3      LYS  55  88.185  -3.485  17.941
  426    H    GLY  56           H        GLY  56  89.701   2.922  13.589
  427    HA2  GLY  56           HA2      GLY  56  89.897   5.111  15.508
  428    HA3  GLY  56           HA3      GLY  56  90.460   5.131  13.841
  429    H    ILE  57           H        ILE  57  88.057   4.265  12.604
  430    HA   ILE  57           HA       ILE  57  86.045   6.267  13.353
  431    HB   ILE  57           HB       ILE  57  85.909   7.162  11.096
  432   HG12  ILE  57          HG12      ILE  57  88.026   6.477   9.621
  433   HG13  ILE  57          HG13      ILE  57  87.926   4.995  10.567
  434   HG21  ILE  57          HG21      ILE  57  88.807   7.182  11.967
  435   HG22  ILE  57          HG22      ILE  57  87.544   8.096  12.792
  436   HG23  ILE  57          HG23      ILE  57  87.933   8.452  11.108
  437   HD11  ILE  57          HD11      ILE  57  85.409   6.055   9.318
  438   HD12  ILE  57          HD12      ILE  57  85.881   4.388   9.645
  439   HD13  ILE  57          HD13      ILE  57  86.590   5.251   8.287
  440    H    THR  58           H        THR  58  84.185   6.038  11.551
  441    HA   THR  58           HA       THR  58  83.682   3.136  11.244
  442    HB   THR  58           HB       THR  58  81.778   5.348  12.027
  443    HG1  THR  58           HG1      THR  58  82.845   3.043  13.241
  444   HG21  THR  58          HG21      THR  58  80.552   4.003  10.490
  445   HG22  THR  58          HG22      THR  58  80.109   3.409  12.090
  446   HG23  THR  58          HG23      THR  58  81.270   2.518  11.108
  447    H    TRP  59           H        TRP  59  82.834   2.417   9.347
  448    HA   TRP  59           HA       TRP  59  83.192   3.984   7.021
  449    HB2  TRP  59           HB2      TRP  59  81.376   1.584   7.162
  450    HB3  TRP  59           HB1      TRP  59  82.350   2.149   5.805
  451    HD1  TRP  59           HD1      TRP  59  85.126   2.508   7.179
  452    HE1  TRP  59           HE1      TRP  59  86.457   0.445   7.985
  453    HE3  TRP  59           HE3      TRP  59  81.347  -0.894   7.605
  454    HZ2  TRP  59           HZ2      TRP  59  85.970  -2.266   8.744
  455    HZ3  TRP  59           HZ3      TRP  59  81.808  -3.206   8.363
  456    HH2  TRP  59           HH2      TRP  59  84.114  -3.893   8.933
  457    H    LYS  60           H        LYS  60  81.805   5.192   5.834
  458    HA   LYS  60           HA       LYS  60  78.947   5.176   6.330
  459    HB2  LYS  60           HB2      LYS  60  80.671   7.562   7.043
  460    HB3  LYS  60           HB3      LYS  60  78.926   7.654   6.816
  461    HG2  LYS  60           HG2      LYS  60  78.762   5.765   8.552
  462    HG3  LYS  60           HG3      LYS  60  80.450   6.113   8.921
  463    HD2  LYS  60           HD2      LYS  60  78.329   8.270   8.921
  464    HD3  LYS  60           HD3      LYS  60  78.704   7.320  10.358
  465    HE2  LYS  60           HE2      LYS  60  81.112   8.002  10.101
  466    HE3  LYS  60           HE3      LYS  60  80.612   9.083   8.799
  467    HZ1  LYS  60           HZ1      LYS  60  80.526  10.469  10.600
  468    HZ2  LYS  60           HZ2      LYS  60  80.041   9.246  11.675
  469    HZ3  LYS  60           HZ3      LYS  60  78.926   9.906  10.575
  470    H    GLU  61           H        GLU  61  78.370   7.644   5.100
  471    HA   GLU  61           HA       GLU  61  78.878   6.946   2.354
  472    HB2  GLU  61           HB2      GLU  61  76.727   7.928   3.084
  473    HB3  GLU  61           HB3      GLU  61  77.567   9.420   3.508
  474    HG2  GLU  61           HG2      GLU  61  78.211   9.799   1.219
  475    HG3  GLU  61           HG3      GLU  61  77.647   8.200   0.738
  476    H    GLU  62           H        GLU  62  79.574   9.883   4.272
  477    HA   GLU  62           HA       GLU  62  81.347  10.974   2.328
  478    HB2  GLU  62           HB2      GLU  62  81.203  11.614   5.284
  479    HB3  GLU  62           HB3      GLU  62  81.872  12.635   4.011
  480    HG2  GLU  62           HG2      GLU  62  78.978  11.759   4.238
  481    HG3  GLU  62           HG3      GLU  62  79.598  13.368   4.600
  482    H    THR  63           H        THR  63  81.864   9.177   5.352
  483    HA   THR  63           HA       THR  63  84.633   9.326   5.509
  484    HB   THR  63           HB       THR  63  84.528   7.185   6.719
  485    HG1  THR  63           HG1      THR  63  83.021   6.167   5.358
  486   HG21  THR  63          HG21      THR  63  82.672   7.860   8.334
  487   HG22  THR  63          HG22      THR  63  82.337   9.193   7.229
  488   HG23  THR  63          HG23      THR  63  83.909   9.075   8.018
  489    H    LEU  64           H        LEU  64  82.579   7.261   3.530
  490    HA   LEU  64           HA       LEU  64  84.690   5.640   2.512
  491    HB2  LEU  64           HB2      LEU  64  81.820   5.955   2.056
  492    HB3  LEU  64           HB3      LEU  64  82.707   5.604   0.580
  493    HG   LEU  64           HG       LEU  64  83.065   3.992   3.116
  494   HD11  LEU  64          HD11      LEU  64  81.664   2.397   1.349
  495   HD12  LEU  64          HD12      LEU  64  80.900   3.968   1.126
  496   HD13  LEU  64          HD13      LEU  64  80.961   3.241   2.728
  497   HD21  LEU  64          HD21      LEU  64  83.943   3.755   0.239
  498   HD22  LEU  64          HD22      LEU  64  83.757   2.305   1.222
  499   HD23  LEU  64          HD23      LEU  64  84.898   3.557   1.707
  500    H    MET  65           H        MET  65  83.220   8.695   1.543
  501    HA   MET  65           HA       MET  65  84.295   8.858  -1.055
  502    HB2  MET  65           HB2      MET  65  83.612  11.066   0.894
  503    HB3  MET  65           HB1      MET  65  83.974  11.312  -0.814
  504    HG2  MET  65           HG2      MET  65  82.076  10.013  -1.492
  505    HG3  MET  65           HG1      MET  65  81.799   9.454   0.155
  506    HE1  MET  65           HE1      MET  65  80.509  11.413  -2.436
  507    HE2  MET  65           HE2      MET  65  81.834  12.558  -2.245
  508    HE3  MET  65           HE3      MET  65  80.184  13.066  -1.897
  509    H    GLU  66           H        GLU  66  85.525  10.384   1.937
  510    HA   GLU  66           HA       GLU  66  87.938  11.296   0.796
  511    HB2  GLU  66           HB2      GLU  66  87.427  10.505   3.676
  512    HB3  GLU  66           HB3      GLU  66  88.716  11.559   3.092
  513    HG2  GLU  66           HG2      GLU  66  86.906  13.062   2.139
  514    HG3  GLU  66           HG3      GLU  66  85.737  12.085   3.026
  515    H    TYR  67           H        TYR  67  86.926   8.242   2.112
  516    HA   TYR  67           HA       TYR  67  89.566   7.082   2.217
  517    HB2  TYR  67           HB2      TYR  67  88.040   6.174   3.763
  518    HB3  TYR  67           HB3      TYR  67  86.765   6.055   2.561
  519    HD1  TYR  67           HD2      TYR  67  86.957   4.357   0.704
  520    HD2  TYR  67           HD1      TYR  67  89.608   4.404   4.083
  521    HE1  TYR  67           HE2      TYR  67  87.622   2.019   0.214
  522    HE2  TYR  67           HE1      TYR  67  90.271   2.064   3.594
  523    HH   TYR  67           HH       TYR  67  90.172   0.612   1.090
  524    H    LEU  68           H        LEU  68  87.035   7.430  -0.131
  525    HA   LEU  68           HA       LEU  68  87.973   5.308  -1.856
  526    HB2  LEU  68           HB2      LEU  68  85.753   7.272  -1.855
  527    HB3  LEU  68           HB3      LEU  68  86.331   6.788  -3.442
  528    HG   LEU  68           HG       LEU  68  85.555   4.835  -1.257
  529   HD11  LEU  68          HD11      LEU  68  83.602   4.451  -2.957
  530   HD12  LEU  68          HD12      LEU  68  83.985   6.086  -3.500
  531   HD13  LEU  68          HD13      LEU  68  83.511   5.797  -1.827
  532   HD21  LEU  68          HD21      LEU  68  85.329   3.506  -3.607
  533   HD22  LEU  68          HD22      LEU  68  86.800   3.512  -2.640
  534   HD23  LEU  68          HD23      LEU  68  86.645   4.603  -4.011
  535    H    GLU  69           H        GLU  69  88.891   8.531  -1.263
  536    HA   GLU  69           HA       GLU  69  90.038   8.872  -3.950
  537    HB2  GLU  69           HB2      GLU  69  90.071  11.129  -3.546
  538    HB3  GLU  69           HB3      GLU  69  88.787  10.685  -2.425
  539    HG2  GLU  69           HG2      GLU  69  90.667  10.382  -0.682
  540    HG3  GLU  69           HG3      GLU  69  91.686  11.265  -1.816
  541    H    ASN  70           H        ASN  70  90.877   7.712  -0.899
  542    HA   ASN  70           HA       ASN  70  93.552   7.144  -1.642
  543    HB2  ASN  70           HB2      ASN  70  93.479   9.711  -1.013
  544    HB3  ASN  70           HB1      ASN  70  93.516   9.090   0.634
  545   HD21  ASN  70          HD21      ASN  70  95.222   6.882   0.398
  546   HD22  ASN  70          HD22      ASN  70  96.756   7.395  -0.114
  547    HA   PRO  71           HA       PRO  71  91.200   4.638   1.630
  548    HB2  PRO  71           HB2      PRO  71  92.819   2.657   0.065
  549    HB3  PRO  71           HB1      PRO  71  91.178   2.505   0.717
  550    HG2  PRO  71           HG2      PRO  71  91.610   2.980  -1.869
  551    HG3  PRO  71           HG1      PRO  71  90.236   3.693  -1.009
  552    HD2  PRO  71           HD2      PRO  71  92.720   5.004  -1.981
  553    HD3  PRO  71           HD1      PRO  71  91.118   5.708  -1.678
  554    H    LYS  72           H        LYS  72  94.567   4.515   0.501
  555    HA   LYS  72           HA       LYS  72  95.599   3.246   2.831
  556    HB2  LYS  72           HB2      LYS  72  96.719   3.260   0.602
  557    HB3  LYS  72           HB3      LYS  72  97.075   4.969   0.835
  558    HG2  LYS  72           HG2      LYS  72  98.931   4.395   1.984
  559    HG3  LYS  72           HG3      LYS  72  97.908   3.667   3.218
  560    HD2  LYS  72           HD2      LYS  72  98.757   2.214   0.695
  561    HD3  LYS  72           HD3      LYS  72  99.637   2.109   2.218
  562    HE2  LYS  72           HE2      LYS  72  96.756   1.288   1.736
  563    HE3  LYS  72           HE3      LYS  72  98.117   0.220   2.074
  564    HZ1  LYS  72           HZ1      LYS  72  96.834   2.172   3.888
  565    HZ2  LYS  72           HZ2      LYS  72  98.373   1.527   4.202
  566    HZ3  LYS  72           HZ3      LYS  72  97.022   0.501   4.106
  567    H    LYS  73           H        LYS  73  95.593   6.648   1.766
  568    HA   LYS  73           HA       LYS  73  96.994   7.625   4.014
  569    HB2  LYS  73           HB2      LYS  73  96.643   8.803   1.793
  570    HB3  LYS  73           HB3      LYS  73  95.029   9.215   2.372
  571    HG2  LYS  73           HG2      LYS  73  96.033  10.299   4.364
  572    HG3  LYS  73           HG3      LYS  73  97.640   9.917   3.746
  573    HD2  LYS  73           HD2      LYS  73  97.400  12.077   2.935
  574    HD3  LYS  73           HD3      LYS  73  96.744  11.164   1.577
  575    HE2  LYS  73           HE2      LYS  73  95.161  12.899   2.024
  576    HE3  LYS  73           HE3      LYS  73  94.455  11.424   2.681
  577    HZ1  LYS  73           HZ1      LYS  73  95.165  13.802   4.030
  578    HZ2  LYS  73           HZ2      LYS  73  96.038  12.497   4.680
  579    HZ3  LYS  73           HZ3      LYS  73  94.340  12.444   4.627
  580    H    TYR  74           H        TYR  74  93.603   6.909   3.498
  581    HA   TYR  74           HA       TYR  74  92.574   8.481   5.625
  582    HB2  TYR  74           HB2      TYR  74  91.402   7.110   3.638
  583    HB3  TYR  74           HB3      TYR  74  91.212   5.923   4.927
  584    HD1  TYR  74           HD1      TYR  74  90.912   9.646   4.476
  585    HD2  TYR  74           HD2      TYR  74  89.259   6.073   6.198
  586    HE1  TYR  74           HE1      TYR  74  89.033  10.964   5.412
  587    HE2  TYR  74           HE2      TYR  74  87.381   7.394   7.133
  588    HH   TYR  74           HH       TYR  74  86.864  10.729   6.257
  589    H    ILE  75           H        ILE  75  93.203   4.970   5.472
  590    HA   ILE  75           HA       ILE  75  93.686   5.020   8.394
  591    HB   ILE  75           HB       ILE  75  92.338   2.805   6.828
  592   HG12  ILE  75          HG12      ILE  75  91.094   4.581   8.935
  593   HG13  ILE  75          HG13      ILE  75  91.045   5.006   7.225
  594   HG21  ILE  75          HG21      ILE  75  93.157   3.167   9.710
  595   HG22  ILE  75          HG22      ILE  75  93.424   1.781   8.653
  596   HG23  ILE  75          HG23      ILE  75  91.811   2.110   9.284
  597   HD11  ILE  75          HD11      ILE  75  89.025   3.720   8.058
  598   HD12  ILE  75          HD12      ILE  75  90.094   2.337   8.290
  599   HD13  ILE  75          HD13      ILE  75  89.845   2.999   6.674
  600    HA   PRO  76           HA       PRO  76  97.486   3.726   5.905
  601    HB2  PRO  76           HB2      PRO  76  98.465   4.567   8.619
  602    HB3  PRO  76           HB1      PRO  76  99.205   4.826   7.025
  603    HG2  PRO  76           HG2      PRO  76  97.878   6.772   8.272
  604    HG3  PRO  76           HG1      PRO  76  97.812   6.581   6.511
  605    HD2  PRO  76           HD2      PRO  76  95.703   6.039   8.529
  606    HD3  PRO  76           HD1      PRO  76  95.541   6.400   6.797
  607    H    GLY  77           H        GLY  77  98.191   1.670   5.897
  608    HA2  GLY  77           HA2      GLY  77  99.172  -0.216   7.091
  609    HA3  GLY  77           HA3      GLY  77  98.016   0.074   8.386
  610    H    THR  78           H        THR  78  95.848   0.615   6.427
  611    HA   THR  78           HA       THR  78  94.657  -1.903   6.319
  612    HB   THR  78           HB       THR  78  93.440   0.245   6.077
  613    HG1  THR  78           HG1      THR  78  92.636  -0.819   3.767
  614   HG21  THR  78          HG21      THR  78  93.515   1.473   4.027
  615   HG22  THR  78          HG22      THR  78  94.465   0.214   3.235
  616   HG23  THR  78          HG23      THR  78  95.190   1.199   4.505
  617    H    LYS  79           H        LYS  79  94.456  -3.469   4.723
  618    HA   LYS  79           HA       LYS  79  96.621  -3.483   2.749
  619    HB2  LYS  79           HB2      LYS  79  95.885  -5.437   4.352
  620    HB3  LYS  79           HB3      LYS  79  94.700  -5.749   3.085
  621    HG2  LYS  79           HG2      LYS  79  96.879  -5.444   1.532
  622    HG3  LYS  79           HG3      LYS  79  97.673  -6.004   3.005
  623    HD2  LYS  79           HD2      LYS  79  95.913  -7.875   3.034
  624    HD3  LYS  79           HD3      LYS  79  95.563  -7.405   1.371
  625    HE2  LYS  79           HE2      LYS  79  98.047  -7.661   0.896
  626    HE3  LYS  79           HE3      LYS  79  98.191  -8.406   2.488
  627    HZ1  LYS  79           HZ1      LYS  79  97.654 -10.291   1.468
  628    HZ2  LYS  79           HZ2      LYS  79  97.151  -9.495   0.055
  629    HZ3  LYS  79           HZ3      LYS  79  96.075  -9.683   1.355
  630    H    MET  80           H        MET  80  95.885  -2.032   1.182
  631    HA   MET  80           HA       MET  80  94.196  -3.136  -0.821
  632    HB2  MET  80           HB2      MET  80  92.308  -2.534   0.457
  633    HB3  MET  80           HB1      MET  80  93.034  -1.011   0.973
  634    HG2  MET  80           HG2      MET  80  92.631   0.030  -1.073
  635    HG3  MET  80           HG1      MET  80  92.585  -1.494  -1.959
  636    HE1  MET  80           HE1      MET  80  90.168   1.339  -0.981
  637    HE2  MET  80           HE2      MET  80  89.193   0.508  -2.185
  638    HE3  MET  80           HE3      MET  80  90.918   0.725  -2.459
  639    H    ILE  81           H        ILE  81  95.831  -2.638  -2.230
  640    HA   ILE  81           HA       ILE  81  96.293   0.244  -2.735
  641    HB   ILE  81           HB       ILE  81  98.265  -2.049  -2.855
  642   HG12  ILE  81          HG12      ILE  81  99.556  -0.374  -1.401
  643   HG13  ILE  81          HG13      ILE  81  98.046   0.525  -1.271
  644   HG21  ILE  81          HG21      ILE  81  98.369   0.730  -4.032
  645   HG22  ILE  81          HG22      ILE  81  98.726  -0.807  -4.819
  646   HG23  ILE  81          HG23      ILE  81  99.838  -0.154  -3.617
  647   HD11  ILE  81          HD11      ILE  81  98.847  -1.605   0.353
  648   HD12  ILE  81          HD12      ILE  81  97.648  -2.317  -0.723
  649   HD13  ILE  81          HD13      ILE  81  97.229  -0.916   0.262
  650    H    PHE  82           H        PHE  82  95.287   0.751  -4.578
  651    HA   PHE  82           HA       PHE  82  95.793  -0.854  -6.963
  652    HB2  PHE  82           HB2      PHE  82  93.737  -1.838  -5.998
  653    HB3  PHE  82           HB1      PHE  82  92.970  -0.252  -6.047
  654    HD1  PHE  82           HD1      PHE  82  94.891  -2.551  -8.311
  655    HD2  PHE  82           HD2      PHE  82  91.669   0.262  -7.918
  656    HE1  PHE  82           HE1      PHE  82  94.269  -2.933 -10.680
  657    HE2  PHE  82           HE2      PHE  82  91.048  -0.120 -10.287
  658    HZ   PHE  82           HZ       PHE  82  92.348  -1.717 -11.669
  659    H    ALA  83           H        ALA  83  93.349   1.612  -6.171
  660    HA   ALA  83           HA       ALA  83  94.760   3.809  -7.259
  661    HB1  ALA  83           HB1      ALA  83  94.512   2.679  -9.393
  662    HB2  ALA  83           HB2      ALA  83  93.440   4.080  -9.358
  663    HB3  ALA  83           HB3      ALA  83  92.785   2.461  -9.115
  664    H    GLY  84           H        GLY  84  93.857   5.534  -6.343
  665    HA2  GLY  84           HA2      GLY  84  91.273   5.341  -5.069
  666    HA3  GLY  84           HA3      GLY  84  92.350   6.734  -5.045
  667    H    ILE  85           H        ILE  85  89.779   7.333  -5.324
  668    HA   ILE  85           HA       ILE  85  89.019   7.466  -8.131
  669    HB   ILE  85           HB       ILE  85  87.747   8.558  -5.616
  670   HG12  ILE  85          HG12      ILE  85  87.875   5.982  -6.261
  671   HG13  ILE  85          HG13      ILE  85  86.382   6.673  -5.637
  672   HG21  ILE  85          HG21      ILE  85  86.932   8.697  -8.519
  673   HG22  ILE  85          HG22      ILE  85  87.009  10.005  -7.337
  674   HG23  ILE  85          HG23      ILE  85  85.741   8.785  -7.224
  675   HD11  ILE  85          HD11      ILE  85  86.242   5.212  -7.775
  676   HD12  ILE  85          HD12      ILE  85  86.919   6.615  -8.601
  677   HD13  ILE  85          HD13      ILE  85  85.374   6.746  -7.760
  678    H    LYS  86           H        LYS  86  88.461   9.564  -9.132
  679    HA   LYS  86           HA       LYS  86  90.460  11.608  -8.403
  680    HB2  LYS  86           HB2      LYS  86  89.413  10.552 -10.940
  681    HB3  LYS  86           HB3      LYS  86  89.508  12.310 -10.895
  682    HG2  LYS  86           HG2      LYS  86  91.621  11.485 -11.726
  683    HG3  LYS  86           HG3      LYS  86  91.890  12.087 -10.091
  684    HD2  LYS  86           HD2      LYS  86  92.958  10.035  -9.937
  685    HD3  LYS  86           HD3      LYS  86  91.334   9.562  -9.439
  686    HE2  LYS  86           HE2      LYS  86  91.953   7.960 -11.078
  687    HE3  LYS  86           HE3      LYS  86  90.898   9.085 -11.933
  688    HZ1  LYS  86           HZ1      LYS  86  92.832  10.235 -12.772
  689    HZ2  LYS  86           HZ2      LYS  86  92.919   8.589 -13.183
  690    HZ3  LYS  86           HZ3      LYS  86  93.866   9.201 -11.912
  691    H    LYS  87           H        LYS  87  87.212  11.586  -9.929
  692    HA   LYS  87           HA       LYS  87  86.704  14.249  -8.874
  693    HB2  LYS  87           HB2      LYS  87  84.868  12.463 -10.479
  694    HB3  LYS  87           HB3      LYS  87  84.699  14.199 -10.216
  695    HG2  LYS  87           HG2      LYS  87  86.926  14.518 -11.339
  696    HG3  LYS  87           HG3      LYS  87  86.915  12.799 -11.736
  697    HD2  LYS  87           HD2      LYS  87  84.731  13.133 -12.911
  698    HD3  LYS  87           HD3      LYS  87  84.876  14.865 -12.611
  699    HE2  LYS  87           HE2      LYS  87  85.742  14.544 -14.803
  700    HE3  LYS  87           HE3      LYS  87  87.160  14.717 -13.769
  701    HZ1  LYS  87           HZ1      LYS  87  87.526  12.854 -15.156
  702    HZ2  LYS  87           HZ2      LYS  87  85.990  12.206 -14.826
  703    HZ3  LYS  87           HZ3      LYS  87  87.180  12.240 -13.613
  704    H    LYS  88           H        LYS  88  84.654  14.751  -7.801
  705    HA   LYS  88           HA       LYS  88  84.275  13.130  -5.478
  706    HB2  LYS  88           HB2      LYS  88  84.025  15.560  -5.389
  707    HB3  LYS  88           HB3      LYS  88  82.694  15.485  -6.542
  708    HG2  LYS  88           HG2      LYS  88  81.456  14.020  -4.899
  709    HG3  LYS  88           HG3      LYS  88  82.743  14.334  -3.736
  710    HD2  LYS  88           HD2      LYS  88  82.221  16.628  -3.587
  711    HD3  LYS  88           HD3      LYS  88  81.320  16.616  -5.102
  712    HE2  LYS  88           HE2      LYS  88  79.642  16.679  -3.439
  713    HE3  LYS  88           HE3      LYS  88  79.707  14.982  -3.909
  714    HZ1  LYS  88           HZ1      LYS  88  79.727  15.036  -1.567
  715    HZ2  LYS  88           HZ2      LYS  88  80.910  16.253  -1.518
  716    HZ3  LYS  88           HZ3      LYS  88  81.321  14.686  -2.031
  717    H    THR  89           H        THR  89  82.090  13.999  -8.176
  718    HA   THR  89           HA       THR  89  79.934  12.407  -7.466
  719    HB   THR  89           HB       THR  89  79.400  12.358  -9.912
  720    HG1  THR  89           HG1      THR  89  81.946  13.595  -9.995
  721   HG21  THR  89          HG21      THR  89  80.267  14.992  -8.690
  722   HG22  THR  89          HG22      THR  89  78.681  14.236  -8.542
  723   HG23  THR  89          HG23      THR  89  79.226  14.846 -10.105
  724    H    GLU  90           H        GLU  90  83.023  11.473  -8.745
  725    HA   GLU  90           HA       GLU  90  82.262   8.905  -9.726
  726    HB2  GLU  90           HB2      GLU  90  84.882  10.131  -8.882
  727    HB3  GLU  90           HB3      GLU  90  84.774   8.420  -9.295
  728    HG2  GLU  90           HG2      GLU  90  84.102   8.883 -11.515
  729    HG3  GLU  90           HG3      GLU  90  83.700  10.556 -11.135
  730    H    ARG  91           H        ARG  91  83.331  10.183  -6.629
  731    HA   ARG  91           HA       ARG  91  83.396   7.626  -5.305
  732    HB2  ARG  91           HB2      ARG  91  83.218  10.389  -4.074
  733    HB3  ARG  91           HB3      ARG  91  83.759   8.908  -3.286
  734    HG2  ARG  91           HG2      ARG  91  85.629   8.761  -4.918
  735    HG3  ARG  91           HG3      ARG  91  85.122  10.304  -5.601
  736    HD2  ARG  91           HD2      ARG  91  85.259  10.864  -2.895
  737    HD3  ARG  91           HD3      ARG  91  86.609   9.756  -3.124
  738    HE   ARG  91           HE       ARG  91  86.853  11.541  -5.190
  739   HH11  ARG  91          HH21      ARG  91  86.564  11.746  -1.746
  740   HH12  ARG  91          HH22      ARG  91  87.482  13.210  -1.618
  741   HH21  ARG  91          HH11      ARG  91  88.059  13.459  -5.028
  742   HH22  ARG  91          HH12      ARG  91  88.327  14.179  -3.476
  743    H    GLU  92           H        GLU  92  81.216  10.453  -5.234
  744    HA   GLU  92           HA       GLU  92  79.295   9.434  -3.485
  745    HB2  GLU  92           HB2      GLU  92  79.472  11.790  -4.494
  746    HB3  GLU  92           HB3      GLU  92  78.601  11.133  -5.880
  747    HG2  GLU  92           HG2      GLU  92  76.812  10.345  -4.313
  748    HG3  GLU  92           HG3      GLU  92  77.653  11.175  -3.003
  749    H    ASP  93           H        ASP  93  79.290   9.313  -7.063
  750    HA   ASP  93           HA       ASP  93  76.977   7.739  -7.333
  751    HB2  ASP  93           HB2      ASP  93  79.416   7.803  -9.127
  752    HB3  ASP  93           HB1      ASP  93  77.822   7.200  -9.574
  753    H    LEU  94           H        LEU  94  80.403   6.793  -7.208
  754    HA   LEU  94           HA       LEU  94  80.078   4.027  -7.437
  755    HB2  LEU  94           HB2      LEU  94  82.282   5.062  -7.558
  756    HB3  LEU  94           HB3      LEU  94  82.139   5.601  -5.887
  757    HG   LEU  94           HG       LEU  94  82.105   3.313  -5.086
  758   HD11  LEU  94          HD11      LEU  94  82.638   1.531  -6.928
  759   HD12  LEU  94          HD12      LEU  94  81.931   2.715  -8.027
  760   HD13  LEU  94          HD13      LEU  94  80.971   2.058  -6.700
  761   HD21  LEU  94          HD21      LEU  94  84.298   4.473  -5.643
  762   HD22  LEU  94          HD22      LEU  94  84.315   3.539  -7.139
  763   HD23  LEU  94          HD23      LEU  94  84.367   2.714  -5.584
  764    H    ILE  95           H        ILE  95  79.822   6.167  -4.668
  765    HA   ILE  95           HA       ILE  95  79.617   4.046  -2.768
  766    HB   ILE  95           HB       ILE  95  79.280   7.019  -2.655
  767   HG12  ILE  95          HG12      ILE  95  80.976   5.456  -0.775
  768   HG13  ILE  95          HG13      ILE  95  81.453   5.387  -2.465
  769   HG21  ILE  95          HG21      ILE  95  79.025   6.479  -0.074
  770   HG22  ILE  95          HG22      ILE  95  78.329   4.973  -0.674
  771   HG23  ILE  95          HG23      ILE  95  77.602   6.518  -1.115
  772   HD11  ILE  95          HD11      ILE  95  80.799   8.096  -1.475
  773   HD12  ILE  95          HD12      ILE  95  82.130   7.553  -2.493
  774   HD13  ILE  95          HD13      ILE  95  82.222   7.356  -0.747
  775    H    ALA  96           H        ALA  96  77.380   5.923  -4.681
  776    HA   ALA  96           HA       ALA  96  75.006   5.343  -3.280
  777    HB1  ALA  96           HB1      ALA  96  75.220   6.987  -5.160
  778    HB2  ALA  96           HB2      ALA  96  73.856   5.883  -5.341
  779    HB3  ALA  96           HB3      ALA  96  75.329   5.627  -6.277
  780    H    TYR  97           H        TYR  97  76.877   3.552  -5.667
  781    HA   TYR  97           HA       TYR  97  74.966   1.421  -5.927
  782    HB2  TYR  97           HB2      TYR  97  76.435   1.768  -7.781
  783    HB3  TYR  97           HB3      TYR  97  77.862   1.699  -6.747
  784    HD1  TYR  97           HD1      TYR  97  75.001  -0.324  -8.030
  785    HD2  TYR  97           HD2      TYR  97  78.890  -0.373  -6.209
  786    HE1  TYR  97           HE1      TYR  97  75.113  -2.780  -8.339
  787    HE2  TYR  97           HE2      TYR  97  79.002  -2.831  -6.520
  788    HH   TYR  97           HH       TYR  97  78.046  -4.570  -7.771
  789    H    LEU  98           H        LEU  98  78.114   1.781  -4.265
  790    HA   LEU  98           HA       LEU  98  78.319  -0.739  -3.146
  791    HB2  LEU  98           HB2      LEU  98  79.204   1.980  -2.233
  792    HB3  LEU  98           HB3      LEU  98  79.456   0.587  -1.191
  793    HG   LEU  98           HG       LEU  98  80.291   0.411  -4.074
  794   HD11  LEU  98          HD11      LEU  98  81.228   2.554  -3.086
  795   HD12  LEU  98          HD12      LEU  98  82.425   1.390  -3.636
  796   HD13  LEU  98          HD13      LEU  98  82.076   1.545  -1.915
  797   HD21  LEU  98          HD21      LEU  98  81.888  -1.167  -3.181
  798   HD22  LEU  98          HD22      LEU  98  80.320  -1.540  -2.465
  799   HD23  LEU  98          HD23      LEU  98  81.530  -0.664  -1.529
  800    H    LYS  99           H        LYS  99  76.125   1.834  -2.365
  801    HA   LYS  99           HA       LYS  99  75.407   0.829   0.244
  802    HB2  LYS  99           HB2      LYS  99  74.303   2.961  -1.571
  803    HB3  LYS  99           HB3      LYS  99  73.447   2.474  -0.108
  804    HG2  LYS  99           HG2      LYS  99  75.472   2.962   1.231
  805    HG3  LYS  99           HG3      LYS  99  76.306   3.476  -0.233
  806    HD2  LYS  99           HD2      LYS  99  75.454   5.448   0.908
  807    HD3  LYS  99           HD3      LYS  99  74.540   5.212  -0.581
  808    HE2  LYS  99           HE2      LYS  99  72.619   4.534   0.544
  809    HE3  LYS  99           HE3      LYS  99  73.519   3.960   1.949
  810    HZ1  LYS  99           HZ1      LYS  99  73.506   6.823   1.253
  811    HZ2  LYS  99           HZ2      LYS  99  73.785   6.089   2.760
  812    HZ3  LYS  99           HZ3      LYS  99  72.213   6.149   2.119
  813    H    LYS 100           H        LYS 100  73.762   0.949  -2.923
  814    HA   LYS 100           HA       LYS 100  71.602  -0.722  -2.015
  815    HB2  LYS 100           HB2      LYS 100  71.610   1.054  -3.915
  816    HB3  LYS 100           HB3      LYS 100  72.271  -0.245  -4.909
  817    HG2  LYS 100           HG2      LYS 100  70.347  -1.667  -4.381
  818    HG3  LYS 100           HG3      LYS 100  69.695  -0.424  -3.315
  819    HD2  LYS 100           HD2      LYS 100  70.315   0.303  -6.160
  820    HD3  LYS 100           HD3      LYS 100  68.852  -0.619  -5.823
  821    HE2  LYS 100           HE2      LYS 100  67.905   1.096  -4.542
  822    HE3  LYS 100           HE3      LYS 100  69.466   1.842  -4.204
  823    HZ1  LYS 100           HZ1      LYS 100  69.045   1.783  -6.984
  824    HZ2  LYS 100           HZ2      LYS 100  69.223   3.131  -5.965
  825    HZ3  LYS 100           HZ3      LYS 100  67.682   2.470  -6.242
  826    H    ALA 101           H        ALA 101  74.752  -1.289  -3.188
  827    HA   ALA 101           HA       ALA 101  74.191  -3.947  -4.232
  828    HB1  ALA 101           HB1      ALA 101  76.903  -2.727  -3.719
  829    HB2  ALA 101           HB2      ALA 101  75.960  -2.368  -5.166
  830    HB3  ALA 101           HB3      ALA 101  76.487  -4.019  -4.844
  831    H    THR 102           H        THR 102  75.415  -2.433  -1.324
  832    HA   THR 102           HA       THR 102  76.223  -5.002  -0.178
  833    HB   THR 102           HB       THR 102  76.904  -3.609   1.768
  834    HG1  THR 102           HG1      THR 102  75.544  -1.723   0.247
  835   HG21  THR 102          HG21      THR 102  78.626  -3.952   0.198
  836   HG22  THR 102          HG22      THR 102  78.599  -2.201   0.405
  837   HG23  THR 102          HG23      THR 102  77.848  -2.934  -1.014
  838    H    ASN 103           H        ASN 103  73.421  -3.325  -0.590
  839    HA   ASN 103           HA       ASN 103  72.234  -4.046   1.997
  840    HB2  ASN 103           HB2      ASN 103  71.356  -2.352  -0.331
  841    HB3  ASN 103           HB1      ASN 103  70.217  -2.867   0.905
  842   HD21  ASN 103          HD21      ASN 103  73.598  -2.204   1.684
  843   HD22  ASN 103          HD22      ASN 103  73.292  -0.796   2.578
  844    H    GLU 104           H        GLU 104  72.376  -5.039  -1.315
  845    HA   GLU 104           HA       GLU 104  70.765  -7.394  -0.699
  846    HB2  GLU 104           HB2      GLU 104  69.415  -7.054  -2.811
  847    HB3  GLU 104           HB3      GLU 104  69.023  -5.952  -1.490
  848    HG2  GLU 104           HG2      GLU 104  70.235  -4.161  -2.491
  849    HG3  GLU 104           HG3      GLU 104  71.021  -5.240  -3.642
  850    HHA  HEC 201           HA       HEC 105  89.246  -3.492   3.251
  851    HHB  HEC 201           HB       HEC 105  85.541   0.105  -0.399
  852    HHC  HEC 201           HC       HEC 105  88.826  -1.705  -5.492
  853    HHD  HEC 201           HD       HEC 105  92.106  -5.762  -1.915
  854   HMA1  HEC 201          HMA1      HEC 105  84.585  -0.128   1.604
  855   HMA2  HEC 201          HMA2      HEC 105  85.740   0.931   2.413
  856   HMA3  HEC 201          HMA3      HEC 105  85.029  -0.428   3.281
  857   HAA1  HEC 201          HAA1      HEC 105  86.792  -0.921   4.532
  858   HAA2  HEC 201          HAA2      HEC 105  88.321  -1.778   4.505
  859   HBA1  HEC 201          HBA1      HEC 105  87.272  -3.888   4.540
  860   HBA2  HEC 201          HBA2      HEC 105  85.706  -3.216   4.098
  861   HMB1  HEC 201          HMB1      HEC 105  84.835   1.259  -3.932
  862   HMB2  HEC 201          HMB2      HEC 105  85.187   1.657  -2.255
  863   HMB3  HEC 201          HMB3      HEC 105  84.151   0.285  -2.637
  864    HAB  HEC 201           HAB      HEC 105  87.379  -0.455  -6.151
  865   HBB1  HEC 201          HBB1      HEC 105  86.741   2.085  -4.712
  866   HBB2  HEC 201          HBB2      HEC 105  87.996   1.755  -5.901
  867   HBB3  HEC 201          HBB3      HEC 105  86.327   1.974  -6.420
  868   HMC1  HEC 201          HMC1      HEC 105  91.145  -4.307  -6.861
  869   HMC2  HEC 201          HMC2      HEC 105  91.410  -2.589  -6.580
  870   HMC3  HEC 201          HMC3      HEC 105  89.778  -3.203  -6.825
  871    HAC  HEC 201           HAC      HEC 105  92.617  -6.141  -3.826
  872   HBC1  HEC 201          HBC1      HEC 105  93.641  -3.951  -5.050
  873   HBC2  HEC 201          HBC2      HEC 105  93.260  -4.933  -6.463
  874   HBC3  HEC 201          HBC3      HEC 105  94.340  -5.560  -5.220
  875   HMD1  HEC 201          HMD1      HEC 105  93.288  -6.346  -0.148
  876   HMD2  HEC 201          HMD2      HEC 105  92.139  -7.518   0.496
  877   HMD3  HEC 201          HMD3      HEC 105  93.141  -6.568   1.590
  878   HAD1  HEC 201          HAD1      HEC 105  91.758  -6.320   3.242
  879   HAD2  HEC 201          HAD2      HEC 105  90.238  -5.588   3.713
  880   HBD1  HEC 201          HBD1      HEC 105  91.511  -3.369   3.824
  881   HBD2  HEC 201          HBD2      HEC 105  92.980  -4.336   3.722
  882    H1   HOH 301           H2       HOH 200  80.541   2.270  -0.639
  883    H2   HOH 301           H1       HOH 200  81.685   3.253  -0.770
  884    H1   HOH 302           H2       HOH 201  87.114   5.595   5.877
  885    H2   HOH 302           H1       HOH 201  85.837   6.147   5.283
  886    H1   HOH 303           H2       HOH 202  82.267  -5.278   5.699
  887    H2   HOH 303           H1       HOH 202  81.761  -6.611   6.206
  888    H1   HOH 304           H2       HOH 203  83.726  -9.984   0.128
  889    H2   HOH 304           H1       HOH 203  82.537 -10.920   0.070
  Start of MODEL   25
    1    H1   GLY   1           H1       GLY   1  75.354   8.320  -6.344
    2    H2   GLY   1           H2       GLY   1  75.807   9.902  -5.922
    3    H3   GLY   1           H3       GLY   1  75.948   9.376  -7.531
    4    HA2  GLY   1           HA2      GLY   1  73.356   9.528  -6.104
    5    HA3  GLY   1           HA3      GLY   1  73.998  10.851  -7.078
    6    H    ASP   2           H        ASP   2  75.125   7.990  -8.336
    7    HA   ASP   2           HA       ASP   2  72.797   7.548 -10.088
    8    HB2  ASP   2           HB2      ASP   2  75.616   8.093 -11.047
    9    HB3  ASP   2           HB1      ASP   2  74.289   7.530 -12.063
   10    H    VAL   3           H        VAL   3  72.574   5.623  -8.860
   11    HA   VAL   3           HA       VAL   3  74.406   3.653  -8.346
   12    HB   VAL   3           HB       VAL   3  72.031   3.575  -7.665
   13   HG11  VAL   3          HG11      VAL   3  71.484   2.716 -10.518
   14   HG12  VAL   3          HG12      VAL   3  71.190   4.351  -9.925
   15   HG13  VAL   3          HG13      VAL   3  70.304   2.990  -9.237
   16   HG21  VAL   3          HG21      VAL   3  71.722   1.170  -7.968
   17   HG22  VAL   3          HG22      VAL   3  73.430   1.506  -7.697
   18   HG23  VAL   3          HG23      VAL   3  72.847   1.168  -9.326
   19    H    GLU   4           H        GLU   4  73.268   4.736 -11.416
   20    HA   GLU   4           HA       GLU   4  73.852   2.347 -12.891
   21    HB2  GLU   4           HB2      GLU   4  73.625   5.205 -13.864
   22    HB3  GLU   4           HB3      GLU   4  73.593   3.760 -14.875
   23    HG2  GLU   4           HG2      GLU   4  71.542   3.005 -13.864
   24    HG3  GLU   4           HG3      GLU   4  71.621   4.267 -12.636
   25    H    LYS   5           H        LYS   5  75.511   5.511 -12.774
   26    HA   LYS   5           HA       LYS   5  77.843   4.510 -14.093
   27    HB2  LYS   5           HB2      LYS   5  77.221   7.044 -12.572
   28    HB3  LYS   5           HB3      LYS   5  78.838   6.712 -13.194
   29    HG2  LYS   5           HG2      LYS   5  77.998   6.543 -15.461
   30    HG3  LYS   5           HG3      LYS   5  76.332   6.674 -14.900
   31    HD2  LYS   5           HD2      LYS   5  78.258   8.860 -14.181
   32    HD3  LYS   5           HD3      LYS   5  77.620   8.807 -15.823
   33    HE2  LYS   5           HE2      LYS   5  75.328   8.854 -14.978
   34    HE3  LYS   5           HE3      LYS   5  75.912   8.791 -13.316
   35    HZ1  LYS   5           HZ1      LYS   5  76.167  10.974 -13.330
   36    HZ2  LYS   5           HZ2      LYS   5  75.519  11.041 -14.900
   37    HZ3  LYS   5           HZ3      LYS   5  77.197  10.892 -14.675
   38    H    GLY   6           H        GLY   6  76.710   4.509 -10.847
   39    HA2  GLY   6           HA2      GLY   6  79.248   4.269  -9.542
   40    HA3  GLY   6           HA3      GLY   6  77.679   3.839  -8.856
   41    H    LYS   7           H        LYS   7  76.919   2.100 -10.994
   42    HA   LYS   7           HA       LYS   7  78.068  -0.340 -10.080
   43    HB2  LYS   7           HB2      LYS   7  75.727  -0.045 -10.980
   44    HB3  LYS   7           HB3      LYS   7  76.436   0.096 -12.587
   45    HG2  LYS   7           HG2      LYS   7  77.620  -2.148 -12.028
   46    HG3  LYS   7           HG3      LYS   7  76.427  -2.287 -10.741
   47    HD2  LYS   7           HD2      LYS   7  75.296  -3.358 -12.462
   48    HD3  LYS   7           HD3      LYS   7  74.725  -1.707 -12.694
   49    HE2  LYS   7           HE2      LYS   7  76.778  -1.445 -14.265
   50    HE3  LYS   7           HE3      LYS   7  76.823  -3.208 -14.256
   51    HZ1  LYS   7           HZ1      LYS   7  74.252  -2.818 -14.716
   52    HZ2  LYS   7           HZ2      LYS   7  75.401  -2.924 -15.963
   53    HZ3  LYS   7           HZ3      LYS   7  74.862  -1.404 -15.428
   54    H    LYS   8           H        LYS   8  78.413   1.607 -13.044
   55    HA   LYS   8           HA       LYS   8  80.088  -0.164 -14.451
   56    HB2  LYS   8           HB2      LYS   8  79.046   1.737 -15.546
   57    HB3  LYS   8           HB3      LYS   8  79.947   2.858 -14.527
   58    HG2  LYS   8           HG2      LYS   8  81.635   0.893 -15.960
   59    HG3  LYS   8           HG3      LYS   8  80.774   2.012 -17.013
   60    HD2  LYS   8           HD2      LYS   8  82.252   3.051 -14.601
   61    HD3  LYS   8           HD3      LYS   8  83.125   2.699 -16.092
   62    HE2  LYS   8           HE2      LYS   8  81.911   4.306 -17.326
   63    HE3  LYS   8           HE3      LYS   8  80.634   4.402 -16.114
   64    HZ1  LYS   8           HZ1      LYS   8  83.023   5.895 -16.289
   65    HZ2  LYS   8           HZ2      LYS   8  83.002   5.032 -14.826
   66    HZ3  LYS   8           HZ3      LYS   8  81.726   6.086 -15.214
   67    H    ILE   9           H        ILE   9  80.889   2.530 -12.274
   68    HA   ILE   9           HA       ILE   9  83.704   2.231 -12.474
   69    HB   ILE   9           HB       ILE   9  82.022   3.466 -10.284
   70   HG12  ILE   9          HG12      ILE   9  83.501   4.844 -12.537
   71   HG13  ILE   9          HG13      ILE   9  81.813   4.352 -12.685
   72   HG21  ILE   9          HG21      ILE   9  84.971   3.688 -10.958
   73   HG22  ILE   9          HG22      ILE   9  84.277   3.003  -9.489
   74   HG23  ILE   9          HG23      ILE   9  84.132   4.731  -9.810
   75   HD11  ILE   9          HD11      ILE   9  81.251   5.689 -10.682
   76   HD12  ILE   9          HD12      ILE   9  81.969   6.694 -11.942
   77   HD13  ILE   9          HD13      ILE   9  82.936   6.194 -10.553
   78    H    PHE  10           H        PHE  10  81.278   0.555 -10.673
   79    HA   PHE  10           HA       PHE  10  83.100  -0.452  -8.667
   80    HB2  PHE  10           HB2      PHE  10  80.946  -0.336  -7.818
   81    HB3  PHE  10           HB1      PHE  10  80.210  -0.871  -9.329
   82    HD1  PHE  10           HD1      PHE  10  80.160  -3.241  -9.944
   83    HD2  PHE  10           HD2      PHE  10  81.891  -1.938  -6.241
   84    HE1  PHE  10           HE1      PHE  10  80.174  -5.583  -9.131
   85    HE2  PHE  10           HE2      PHE  10  81.909  -4.278  -5.424
   86    HZ   PHE  10           HZ       PHE  10  81.050  -6.103  -6.873
   87    H    VAL  11           H        VAL  11  81.318  -1.942 -11.390
   88    HA   VAL  11           HA       VAL  11  82.335  -4.517 -11.156
   89    HB   VAL  11           HB       VAL  11  81.836  -4.763 -13.571
   90   HG11  VAL  11          HG11      VAL  11  79.488  -4.460 -13.342
   91   HG12  VAL  11          HG12      VAL  11  79.697  -3.121 -12.215
   92   HG13  VAL  11          HG13      VAL  11  80.082  -4.764 -11.711
   93   HG21  VAL  11          HG21      VAL  11  82.615  -2.517 -14.271
   94   HG22  VAL  11          HG22      VAL  11  81.268  -1.792 -13.397
   95   HG23  VAL  11          HG23      VAL  11  80.958  -2.816 -14.797
   96    H    GLN  12           H        GLN  12  83.789  -1.657 -12.547
   97    HA   GLN  12           HA       GLN  12  86.025  -3.242 -13.595
   98    HB2  GLN  12           HB2      GLN  12  86.698  -1.254 -14.744
   99    HB3  GLN  12           HB1      GLN  12  84.957  -1.444 -14.956
  100    HG2  GLN  12           HG2      GLN  12  84.662   0.100 -12.954
  101    HG3  GLN  12           HG1      GLN  12  86.390   0.436 -13.069
  102   HE21  GLN  12          HE21      GLN  12  85.650  -0.127 -16.188
  103   HE22  GLN  12          HE22      GLN  12  85.209   1.431 -16.690
  104    H    LYS  13           H        LYS  13  85.308  -1.106 -10.911
  105    HA   LYS  13           HA       LYS  13  88.183  -0.851 -10.342
  106    HB2  LYS  13           HB2      LYS  13  86.527   1.124 -10.365
  107    HB3  LYS  13           HB3      LYS  13  86.026   0.529  -8.782
  108    HG2  LYS  13           HG2      LYS  13  88.220   0.814  -7.879
  109    HG3  LYS  13           HG3      LYS  13  88.926   1.054  -9.475
  110    HD2  LYS  13           HD2      LYS  13  86.758   2.927  -8.586
  111    HD3  LYS  13           HD3      LYS  13  88.374   3.132  -7.910
  112    HE2  LYS  13           HE2      LYS  13  89.310   3.236 -10.203
  113    HE3  LYS  13           HE3      LYS  13  87.683   3.072 -10.865
  114    HZ1  LYS  13           HZ1      LYS  13  88.276   5.201  -8.921
  115    HZ2  LYS  13           HZ2      LYS  13  87.072   5.145 -10.119
  116    HZ3  LYS  13           HZ3      LYS  13  88.694   5.409 -10.552
  117    H    CYS  14           H        CYS  14  85.285  -1.411  -8.266
  118    HA   CYS  14           HA       CYS  14  87.019  -2.629  -6.280
  119    HB2  CYS  14           HB2      CYS  14  84.044  -2.537  -6.030
  120    HB3  CYS  14           HB1      CYS  14  85.267  -2.409  -4.773
  121    H    ALA  15           H        ALA  15  84.516  -3.808  -8.487
  122    HA   ALA  15           HA       ALA  15  83.973  -6.276  -7.408
  123    HB1  ALA  15           HB1      ALA  15  82.797  -5.787  -9.360
  124    HB2  ALA  15           HB2      ALA  15  83.911  -7.043  -9.899
  125    HB3  ALA  15           HB3      ALA  15  84.256  -5.349 -10.247
  126    H    GLN  16           H        GLN  16  86.933  -5.186  -8.858
  127    HA   GLN  16           HA       GLN  16  88.205  -7.480  -9.638
  128    HB2  GLN  16           HB2      GLN  16  89.385  -5.171  -8.090
  129    HB3  GLN  16           HB1      GLN  16  90.316  -6.368  -8.987
  130    HG2  GLN  16           HG2      GLN  16  88.130  -5.131 -10.544
  131    HG3  GLN  16           HG1      GLN  16  89.382  -4.000 -10.046
  132   HE21  GLN  16          HE21      GLN  16  90.614  -3.755 -11.947
  133   HE22  GLN  16          HE22      GLN  16  91.305  -5.049 -12.803
  134    H    CYS  17           H        CYS  17  88.583  -6.130  -6.326
  135    HA   CYS  17           HA       CYS  17  89.005  -8.912  -5.385
  136    HB2  CYS  17           HB2      CYS  17  90.115  -6.713  -3.747
  137    HB3  CYS  17           HB1      CYS  17  90.809  -8.278  -4.156
  138    H    HIS  18           H        HSD  18  86.390  -7.999  -5.443
  139    HA   HIS  18           HA       HSD  18  85.770  -8.064  -2.605
  140    HB2  HIS  18           HB2      HSD  18  85.145  -5.666  -4.315
  141    HB3  HIS  18           HB1      HSD  18  84.166  -6.069  -2.906
  142    HD1  HIS  18           HD1      HSD  18  86.638  -7.152  -1.174
  143    HD2  HIS  18           HD2      HSD  18  86.428  -3.466  -3.105
  144    HE1  HIS  18           HE1      HSD  18  88.280  -5.625   0.012
  145    H    THR  19           H        THR  19  83.189  -7.716  -2.457
  146    HA   THR  19           HA       THR  19  81.905  -9.234  -4.639
  147    HB   THR  19           HB       THR  19  80.758 -10.143  -2.224
  148    HG1  THR  19           HG1      THR  19  82.956 -11.090  -1.530
  149   HG21  THR  19          HG21      THR  19  81.031 -11.442  -4.295
  150   HG22  THR  19          HG22      THR  19  81.726 -12.303  -2.922
  151   HG23  THR  19          HG23      THR  19  82.778 -11.459  -4.059
  152    H    VAL  20           H        VAL  20  81.548  -7.258  -1.738
  153    HA   VAL  20           HA       VAL  20  79.823  -5.952  -0.965
  154    HB   VAL  20           HB       VAL  20  79.158  -4.224  -2.509
  155   HG11  VAL  20          HG11      VAL  20  81.985  -5.149  -3.108
  156   HG12  VAL  20          HG12      VAL  20  81.500  -4.240  -1.678
  157   HG13  VAL  20          HG13      VAL  20  81.372  -3.505  -3.276
  158   HG21  VAL  20          HG21      VAL  20  80.416  -5.847  -4.724
  159   HG22  VAL  20          HG22      VAL  20  79.460  -4.376  -4.869
  160   HG23  VAL  20          HG23      VAL  20  78.685  -5.885  -4.401
  161    H    GLU  21           H        GLU  21  78.956  -8.646  -1.632
  162    HA   GLU  21           HA       GLU  21  76.115  -8.028  -2.157
  163    HB2  GLU  21           HB2      GLU  21  75.835  -9.909  -3.569
  164    HB3  GLU  21           HB3      GLU  21  77.291  -9.104  -4.151
  165    HG2  GLU  21           HG2      GLU  21  78.539 -10.715  -2.519
  166    HG3  GLU  21           HG3      GLU  21  77.046 -11.651  -2.570
  167    H    LYS  22           H        LYS  22  75.010  -8.473  -0.395
  168    HA   LYS  22           HA       LYS  22  75.852  -9.747   1.877
  169    HB2  LYS  22           HB2      LYS  22  73.733  -8.437   1.609
  170    HB3  LYS  22           HB3      LYS  22  73.015  -9.842   0.824
  171    HG2  LYS  22           HG2      LYS  22  74.327 -10.419   3.420
  172    HG3  LYS  22           HG3      LYS  22  72.916  -9.368   3.528
  173    HD2  LYS  22           HD2      LYS  22  71.601 -11.032   2.234
  174    HD3  LYS  22           HD3      LYS  22  73.008 -12.095   2.201
  175    HE2  LYS  22           HE2      LYS  22  72.979 -12.352   4.585
  176    HE3  LYS  22           HE3      LYS  22  71.797 -11.057   4.772
  177    HZ1  LYS  22           HZ1      LYS  22  70.629 -13.086   4.939
  178    HZ2  LYS  22           HZ2      LYS  22  71.382 -13.729   3.557
  179    HZ3  LYS  22           HZ3      LYS  22  70.262 -12.459   3.405
  180    H    GLY  23           H        GLY  23  75.819 -11.811   2.701
  181    HA2  GLY  23           HA2      GLY  23  75.976 -14.104   2.665
  182    HA3  GLY  23           HA3      GLY  23  74.575 -14.057   1.598
  183    H    GLY  24           H        GLY  24  77.545 -12.451   0.716
  184    HA2  GLY  24           HA2      GLY  24  77.791 -14.192  -1.615
  185    HA3  GLY  24           HA3      GLY  24  78.661 -12.688  -1.331
  186    H    LYS  25           H        LYS  25  80.702 -13.439  -1.702
  187    HA   LYS  25           HA       LYS  25  81.862 -15.088   0.418
  188    HB2  LYS  25           HB2      LYS  25  82.556 -15.769  -2.428
  189    HB3  LYS  25           HB3      LYS  25  82.769 -16.737  -0.969
  190    HG2  LYS  25           HG2      LYS  25  80.300 -16.958  -0.781
  191    HG3  LYS  25           HG3      LYS  25  80.121 -16.053  -2.283
  192    HD2  LYS  25           HD2      LYS  25  81.902 -18.472  -2.250
  193    HD3  LYS  25           HD3      LYS  25  80.155 -18.697  -2.325
  194    HE2  LYS  25           HE2      LYS  25  80.029 -17.285  -4.323
  195    HE3  LYS  25           HE3      LYS  25  81.763 -16.973  -4.235
  196    HZ1  LYS  25           HZ1      LYS  25  80.375 -19.248  -5.274
  197    HZ2  LYS  25           HZ2      LYS  25  81.574 -19.687  -4.153
  198    HZ3  LYS  25           HZ3      LYS  25  81.981 -18.759  -5.517
  199    H    HIS  26           H        HIS  26  83.320 -13.669   1.178
  200    HA   HIS  26           HA       HIS  26  84.526 -11.578  -0.207
  201    HB2  HIS  26           HB2      HIS  26  86.396 -11.984   1.629
  202    HB3  HIS  26           HB1      HIS  26  84.801 -11.383   2.080
  203    HD1  HIS  26           HD1      HIS  26  85.361 -14.974   1.100
  204    HD2  HIS  26           HD2      HIS  26  84.756 -12.742   4.570
  205    HE1  HIS  26           HE1      HIS  26  84.939 -16.641   2.960
  206    HE2  HIS  26           HE2      HIS  26  84.569 -15.297   5.082
  207    H    LYS  27           H        LYS  27  85.974 -11.523  -1.786
  208    HA   LYS  27           HA       LYS  27  87.795 -13.835  -2.146
  209    HB2  LYS  27           HB2      LYS  27  86.294 -12.187  -4.177
  210    HB3  LYS  27           HB3      LYS  27  87.732 -13.109  -4.616
  211    HG2  LYS  27           HG2      LYS  27  86.667 -15.165  -3.727
  212    HG3  LYS  27           HG3      LYS  27  85.218 -14.236  -3.348
  213    HD2  LYS  27           HD2      LYS  27  85.158 -13.567  -5.808
  214    HD3  LYS  27           HD3      LYS  27  86.391 -14.800  -6.078
  215    HE2  LYS  27           HE2      LYS  27  83.547 -15.159  -5.146
  216    HE3  LYS  27           HE3      LYS  27  84.375 -15.951  -6.486
  217    HZ1  LYS  27           HZ1      LYS  27  84.989 -16.341  -3.607
  218    HZ2  LYS  27           HZ2      LYS  27  85.773 -17.110  -4.903
  219    HZ3  LYS  27           HZ3      LYS  27  84.135 -17.428  -4.588
  220    H    THR  28           H        THR  28  89.919 -13.390  -2.265
  221    HA   THR  28           HA       THR  28  91.816 -12.109  -1.864
  222    HB   THR  28           HB       THR  28  90.722 -10.598  -4.245
  223    HG1  THR  28           HG1      THR  28  92.150 -13.043  -4.139
  224   HG21  THR  28          HG21      THR  28  92.714  -9.532  -3.705
  225   HG22  THR  28          HG22      THR  28  93.316 -10.818  -4.747
  226   HG23  THR  28          HG23      THR  28  93.422 -10.982  -2.996
  227    H    GLY  29           H        GLY  29  89.353 -11.197  -0.499
  228    HA2  GLY  29           HA2      GLY  29  90.224  -8.998   0.866
  229    HA3  GLY  29           HA3      GLY  29  89.363  -8.318  -0.512
  230    HA   PRO  30           HA       PRO  30  86.442  -9.869   2.959
  231    HB2  PRO  30           HB2      PRO  30  85.995  -7.535   4.317
  232    HB3  PRO  30           HB1      PRO  30  87.271  -8.686   4.757
  233    HG2  PRO  30           HG2      PRO  30  87.469  -6.141   3.217
  234    HG3  PRO  30           HG1      PRO  30  88.559  -6.803   4.448
  235    HD2  PRO  30           HD2      PRO  30  89.081  -6.971   1.766
  236    HD3  PRO  30           HD1      PRO  30  89.647  -8.184   2.937
  237    H    ASN  31           H        ASN  31  84.179  -8.944   3.388
  238    HA   ASN  31           HA       ASN  31  83.129  -7.880   0.861
  239    HB2  ASN  31           HB2      ASN  31  81.014  -8.705   1.567
  240    HB3  ASN  31           HB1      ASN  31  82.182  -9.948   2.014
  241   HD21  ASN  31          HD21      ASN  31  82.423 -10.440   4.245
  242   HD22  ASN  31          HD22      ASN  31  81.553  -9.654   5.471
  243    H    LEU  32           H        LEU  32  81.313  -6.266   1.057
  244    HA   LEU  32           HA       LEU  32  81.895  -4.309   3.206
  245    HB2  LEU  32           HB2      LEU  32  80.824  -3.634   0.461
  246    HB3  LEU  32           HB3      LEU  32  81.406  -2.521   1.692
  247    HG   LEU  32           HG       LEU  32  83.039  -4.483   0.059
  248   HD11  LEU  32          HD11      LEU  32  82.769  -1.489   0.231
  249   HD12  LEU  32          HD12      LEU  32  82.835  -2.520  -1.196
  250   HD13  LEU  32          HD13      LEU  32  84.301  -2.193  -0.279
  251   HD21  LEU  32          HD21      LEU  32  84.164  -4.673   2.081
  252   HD22  LEU  32          HD22      LEU  32  83.656  -3.085   2.638
  253   HD23  LEU  32          HD23      LEU  32  84.936  -3.229   1.441
  254    H    HIS  33           H        HIS  33  79.988  -6.446   3.421
  255    HA   HIS  33           HA       HIS  33  77.346  -5.590   2.839
  256    HB2  HIS  33           HB2      HIS  33  78.246  -7.440   5.061
  257    HB3  HIS  33           HB1      HIS  33  76.632  -7.343   4.360
  258    HD1  HIS  33           HD1      HIS  33  78.913  -9.762   4.294
  259    HD2  HIS  33           HD2      HIS  33  77.552  -7.384   1.153
  260    HE1  HIS  33           HE1      HIS  33  79.377 -11.053   2.166
  261    HE2  HIS  33           HE2      HIS  33  78.549  -9.620   0.241
  262    H    GLY  34           H        GLY  34  75.843  -4.469   4.055
  263    HA2  GLY  34           HA2      GLY  34  75.290  -2.651   5.416
  264    HA3  GLY  34           HA3      GLY  34  75.679  -3.830   6.666
  265    H    LEU  35           H        LEU  35  78.060  -2.656   4.435
  266    HA   LEU  35           HA       LEU  35  80.054  -2.067   6.196
  267    HB2  LEU  35           HB2      LEU  35  80.411  -2.109   3.804
  268    HB3  LEU  35           HB3      LEU  35  79.365  -0.711   3.584
  269    HG   LEU  35           HG       LEU  35  81.095   0.406   5.284
  270   HD11  LEU  35          HD11      LEU  35  82.282  -1.916   5.369
  271   HD12  LEU  35          HD12      LEU  35  83.272  -0.464   5.224
  272   HD13  LEU  35          HD13      LEU  35  82.937  -1.446   3.804
  273   HD21  LEU  35          HD21      LEU  35  80.570   1.009   2.862
  274   HD22  LEU  35          HD22      LEU  35  81.908  -0.044   2.407
  275   HD23  LEU  35          HD23      LEU  35  82.206   1.381   3.402
  276    H    PHE  36           H        PHE  36  77.846   0.366   4.823
  277    HA   PHE  36           HA       PHE  36  78.712   2.546   6.306
  278    HB2  PHE  36           HB2      PHE  36  75.845   2.079   5.471
  279    HB3  PHE  36           HB1      PHE  36  76.665   3.625   5.690
  280    HD1  PHE  36           HD2      PHE  36  76.581   0.536   3.606
  281    HD2  PHE  36           HD1      PHE  36  77.999   4.582   3.943
  282    HE1  PHE  36           HE2      PHE  36  77.351   0.466   1.254
  283    HE2  PHE  36           HE1      PHE  36  78.755   4.510   1.594
  284    HZ   PHE  36           HZ       PHE  36  78.437   2.455   0.244
  285    H    GLY  37           H        GLY  37  79.106   2.051   8.485
  286    HA2  GLY  37           HA2      GLY  37  77.641   2.763  10.493
  287    HA3  GLY  37           HA3      GLY  37  76.761   1.295  10.111
  288    H    ARG  38           H        ARG  38  79.370  -0.074   9.369
  289    HA   ARG  38           HA       ARG  38  79.994  -0.915  12.102
  290    HB2  ARG  38           HB2      ARG  38  80.261  -2.074   9.397
  291    HB3  ARG  38           HB3      ARG  38  81.554  -2.486  10.523
  292    HG2  ARG  38           HG2      ARG  38  79.746  -3.129  12.192
  293    HG3  ARG  38           HG3      ARG  38  78.585  -2.966  10.875
  294    HD2  ARG  38           HD2      ARG  38  80.996  -4.622  10.317
  295    HD3  ARG  38           HD3      ARG  38  79.828  -5.296  11.446
  296    HE   ARG  38           HE       ARG  38  78.177  -4.649   9.498
  297   HH11  ARG  38          HH21      ARG  38  81.389  -5.961   9.268
  298   HH12  ARG  38          HH22      ARG  38  81.088  -6.774   7.771
  299   HH21  ARG  38          HH11      ARG  38  77.790  -5.738   7.551
  300   HH22  ARG  38          HH12      ARG  38  79.055  -6.658   6.808
  301    H    LYS  39           H        LYS  39  82.026  -0.933  13.030
  302    HA   LYS  39           HA       LYS  39  83.734   1.255  12.429
  303    HB2  LYS  39           HB2      LYS  39  83.822  -1.056  14.330
  304    HB3  LYS  39           HB3      LYS  39  85.270  -0.078  14.098
  305    HG2  LYS  39           HG2      LYS  39  82.679   1.352  14.559
  306    HG3  LYS  39           HG3      LYS  39  83.442   0.563  15.939
  307    HD2  LYS  39           HD2      LYS  39  85.518   1.805  15.537
  308    HD3  LYS  39           HD3      LYS  39  84.811   2.558  14.108
  309    HE2  LYS  39           HE2      LYS  39  82.958   3.404  15.679
  310    HE3  LYS  39           HE3      LYS  39  84.033   2.946  17.000
  311    HZ1  LYS  39           HZ1      LYS  39  84.086   5.314  15.724
  312    HZ2  LYS  39           HZ2      LYS  39  85.308   4.463  14.906
  313    HZ3  LYS  39           HZ3      LYS  39  85.386   4.658  16.593
  314    H    THR  40           H        THR  40  86.181   0.908  12.196
  315    HA   THR  40           HA       THR  40  86.669  -0.406   9.725
  316    HB   THR  40           HB       THR  40  89.089   0.161  10.252
  317    HG1  THR  40           HG1      THR  40  87.989   1.673  12.349
  318   HG21  THR  40          HG21      THR  40  88.634   2.638  10.096
  319   HG22  THR  40          HG22      THR  40  86.925   2.275  10.337
  320   HG23  THR  40          HG23      THR  40  87.764   1.663   8.912
  321    H    GLY  41           H        GLY  41  87.837  -2.225   9.228
  322    HA2  GLY  41           HA2      GLY  41  88.358  -4.453   9.487
  323    HA3  GLY  41           HA3      GLY  41  89.390  -3.847  10.779
  324    H    GLN  42           H        GLN  42  85.856  -4.128  10.421
  325    HA   GLN  42           HA       GLN  42  85.807  -5.560  13.012
  326    HB2  GLN  42           HB2      GLN  42  84.656  -3.241  12.702
  327    HB3  GLN  42           HB1      GLN  42  83.420  -4.159  11.842
  328    HG2  GLN  42           HG2      GLN  42  83.407  -5.722  13.893
  329    HG3  GLN  42           HG1      GLN  42  84.296  -4.443  14.718
  330   HE21  GLN  42          HE21      GLN  42  81.183  -5.234  13.197
  331   HE22  GLN  42          HE22      GLN  42  80.332  -3.930  13.874
  332    H    ALA  43           H        ALA  43  85.063  -5.758   9.658
  333    HA   ALA  43           HA       ALA  43  82.982  -7.667   9.746
  334    HB1  ALA  43           HB1      ALA  43  83.043  -7.226   7.548
  335    HB2  ALA  43           HB2      ALA  43  84.568  -8.102   7.420
  336    HB3  ALA  43           HB3      ALA  43  84.571  -6.370   7.752
  337    HA   PRO  44           HA       PRO  44  85.623 -11.051  11.094
  338    HB2  PRO  44           HB2      PRO  44  83.702 -12.935  11.388
  339    HB3  PRO  44           HB1      PRO  44  83.871 -11.581  12.523
  340    HG2  PRO  44           HG2      PRO  44  81.945 -11.935  10.276
  341    HG3  PRO  44           HG1      PRO  44  81.676 -11.274  11.898
  342    HD2  PRO  44           HD2      PRO  44  82.040  -9.715   9.645
  343    HD3  PRO  44           HD1      PRO  44  82.395  -9.168  11.300
  344    H    GLY  45           H        GLY  45  86.910 -12.003   9.603
  345    HA2  GLY  45           HA2      GLY  45  86.388 -14.195   8.104
  346    HA3  GLY  45           HA3      GLY  45  85.876 -12.885   7.045
  347    H    PHE  46           H        PHE  46  87.462 -11.262   6.453
  348    HA   PHE  46           HA       PHE  46  89.984 -12.424   5.778
  349    HB2  PHE  46           HB2      PHE  46  88.683 -10.676   4.450
  350    HB3  PHE  46           HB1      PHE  46  89.279  -9.494   5.615
  351    HD1  PHE  46           HD1      PHE  46  91.688  -9.004   5.802
  352    HD2  PHE  46           HD2      PHE  46  90.170 -11.727   2.847
  353    HE1  PHE  46           HE1      PHE  46  93.844  -8.882   4.582
  354    HE2  PHE  46           HE2      PHE  46  92.326 -11.605   1.627
  355    HZ   PHE  46           HZ       PHE  46  94.163 -10.182   2.495
  356    H    THR  47           H        THR  47  92.067 -11.769   6.440
  357    HA   THR  47           HA       THR  47  92.268 -11.134   9.241
  358    HB   THR  47           HB       THR  47  94.509 -11.307   7.220
  359    HG1  THR  47           HG1      THR  47  94.574 -13.507   7.897
  360   HG21  THR  47          HG21      THR  47  94.384 -11.765  10.214
  361   HG22  THR  47          HG22      THR  47  95.098 -10.364   9.418
  362   HG23  THR  47          HG23      THR  47  95.819 -11.960   9.207
  363    H    TYR  48           H        TYR  48  91.292  -9.028   9.260
  364    HA   TYR  48           HA       TYR  48  92.153  -6.824   7.764
  365    HB2  TYR  48           HB2      TYR  48  90.725  -7.197  10.356
  366    HB3  TYR  48           HB3      TYR  48  91.341  -5.590   9.986
  367    HD1  TYR  48           HD2      TYR  48  90.872  -4.740   7.540
  368    HD2  TYR  48           HD1      TYR  48  88.616  -7.805   9.528
  369    HE1  TYR  48           HE2      TYR  48  88.971  -4.331   6.007
  370    HE2  TYR  48           HE1      TYR  48  86.711  -7.393   7.993
  371    HH   TYR  48           HH       TYR  48  86.133  -4.893   6.427
  372    H    THR  49           H        THR  49  93.519  -5.078   8.287
  373    HA   THR  49           HA       THR  49  95.967  -5.885   9.610
  374    HB   THR  49           HB       THR  49  96.791  -3.670   8.869
  375    HG1  THR  49           HG1      THR  49  95.126  -2.328   8.888
  376   HG21  THR  49          HG21      THR  49  96.555  -5.779   7.355
  377   HG22  THR  49          HG22      THR  49  96.891  -4.228   6.588
  378   HG23  THR  49          HG23      THR  49  95.252  -4.877   6.580
  379    H    ASP  50           H        ASP  50  97.022  -4.485  11.225
  380    HA   ASP  50           HA       ASP  50  95.473  -4.127  13.522
  381    HB2  ASP  50           HB2      ASP  50  97.434  -2.702  14.296
  382    HB3  ASP  50           HB1      ASP  50  97.822  -4.343  13.787
  383    H    ALA  51           H        ALA  51  96.618  -1.723  11.173
  384    HA   ALA  51           HA       ALA  51  95.619   0.584  12.355
  385    HB1  ALA  51           HB1      ALA  51  95.502   1.464   9.996
  386    HB2  ALA  51           HB2      ALA  51  95.918  -0.159   9.443
  387    HB3  ALA  51           HB3      ALA  51  97.051   0.749  10.444
  388    H    ASN  52           H        ASN  52  93.974  -1.784  10.310
  389    HA   ASN  52           HA       ASN  52  91.502  -0.274  10.273
  390    HB2  ASN  52           HB2      ASN  52  92.598  -2.648   8.962
  391    HB3  ASN  52           HB1      ASN  52  90.921  -2.868   9.444
  392   HD21  ASN  52          HD21      ASN  52  90.230  -2.778   7.174
  393   HD22  ASN  52          HD22      ASN  52  90.194  -1.299   6.339
  394    H    LYS  53           H        LYS  53  92.945  -2.792  12.189
  395    HA   LYS  53           HA       LYS  53  90.447  -3.520  13.477
  396    HB2  LYS  53           HB2      LYS  53  91.819  -5.383  13.331
  397    HB3  LYS  53           HB3      LYS  53  93.290  -4.449  13.577
  398    HG2  LYS  53           HG2      LYS  53  92.835  -4.201  15.927
  399    HG3  LYS  53           HG3      LYS  53  91.221  -4.890  15.737
  400    HD2  LYS  53           HD2      LYS  53  92.427  -6.993  14.846
  401    HD3  LYS  53           HD3      LYS  53  93.893  -6.284  15.526
  402    HE2  LYS  53           HE2      LYS  53  91.348  -6.953  17.033
  403    HE3  LYS  53           HE3      LYS  53  92.898  -7.780  17.173
  404    HZ1  LYS  53           HZ1      LYS  53  92.043  -5.254  18.294
  405    HZ2  LYS  53           HZ2      LYS  53  93.606  -5.245  17.629
  406    HZ3  LYS  53           HZ3      LYS  53  93.208  -6.351  18.853
  407    H    ASN  54           H        ASN  54  92.755  -1.102  13.708
  408    HA   ASN  54           HA       ASN  54  92.921  -0.728  16.516
  409    HB2  ASN  54           HB2      ASN  54  94.053   1.213  16.010
  410    HB3  ASN  54           HB1      ASN  54  94.282   0.319  14.514
  411   HD21  ASN  54          HD21      ASN  54  91.588   0.712  13.465
  412   HD22  ASN  54          HD22      ASN  54  91.432   2.357  13.082
  413    H    LYS  55           H        LYS  55  90.469  -0.170  14.220
  414    HA   LYS  55           HA       LYS  55  88.367   0.773  14.351
  415    HB2  LYS  55           HB2      LYS  55  88.591   0.783  17.346
  416    HB3  LYS  55           HB3      LYS  55  87.189   0.437  16.335
  417    HG2  LYS  55           HG2      LYS  55  88.663  -1.586  15.496
  418    HG3  LYS  55           HG3      LYS  55  89.512  -1.332  17.021
  419    HD2  LYS  55           HD2      LYS  55  87.409  -1.567  18.261
  420    HD3  LYS  55           HD3      LYS  55  86.522  -1.760  16.748
  421    HE2  LYS  55           HE2      LYS  55  87.172  -3.912  18.020
  422    HE3  LYS  55           HE3      LYS  55  87.524  -3.854  16.292
  423    HZ1  LYS  55           HZ1      LYS  55  89.482  -3.104  18.389
  424    HZ2  LYS  55           HZ2      LYS  55  89.778  -3.327  16.731
  425    HZ3  LYS  55           HZ3      LYS  55  89.387  -4.657  17.714
  426    H    GLY  56           H        GLY  56  89.843   2.692  13.616
  427    HA2  GLY  56           HA2      GLY  56  90.030   4.841  15.577
  428    HA3  GLY  56           HA3      GLY  56  90.586   4.898  13.908
  429    H    ILE  57           H        ILE  57  88.254   4.146  12.579
  430    HA   ILE  57           HA       ILE  57  86.224   6.113  13.407
  431    HB   ILE  57           HB       ILE  57  86.094   7.063  11.185
  432   HG12  ILE  57          HG12      ILE  57  88.154   6.342   9.646
  433   HG13  ILE  57          HG13      ILE  57  88.028   4.846  10.566
  434   HG21  ILE  57          HG21      ILE  57  88.963   6.946  12.160
  435   HG22  ILE  57          HG22      ILE  57  87.719   8.042  12.762
  436   HG23  ILE  57          HG23      ILE  57  88.286   8.181  11.099
  437   HD11  ILE  57          HD11      ILE  57  86.004   4.282   9.628
  438   HD12  ILE  57          HD12      ILE  57  86.626   5.272   8.313
  439   HD13  ILE  57          HD13      ILE  57  85.484   5.958   9.465
  440    H    THR  58           H        THR  58  84.347   5.918  11.621
  441    HA   THR  58           HA       THR  58  83.832   3.024  11.273
  442    HB   THR  58           HB       THR  58  81.954   5.226  12.134
  443    HG1  THR  58           HG1      THR  58  83.172   4.215  13.756
  444   HG21  THR  58          HG21      THR  58  80.460   4.075  10.825
  445   HG22  THR  58          HG22      THR  58  80.433   2.996  12.219
  446   HG23  THR  58          HG23      THR  58  81.434   2.606  10.824
  447    H    TRP  59           H        TRP  59  82.955   2.334   9.382
  448    HA   TRP  59           HA       TRP  59  83.286   3.923   7.066
  449    HB2  TRP  59           HB2      TRP  59  81.451   1.538   7.206
  450    HB3  TRP  59           HB1      TRP  59  82.426   2.102   5.848
  451    HD1  TRP  59           HD1      TRP  59  85.210   2.418   7.208
  452    HE1  TRP  59           HE1      TRP  59  86.523   0.335   7.990
  453    HE3  TRP  59           HE3      TRP  59  81.395  -0.946   7.634
  454    HZ2  TRP  59           HZ2      TRP  59  86.010  -2.378   8.732
  455    HZ3  TRP  59           HZ3      TRP  59  81.836  -3.268   8.369
  456    HH2  TRP  59           HH2      TRP  59  84.138  -3.986   8.920
  457    H    LYS  60           H        LYS  60  81.892   5.160   5.922
  458    HA   LYS  60           HA       LYS  60  79.041   5.139   6.459
  459    HB2  LYS  60           HB2      LYS  60  80.780   7.512   7.170
  460    HB3  LYS  60           HB3      LYS  60  79.033   7.615   6.964
  461    HG2  LYS  60           HG2      LYS  60  78.876   5.710   8.681
  462    HG3  LYS  60           HG3      LYS  60  80.572   6.039   9.034
  463    HD2  LYS  60           HD2      LYS  60  78.460   8.205   9.091
  464    HD3  LYS  60           HD3      LYS  60  78.866   7.243  10.511
  465    HE2  LYS  60           HE2      LYS  60  81.271   7.924  10.192
  466    HE3  LYS  60           HE3      LYS  60  80.732   9.029   8.927
  467    HZ1  LYS  60           HZ1      LYS  60  80.918   9.707  11.490
  468    HZ2  LYS  60           HZ2      LYS  60  79.300   9.191  11.447
  469    HZ3  LYS  60           HZ3      LYS  60  79.827  10.431  10.412
  470    H    GLU  61           H        GLU  61  78.435   7.605   5.251
  471    HA   GLU  61           HA       GLU  61  78.891   6.918   2.495
  472    HB2  GLU  61           HB2      GLU  61  76.761   7.914   3.361
  473    HB3  GLU  61           HB3      GLU  61  77.629   9.428   3.619
  474    HG2  GLU  61           HG2      GLU  61  78.143   9.604   1.257
  475    HG3  GLU  61           HG3      GLU  61  77.467   8.004   0.949
  476    H    GLU  62           H        GLU  62  79.618   9.863   4.395
  477    HA   GLU  62           HA       GLU  62  81.343  10.940   2.392
  478    HB2  GLU  62           HB2      GLU  62  80.933  11.614   5.310
  479    HB3  GLU  62           HB3      GLU  62  82.023  12.514   4.254
  480    HG2  GLU  62           HG2      GLU  62  79.126  12.036   3.540
  481    HG3  GLU  62           HG3      GLU  62  79.641  13.435   4.480
  482    H    THR  63           H        THR  63  81.899   9.136   5.395
  483    HA   THR  63           HA       THR  63  84.677   9.344   5.537
  484    HB   THR  63           HB       THR  63  84.616   7.220   6.773
  485    HG1  THR  63           HG1      THR  63  82.754   6.594   5.176
  486   HG21  THR  63          HG21      THR  63  82.388   9.189   7.281
  487   HG22  THR  63          HG22      THR  63  83.968   9.105   8.062
  488   HG23  THR  63          HG23      THR  63  82.754   7.869   8.393
  489    H    LEU  64           H        LEU  64  82.617   7.236   3.614
  490    HA   LEU  64           HA       LEU  64  84.694   5.597   2.588
  491    HB2  LEU  64           HB2      LEU  64  81.836   5.975   2.123
  492    HB3  LEU  64           HB3      LEU  64  82.717   5.623   0.641
  493    HG   LEU  64           HG       LEU  64  83.040   3.988   3.164
  494   HD11  LEU  64          HD11      LEU  64  80.903   4.001   1.144
  495   HD12  LEU  64          HD12      LEU  64  80.934   3.261   2.741
  496   HD13  LEU  64          HD13      LEU  64  81.649   2.420   1.366
  497   HD21  LEU  64          HD21      LEU  64  84.556   4.127   0.821
  498   HD22  LEU  64          HD22      LEU  64  83.506   2.737   0.550
  499   HD23  LEU  64          HD23      LEU  64  84.551   2.790   1.969
  500    H    MET  65           H        MET  65  83.221   8.634   1.524
  501    HA   MET  65           HA       MET  65  84.341   8.791  -1.036
  502    HB2  MET  65           HB2      MET  65  83.794  11.041   0.910
  503    HB3  MET  65           HB1      MET  65  84.082  11.237  -0.818
  504    HG2  MET  65           HG2      MET  65  82.108   9.968  -1.366
  505    HG3  MET  65           HG1      MET  65  81.874   9.512   0.320
  506    HE1  MET  65           HE1      MET  65  81.803  12.242  -2.351
  507    HE2  MET  65           HE2      MET  65  80.322  13.064  -1.866
  508    HE3  MET  65           HE3      MET  65  80.291  11.335  -2.205
  509    H    GLU  66           H        GLU  66  85.621  10.261   1.957
  510    HA   GLU  66           HA       GLU  66  88.059  11.112   0.836
  511    HB2  GLU  66           HB2      GLU  66  87.504  10.311   3.703
  512    HB3  GLU  66           HB3      GLU  66  88.831  11.328   3.142
  513    HG2  GLU  66           HG2      GLU  66  87.083  12.893   2.179
  514    HG3  GLU  66           HG3      GLU  66  85.871  11.945   3.040
  515    H    TYR  67           H        TYR  67  86.980   8.052   2.091
  516    HA   TYR  67           HA       TYR  67  89.608   6.862   2.199
  517    HB2  TYR  67           HB2      TYR  67  87.993   5.984   3.712
  518    HB3  TYR  67           HB3      TYR  67  86.805   5.781   2.431
  519    HD1  TYR  67           HD2      TYR  67  87.070   4.000   0.728
  520    HD2  TYR  67           HD1      TYR  67  89.749   4.367   4.065
  521    HE1  TYR  67           HE2      TYR  67  87.891   1.696   0.321
  522    HE2  TYR  67           HE1      TYR  67  90.568   2.061   3.661
  523    HH   TYR  67           HH       TYR  67  90.182   0.435   0.889
  524    H    LEU  68           H        LEU  68  87.102   7.285  -0.157
  525    HA   LEU  68           HA       LEU  68  87.982   5.180  -1.910
  526    HB2  LEU  68           HB2      LEU  68  85.942   7.368  -2.032
  527    HB3  LEU  68           HB3      LEU  68  86.462   6.630  -3.541
  528    HG   LEU  68           HG       LEU  68  85.319   5.154  -1.148
  529   HD11  LEU  68          HD11      LEU  68  83.465   4.665  -2.756
  530   HD12  LEU  68          HD12      LEU  68  84.210   5.786  -3.896
  531   HD13  LEU  68          HD13      LEU  68  83.605   6.374  -2.353
  532   HD21  LEU  68          HD21      LEU  68  86.495   3.433  -2.054
  533   HD22  LEU  68          HD22      LEU  68  86.732   4.263  -3.590
  534   HD23  LEU  68          HD23      LEU  68  85.214   3.435  -3.264
  535    H    GLU  69           H        GLU  69  88.821   8.520  -1.414
  536    HA   GLU  69           HA       GLU  69  90.229   8.638  -3.993
  537    HB2  GLU  69           HB2      GLU  69  90.405  10.964  -3.680
  538    HB3  GLU  69           HB3      GLU  69  88.806  10.563  -3.061
  539    HG2  GLU  69           HG2      GLU  69  89.867  10.384  -0.760
  540    HG3  GLU  69           HG3      GLU  69  91.320  11.090  -1.464
  541    H    ASN  70           H        ASN  70  90.799   7.689  -0.856
  542    HA   ASN  70           HA       ASN  70  93.601   7.346  -1.303
  543    HB2  ASN  70           HB2      ASN  70  94.409   8.760   0.538
  544    HB3  ASN  70           HB1      ASN  70  93.649   9.725  -0.724
  545   HD21  ASN  70          HD21      ASN  70  93.215   8.495   2.586
  546   HD22  ASN  70          HD22      ASN  70  91.927   9.531   2.976
  547    HA   PRO  71           HA       PRO  71  91.149   4.472   1.537
  548    HB2  PRO  71           HB2      PRO  71  92.980   2.640   0.041
  549    HB3  PRO  71           HB1      PRO  71  91.274   2.421   0.474
  550    HG2  PRO  71           HG2      PRO  71  92.028   3.051  -2.010
  551    HG3  PRO  71           HG1      PRO  71  90.523   3.663  -1.301
  552    HD2  PRO  71           HD2      PRO  71  93.066   5.110  -1.848
  553    HD3  PRO  71           HD1      PRO  71  91.405   5.735  -1.767
  554    H    LYS  72           H        LYS  72  94.588   4.718   0.721
  555    HA   LYS  72           HA       LYS  72  95.441   3.391   3.142
  556    HB2  LYS  72           HB2      LYS  72  96.724   3.210   1.044
  557    HB3  LYS  72           HB3      LYS  72  97.035   4.940   1.092
  558    HG2  LYS  72           HG2      LYS  72  98.980   4.041   2.055
  559    HG3  LYS  72           HG3      LYS  72  98.018   4.480   3.462
  560    HD2  LYS  72           HD2      LYS  72  98.953   2.231   3.749
  561    HD3  LYS  72           HD3      LYS  72  97.199   2.139   3.619
  562    HE2  LYS  72           HE2      LYS  72  97.276   1.047   1.604
  563    HE3  LYS  72           HE3      LYS  72  98.696   1.939   1.056
  564    HZ1  LYS  72           HZ1      LYS  72  98.532  -0.501   2.655
  565    HZ2  LYS  72           HZ2      LYS  72  99.803   0.573   2.995
  566    HZ3  LYS  72           HZ3      LYS  72  99.630  -0.078   1.435
  567    H    LYS  73           H        LYS  73  95.605   6.745   1.909
  568    HA   LYS  73           HA       LYS  73  96.909   7.812   4.146
  569    HB2  LYS  73           HB2      LYS  73  96.333   8.870   1.806
  570    HB3  LYS  73           HB3      LYS  73  94.894   9.448   2.642
  571    HG2  LYS  73           HG2      LYS  73  97.511   9.853   4.030
  572    HG3  LYS  73           HG3      LYS  73  97.196  10.847   2.612
  573    HD2  LYS  73           HD2      LYS  73  95.047  10.580   4.694
  574    HD3  LYS  73           HD3      LYS  73  96.408  11.656   5.003
  575    HE2  LYS  73           HE2      LYS  73  94.866  11.781   2.411
  576    HE3  LYS  73           HE3      LYS  73  94.342  12.674   3.838
  577    HZ1  LYS  73           HZ1      LYS  73  96.346  13.879   3.887
  578    HZ2  LYS  73           HZ2      LYS  73  95.847  13.897   2.262
  579    HZ3  LYS  73           HZ3      LYS  73  97.094  12.856   2.759
  580    H    TYR  74           H        TYR  74  93.542   7.023   3.618
  581    HA   TYR  74           HA       TYR  74  92.479   8.537   5.775
  582    HB2  TYR  74           HB2      TYR  74  91.330   7.203   3.754
  583    HB3  TYR  74           HB3      TYR  74  91.179   5.967   5.001
  584    HD1  TYR  74           HD1      TYR  74  90.782   9.695   4.697
  585    HD2  TYR  74           HD2      TYR  74  89.216   6.012   6.262
  586    HE1  TYR  74           HE1      TYR  74  88.866  10.926   5.679
  587    HE2  TYR  74           HE2      TYR  74  87.302   7.244   7.243
  588    HH   TYR  74           HH       TYR  74  87.067   9.969   8.007
  589    H    ILE  75           H        ILE  75  93.180   5.044   5.519
  590    HA   ILE  75           HA       ILE  75  93.697   5.025   8.436
  591    HB   ILE  75           HB       ILE  75  92.358   2.812   6.860
  592   HG12  ILE  75          HG12      ILE  75  91.074   4.540   8.981
  593   HG13  ILE  75          HG13      ILE  75  91.043   5.015   7.285
  594   HG21  ILE  75          HG21      ILE  75  93.105   3.204   9.765
  595   HG22  ILE  75          HG22      ILE  75  93.523   1.858   8.705
  596   HG23  ILE  75          HG23      ILE  75  91.864   2.052   9.271
  597   HD11  ILE  75          HD11      ILE  75  89.896   2.982   6.662
  598   HD12  ILE  75          HD12      ILE  75  89.021   3.701   8.014
  599   HD13  ILE  75          HD13      ILE  75  90.087   2.322   8.286
  600    HA   PRO  76           HA       PRO  76  97.453   3.803   5.855
  601    HB2  PRO  76           HB2      PRO  76  98.506   4.604   8.551
  602    HB3  PRO  76           HB1      PRO  76  99.186   4.912   6.939
  603    HG2  PRO  76           HG2      PRO  76  97.874   6.805   8.290
  604    HG3  PRO  76           HG1      PRO  76  97.768   6.669   6.526
  605    HD2  PRO  76           HD2      PRO  76  95.715   6.044   8.577
  606    HD3  PRO  76           HD1      PRO  76  95.506   6.456   6.862
  607    H    GLY  77           H        GLY  77  98.030   1.712   5.773
  608    HA2  GLY  77           HA2      GLY  77  99.103  -0.160   6.977
  609    HA3  GLY  77           HA3      GLY  77  97.920   0.093   8.257
  610    H    THR  78           H        THR  78  95.751   0.622   6.332
  611    HA   THR  78           HA       THR  78  94.626  -1.919   6.131
  612    HB   THR  78           HB       THR  78  93.380   0.236   5.969
  613    HG1  THR  78           HG1      THR  78  92.881  -2.006   4.862
  614   HG21  THR  78          HG21      THR  78  93.403   1.508   3.961
  615   HG22  THR  78          HG22      THR  78  94.287   0.254   3.090
  616   HG23  THR  78          HG23      THR  78  95.098   1.201   4.339
  617    H    LYS  79           H        LYS  79  94.626  -3.511   4.596
  618    HA   LYS  79           HA       LYS  79  96.732  -3.372   2.591
  619    HB2  LYS  79           HB2      LYS  79  96.387  -5.419   3.935
  620    HB3  LYS  79           HB3      LYS  79  94.791  -5.610   3.212
  621    HG2  LYS  79           HG2      LYS  79  95.643  -6.456   1.283
  622    HG3  LYS  79           HG3      LYS  79  96.903  -5.227   1.203
  623    HD2  LYS  79           HD2      LYS  79  97.984  -7.370   1.458
  624    HD3  LYS  79           HD3      LYS  79  98.153  -6.506   2.985
  625    HE2  LYS  79           HE2      LYS  79  95.996  -7.723   3.706
  626    HE3  LYS  79           HE3      LYS  79  96.276  -8.775   2.319
  627    HZ1  LYS  79           HZ1      LYS  79  98.681  -8.812   3.391
  628    HZ2  LYS  79           HZ2      LYS  79  97.464  -9.904   3.853
  629    HZ3  LYS  79           HZ3      LYS  79  97.783  -8.530   4.802
  630    H    MET  80           H        MET  80  95.997  -1.879   1.073
  631    HA   MET  80           HA       MET  80  94.448  -2.897  -1.054
  632    HB2  MET  80           HB2      MET  80  92.518  -2.534   0.380
  633    HB3  MET  80           HB1      MET  80  93.033  -0.879   0.707
  634    HG2  MET  80           HG2      MET  80  92.691  -0.237  -1.591
  635    HG3  MET  80           HG1      MET  80  92.433  -1.912  -2.077
  636    HE1  MET  80           HE1      MET  80  90.846   1.087  -2.023
  637    HE2  MET  80           HE2      MET  80  89.153   0.609  -2.030
  638    HE3  MET  80           HE3      MET  80  90.279  -0.151  -3.151
  639    H    ILE  81           H        ILE  81  95.998  -2.118  -2.407
  640    HA   ILE  81           HA       ILE  81  96.178   0.818  -2.653
  641    HB   ILE  81           HB       ILE  81  98.512  -1.110  -2.796
  642   HG12  ILE  81          HG12      ILE  81  99.213   0.626  -0.887
  643   HG13  ILE  81          HG13      ILE  81  97.466   0.780  -0.708
  644   HG21  ILE  81          HG21      ILE  81  98.898   0.615  -4.390
  645   HG22  ILE  81          HG22      ILE  81  99.774   1.121  -2.946
  646   HG23  ILE  81          HG23      ILE  81  98.215   1.851  -3.333
  647   HD11  ILE  81          HD11      ILE  81  97.643  -1.911  -0.790
  648   HD12  ILE  81          HD12      ILE  81  97.790  -1.001   0.712
  649   HD13  ILE  81          HD13      ILE  81  99.237  -1.546  -0.132
  650    H    PHE  82           H        PHE  82  94.651   0.548  -4.375
  651    HA   PHE  82           HA       PHE  82  95.775  -0.696  -6.817
  652    HB2  PHE  82           HB2      PHE  82  93.691  -1.746  -6.148
  653    HB3  PHE  82           HB1      PHE  82  92.900  -0.174  -6.026
  654    HD1  PHE  82           HD2      PHE  82  94.598  -2.479  -8.423
  655    HD2  PHE  82           HD1      PHE  82  91.934   0.855  -7.928
  656    HE1  PHE  82           HE2      PHE  82  94.019  -2.583 -10.833
  657    HE2  PHE  82           HE1      PHE  82  91.355   0.750 -10.337
  658    HZ   PHE  82           HZ       PHE  82  92.398  -0.969 -11.790
  659    H    ALA  83           H        ALA  83  93.279   1.769  -6.195
  660    HA   ALA  83           HA       ALA  83  94.755   3.968  -7.184
  661    HB1  ALA  83           HB1      ALA  83  93.506   4.231  -9.361
  662    HB2  ALA  83           HB2      ALA  83  92.963   2.564  -9.175
  663    HB3  ALA  83           HB3      ALA  83  94.683   2.919  -9.342
  664    H    GLY  84           H        GLY  84  93.827   5.533  -6.044
  665    HA2  GLY  84           HA2      GLY  84  91.194   5.392  -4.989
  666    HA3  GLY  84           HA3      GLY  84  92.237   6.809  -4.972
  667    H    ILE  85           H        ILE  85  89.658   7.324  -5.309
  668    HA   ILE  85           HA       ILE  85  88.927   7.385  -8.122
  669    HB   ILE  85           HB       ILE  85  87.627   8.470  -5.622
  670   HG12  ILE  85          HG12      ILE  85  87.752   5.913  -6.288
  671   HG13  ILE  85          HG13      ILE  85  86.238   6.597  -5.710
  672   HG21  ILE  85          HG21      ILE  85  86.899   9.954  -7.315
  673   HG22  ILE  85          HG22      ILE  85  85.628   8.734  -7.232
  674   HG23  ILE  85          HG23      ILE  85  86.824   8.671  -8.524
  675   HD11  ILE  85          HD11      ILE  85  86.197   5.153  -7.875
  676   HD12  ILE  85          HD12      ILE  85  86.859   6.589  -8.654
  677   HD13  ILE  85          HD13      ILE  85  85.292   6.667  -7.852
  678    H    LYS  86           H        LYS  86  88.348   9.429  -9.196
  679    HA   LYS  86           HA       LYS  86  90.340  11.505  -8.585
  680    HB2  LYS  86           HB2      LYS  86  90.461  10.640 -10.830
  681    HB3  LYS  86           HB3      LYS  86  88.736  10.905 -11.077
  682    HG2  LYS  86           HG2      LYS  86  89.007  13.294 -10.972
  683    HG3  LYS  86           HG3      LYS  86  90.683  13.137 -10.444
  684    HD2  LYS  86           HD2      LYS  86  91.446  12.582 -12.557
  685    HD3  LYS  86           HD3      LYS  86  89.919  11.838 -13.030
  686    HE2  LYS  86           HE2      LYS  86  88.886  14.111 -13.121
  687    HE3  LYS  86           HE3      LYS  86  90.467  14.810 -12.771
  688    HZ1  LYS  86           HZ1      LYS  86  90.302  12.900 -14.971
  689    HZ2  LYS  86           HZ2      LYS  86  91.255  14.299 -14.814
  690    HZ3  LYS  86           HZ3      LYS  86  89.611  14.428 -15.226
  691    H    LYS  87           H        LYS  87  87.080  11.629 -10.063
  692    HA   LYS  87           HA       LYS  87  86.628  14.223  -8.831
  693    HB2  LYS  87           HB2      LYS  87  84.857  12.549 -10.627
  694    HB3  LYS  87           HB3      LYS  87  84.529  14.207 -10.126
  695    HG2  LYS  87           HG2      LYS  87  87.066  14.483 -11.095
  696    HG3  LYS  87           HG3      LYS  87  86.475  13.185 -12.128
  697    HD2  LYS  87           HD2      LYS  87  84.997  15.797 -11.684
  698    HD3  LYS  87           HD3      LYS  87  86.072  15.495 -13.046
  699    HE2  LYS  87           HE2      LYS  87  83.914  13.491 -12.522
  700    HE3  LYS  87           HE3      LYS  87  83.449  15.037 -13.227
  701    HZ1  LYS  87           HZ1      LYS  87  83.988  13.391 -14.921
  702    HZ2  LYS  87           HZ2      LYS  87  85.558  13.237 -14.287
  703    HZ3  LYS  87           HZ3      LYS  87  85.057  14.706 -14.977
  704    H    LYS  88           H        LYS  88  84.578  14.702  -7.720
  705    HA   LYS  88           HA       LYS  88  84.193  12.946  -5.506
  706    HB2  LYS  88           HB2      LYS  88  83.920  15.464  -5.481
  707    HB3  LYS  88           HB3      LYS  88  82.393  15.229  -6.331
  708    HG2  LYS  88           HG2      LYS  88  81.834  13.557  -4.413
  709    HG3  LYS  88           HG3      LYS  88  83.149  14.350  -3.547
  710    HD2  LYS  88           HD2      LYS  88  81.362  15.666  -2.868
  711    HD3  LYS  88           HD3      LYS  88  81.880  16.559  -4.298
  712    HE2  LYS  88           HE2      LYS  88  80.214  15.081  -5.601
  713    HE3  LYS  88           HE3      LYS  88  79.555  14.652  -4.023
  714    HZ1  LYS  88           HZ1      LYS  88  78.837  16.814  -5.463
  715    HZ2  LYS  88           HZ2      LYS  88  79.973  17.477  -4.388
  716    HZ3  LYS  88           HZ3      LYS  88  78.617  16.647  -3.789
  717    H    THR  89           H        THR  89  82.044  13.908  -8.202
  718    HA   THR  89           HA       THR  89  79.850  12.343  -7.586
  719    HB   THR  89           HB       THR  89  79.382  12.289 -10.021
  720    HG1  THR  89           HG1      THR  89  81.392  13.885 -10.777
  721   HG21  THR  89          HG21      THR  89  80.384  14.911  -8.879
  722   HG22  THR  89          HG22      THR  89  78.750  14.262  -8.749
  723   HG23  THR  89          HG23      THR  89  79.373  14.776 -10.317
  724    H    GLU  90           H        GLU  90  82.957  11.376  -8.833
  725    HA   GLU  90           HA       GLU  90  82.184   8.786  -9.745
  726    HB2  GLU  90           HB2      GLU  90  84.821  10.017  -8.952
  727    HB3  GLU  90           HB3      GLU  90  84.694   8.314  -9.386
  728    HG2  GLU  90           HG2      GLU  90  83.941   8.827 -11.585
  729    HG3  GLU  90           HG3      GLU  90  83.632  10.511 -11.163
  730    H    ARG  91           H        ARG  91  83.217  10.160  -6.685
  731    HA   ARG  91           HA       ARG  91  83.370   7.622  -5.313
  732    HB2  ARG  91           HB2      ARG  91  83.188  10.438  -4.196
  733    HB3  ARG  91           HB3      ARG  91  83.624   8.990  -3.290
  734    HG2  ARG  91           HG2      ARG  91  85.534   8.667  -4.909
  735    HG3  ARG  91           HG3      ARG  91  85.165  10.262  -5.561
  736    HD2  ARG  91           HD2      ARG  91  85.271  10.492  -2.711
  737    HD3  ARG  91           HD3      ARG  91  86.708   9.618  -3.233
  738    HE   ARG  91           HE       ARG  91  86.544  11.734  -4.968
  739   HH11  ARG  91          HH21      ARG  91  86.573  11.328  -1.530
  740   HH12  ARG  91          HH22      ARG  91  87.330  12.854  -1.219
  741   HH21  ARG  91          HH11      ARG  91  87.536  13.736  -4.565
  742   HH22  ARG  91          HH12      ARG  91  87.876  14.216  -2.936
  743    H    GLU  92           H        GLU  92  81.103  10.380  -5.314
  744    HA   GLU  92           HA       GLU  92  79.232   9.310  -3.522
  745    HB2  GLU  92           HB2      GLU  92  79.348  11.685  -4.498
  746    HB3  GLU  92           HB3      GLU  92  78.477  11.029  -5.885
  747    HG2  GLU  92           HG2      GLU  92  76.775  10.119  -4.209
  748    HG3  GLU  92           HG3      GLU  92  77.565  11.134  -3.003
  749    H    ASP  93           H        ASP  93  79.213   9.234  -7.103
  750    HA   ASP  93           HA       ASP  93  76.936   7.618  -7.390
  751    HB2  ASP  93           HB2      ASP  93  79.384   7.725  -9.171
  752    HB3  ASP  93           HB1      ASP  93  77.801   7.097  -9.626
  753    H    LEU  94           H        LEU  94  80.375   6.741  -7.167
  754    HA   LEU  94           HA       LEU  94  80.064   3.955  -7.408
  755    HB2  LEU  94           HB2      LEU  94  82.261   5.024  -7.573
  756    HB3  LEU  94           HB3      LEU  94  82.147   5.543  -5.894
  757    HG   LEU  94           HG       LEU  94  82.147   3.241  -5.120
  758   HD11  LEU  94          HD11      LEU  94  81.001   1.990  -6.726
  759   HD12  LEU  94          HD12      LEU  94  82.670   1.498  -7.015
  760   HD13  LEU  94          HD13      LEU  94  81.909   2.692  -8.066
  761   HD21  LEU  94          HD21      LEU  94  84.320   4.460  -5.778
  762   HD22  LEU  94          HD22      LEU  94  84.324   3.429  -7.207
  763   HD23  LEU  94          HD23      LEU  94  84.408   2.709  -5.601
  764    H    ILE  95           H        ILE  95  79.819   6.136  -4.671
  765    HA   ILE  95           HA       ILE  95  79.649   4.035  -2.736
  766    HB   ILE  95           HB       ILE  95  79.242   7.010  -2.625
  767   HG12  ILE  95          HG12      ILE  95  81.137   5.346  -0.986
  768   HG13  ILE  95          HG13      ILE  95  81.503   5.650  -2.679
  769   HG21  ILE  95          HG21      ILE  95  78.477   4.905  -0.630
  770   HG22  ILE  95          HG22      ILE  95  77.696   6.445  -0.982
  771   HG23  ILE  95          HG23      ILE  95  79.181   6.409  -0.032
  772   HD11  ILE  95          HD11      ILE  95  82.296   7.311  -0.737
  773   HD12  ILE  95          HD12      ILE  95  80.700   7.996  -1.034
  774   HD13  ILE  95          HD13      ILE  95  81.872   7.884  -2.346
  775    H    ALA  96           H        ALA  96  77.425   5.819  -4.710
  776    HA   ALA  96           HA       ALA  96  75.051   5.243  -3.259
  777    HB1  ALA  96           HB1      ALA  96  73.936   5.693  -5.474
  778    HB2  ALA  96           HB2      ALA  96  75.545   5.858  -6.180
  779    HB3  ALA  96           HB3      ALA  96  75.011   6.980  -4.927
  780    H    TYR  97           H        TYR  97  76.953   3.548  -5.673
  781    HA   TYR  97           HA       TYR  97  75.034   1.433  -6.050
  782    HB2  TYR  97           HB2      TYR  97  76.564   1.912  -7.862
  783    HB3  TYR  97           HB3      TYR  97  77.956   1.667  -6.805
  784    HD1  TYR  97           HD1      TYR  97  75.006  -0.048  -8.308
  785    HD2  TYR  97           HD2      TYR  97  78.828  -0.509  -6.406
  786    HE1  TYR  97           HE1      TYR  97  74.958  -2.477  -8.797
  787    HE2  TYR  97           HE2      TYR  97  78.780  -2.938  -6.897
  788    HH   TYR  97           HH       TYR  97  75.928  -4.462  -8.340
  789    H    LEU  98           H        LEU  98  78.064   1.866  -4.240
  790    HA   LEU  98           HA       LEU  98  78.303  -0.729  -3.226
  791    HB2  LEU  98           HB2      LEU  98  79.192   1.966  -2.238
  792    HB3  LEU  98           HB3      LEU  98  79.461   0.532  -1.256
  793    HG   LEU  98           HG       LEU  98  80.279   0.529  -4.156
  794   HD11  LEU  98          HD11      LEU  98  81.260   2.566  -3.050
  795   HD12  LEU  98          HD12      LEU  98  82.452   1.398  -3.603
  796   HD13  LEU  98          HD13      LEU  98  82.039   1.489  -1.891
  797   HD21  LEU  98          HD21      LEU  98  81.448  -0.778  -1.684
  798   HD22  LEU  98          HD22      LEU  98  81.873  -1.127  -3.360
  799   HD23  LEU  98          HD23      LEU  98  80.276  -1.555  -2.746
  800    H    LYS  99           H        LYS  99  76.107   1.826  -2.436
  801    HA   LYS  99           HA       LYS  99  75.375   0.796   0.162
  802    HB2  LYS  99           HB2      LYS  99  74.317   2.958  -1.640
  803    HB3  LYS  99           HB3      LYS  99  73.387   2.428  -0.238
  804    HG2  LYS  99           HG2      LYS  99  75.328   2.891   1.222
  805    HG3  LYS  99           HG3      LYS  99  76.245   3.435  -0.181
  806    HD2  LYS  99           HD2      LYS  99  75.324   5.380   0.963
  807    HD3  LYS  99           HD3      LYS  99  74.516   5.187  -0.591
  808    HE2  LYS  99           HE2      LYS  99  72.524   4.459   0.380
  809    HE3  LYS  99           HE3      LYS  99  73.327   3.886   1.842
  810    HZ1  LYS  99           HZ1      LYS  99  73.865   6.562   1.768
  811    HZ2  LYS  99           HZ2      LYS  99  72.705   5.799   2.747
  812    HZ3  LYS  99           HZ3      LYS  99  72.251   6.466   1.252
  813    H    LYS 100           H        LYS 100  73.734   0.980  -3.001
  814    HA   LYS 100           HA       LYS 100  71.577  -0.716  -2.169
  815    HB2  LYS 100           HB2      LYS 100  72.490   0.298  -4.863
  816    HB3  LYS 100           HB3      LYS 100  71.084  -0.748  -4.663
  817    HG2  LYS 100           HG2      LYS 100  70.154   0.917  -3.028
  818    HG3  LYS 100           HG3      LYS 100  71.500   1.986  -3.421
  819    HD2  LYS 100           HD2      LYS 100  70.771   1.748  -5.870
  820    HD3  LYS 100           HD3      LYS 100  69.281   1.041  -5.242
  821    HE2  LYS 100           HE2      LYS 100  69.020   3.106  -3.801
  822    HE3  LYS 100           HE3      LYS 100  70.368   3.813  -4.690
  823    HZ1  LYS 100           HZ1      LYS 100  67.878   4.124  -5.453
  824    HZ2  LYS 100           HZ2      LYS 100  68.187   2.655  -6.247
  825    HZ3  LYS 100           HZ3      LYS 100  69.148   4.018  -6.571
  826    H    ALA 101           H        ALA 101  74.759  -1.261  -3.283
  827    HA   ALA 101           HA       ALA 101  74.232  -3.929  -4.320
  828    HB1  ALA 101           HB1      ALA 101  76.655  -4.011  -4.694
  829    HB2  ALA 101           HB2      ALA 101  76.849  -2.488  -3.825
  830    HB3  ALA 101           HB3      ALA 101  75.973  -2.525  -5.356
  831    H    THR 102           H        THR 102  75.380  -2.390  -1.397
  832    HA   THR 102           HA       THR 102  76.180  -4.947  -0.214
  833    HB   THR 102           HB       THR 102  76.823  -3.526   1.733
  834    HG1  THR 102           HG1      THR 102  75.265  -1.797   0.433
  835   HG21  THR 102          HG21      THR 102  77.841  -2.920  -1.037
  836   HG22  THR 102          HG22      THR 102  78.576  -3.920   0.214
  837   HG23  THR 102          HG23      THR 102  78.565  -2.165   0.384
  838    H    ASN 103           H        ASN 103  73.378  -3.292  -0.687
  839    HA   ASN 103           HA       ASN 103  72.172  -3.974   1.904
  840    HB2  ASN 103           HB2      ASN 103  71.333  -2.287  -0.441
  841    HB3  ASN 103           HB1      ASN 103  70.160  -2.811   0.760
  842   HD21  ASN 103          HD21      ASN 103  73.495  -2.187   1.697
  843   HD22  ASN 103          HD22      ASN 103  73.171  -0.766   2.565
  844    H    GLU 104           H        GLU 104  72.336  -5.002  -1.396
  845    HA   GLU 104           HA       GLU 104  70.812  -7.392  -0.772
  846    HB2  GLU 104           HB2      GLU 104  69.253  -7.083  -2.692
  847    HB3  GLU 104           HB3      GLU 104  68.993  -5.910  -1.400
  848    HG2  GLU 104           HG2      GLU 104  70.305  -4.238  -2.625
  849    HG3  GLU 104           HG3      GLU 104  70.630  -5.408  -3.903
  850    HHA  HEC 201           HA       HEC 105  89.328  -3.490   3.205
  851    HHB  HEC 201           HB       HEC 105  85.556   0.066  -0.412
  852    HHC  HEC 201           HC       HEC 105  88.810  -1.716  -5.535
  853    HHD  HEC 201           HD       HEC 105  92.184  -5.717  -1.979
  854   HMA1  HEC 201          HMA1      HEC 105  84.644  -0.130   1.579
  855   HMA2  HEC 201          HMA2      HEC 105  85.793   0.886   2.450
  856   HMA3  HEC 201          HMA3      HEC 105  85.053  -0.500   3.251
  857   HAA1  HEC 201          HAA1      HEC 105  86.857  -0.965   4.511
  858   HAA2  HEC 201          HAA2      HEC 105  88.368  -1.851   4.475
  859   HBA1  HEC 201          HBA1      HEC 105  87.291  -3.938   4.511
  860   HBA2  HEC 201          HBA2      HEC 105  85.747  -3.253   4.011
  861   HMB1  HEC 201          HMB1      HEC 105  84.839   1.267  -3.910
  862   HMB2  HEC 201          HMB2      HEC 105  85.073   1.510  -2.182
  863   HMB3  HEC 201          HMB3      HEC 105  84.112   0.152  -2.760
  864    HAB  HEC 201           HAB      HEC 105  87.334  -0.482  -6.182
  865   HBB1  HEC 201          HBB1      HEC 105  87.991   1.735  -5.812
  866   HBB2  HEC 201          HBB2      HEC 105  86.389   1.927  -6.522
  867   HBB3  HEC 201          HBB3      HEC 105  86.608   2.080  -4.780
  868   HMC1  HEC 201          HMC1      HEC 105  91.338  -2.541  -6.646
  869   HMC2  HEC 201          HMC2      HEC 105  89.752  -3.273  -6.880
  870   HMC3  HEC 201          HMC3      HEC 105  91.196  -4.276  -6.910
  871    HAC  HEC 201           HAC      HEC 105  92.639  -6.130  -3.902
  872   HBC1  HEC 201          HBC1      HEC 105  94.361  -5.503  -5.248
  873   HBC2  HEC 201          HBC2      HEC 105  93.587  -3.919  -5.247
  874   HBC3  HEC 201          HBC3      HEC 105  93.286  -5.049  -6.567
  875   HMD1  HEC 201          HMD1      HEC 105  92.313  -7.450   0.472
  876   HMD2  HEC 201          HMD2      HEC 105  93.304  -6.437   1.521
  877   HMD3  HEC 201          HMD3      HEC 105  93.402  -6.251  -0.226
  878   HAD1  HEC 201          HAD1      HEC 105  91.896  -6.256   3.189
  879   HAD2  HEC 201          HAD2      HEC 105  90.385  -5.520   3.682
  880   HBD1  HEC 201          HBD1      HEC 105  91.524  -3.344   3.924
  881   HBD2  HEC 201          HBD2      HEC 105  93.044  -4.095   3.451
  882    H1   HOH 301           H2       HOH 200  79.924   3.542  -0.527
  883    H2   HOH 301           H1       HOH 200  80.561   2.175  -0.642
  884    H1   HOH 302           H2       HOH 201  85.584   4.959   6.613
  885    H2   HOH 302           H1       HOH 201  86.349   5.065   5.314
  886    H1   HOH 303           H2       HOH 202  82.752  -5.334   4.990
  887    H2   HOH 303           H1       HOH 202  82.050  -5.452   6.326
  888    H1   HOH 304           H2       HOH 203  80.654 -11.031  -0.330
  889    H2   HOH 304           H1       HOH 203  80.797  -9.524  -0.292
  Start of MODEL   26
    1    H1   GLY   1           H1       GLY   1  74.146   8.893  -4.529
    2    H2   GLY   1           H2       GLY   1  73.002   8.059  -5.469
    3    H3   GLY   1           H3       GLY   1  72.830   9.728  -5.197
    4    HA2  GLY   1           HA2      GLY   1  74.302  10.301  -6.777
    5    HA3  GLY   1           HA3      GLY   1  75.331   8.913  -6.423
    6    H    ASP   2           H        ASP   2  75.459   8.579  -8.741
    7    HA   ASP   2           HA       ASP   2  73.002   7.658 -10.062
    8    HB2  ASP   2           HB2      ASP   2  75.797   8.187 -11.082
    9    HB3  ASP   2           HB1      ASP   2  74.503   7.517 -12.073
   10    H    VAL   3           H        VAL   3  72.714   5.729  -8.882
   11    HA   VAL   3           HA       VAL   3  74.497   3.704  -8.374
   12    HB   VAL   3           HB       VAL   3  72.136   3.674  -7.669
   13   HG11  VAL   3          HG11      VAL   3  70.363   3.215  -9.216
   14   HG12  VAL   3          HG12      VAL   3  71.501   2.877 -10.519
   15   HG13  VAL   3          HG13      VAL   3  71.311   4.524  -9.921
   16   HG21  VAL   3          HG21      VAL   3  73.479   1.556  -7.796
   17   HG22  VAL   3          HG22      VAL   3  72.810   1.274  -9.403
   18   HG23  VAL   3          HG23      VAL   3  71.748   1.293  -7.996
   19    H    GLU   4           H        GLU   4  73.405   4.850 -11.428
   20    HA   GLU   4           HA       GLU   4  73.892   2.455 -12.931
   21    HB2  GLU   4           HB2      GLU   4  73.745   5.340 -13.838
   22    HB3  GLU   4           HB3      GLU   4  73.718   3.930 -14.897
   23    HG2  GLU   4           HG2      GLU   4  71.657   3.140 -13.851
   24    HG3  GLU   4           HG3      GLU   4  71.700   4.475 -12.701
   25    H    LYS   5           H        LYS   5  75.676   5.555 -12.781
   26    HA   LYS   5           HA       LYS   5  77.976   4.442 -14.087
   27    HB2  LYS   5           HB2      LYS   5  77.440   7.039 -12.645
   28    HB3  LYS   5           HB3      LYS   5  79.046   6.629 -13.248
   29    HG2  LYS   5           HG2      LYS   5  78.241   6.462 -15.511
   30    HG3  LYS   5           HG3      LYS   5  76.564   6.591 -14.983
   31    HD2  LYS   5           HD2      LYS   5  78.451   8.804 -14.252
   32    HD3  LYS   5           HD3      LYS   5  77.869   8.718 -15.914
   33    HE2  LYS   5           HE2      LYS   5  75.614   8.978 -15.269
   34    HE3  LYS   5           HE3      LYS   5  75.950   8.549 -13.593
   35    HZ1  LYS   5           HZ1      LYS   5  76.632  10.615 -13.106
   36    HZ2  LYS   5           HZ2      LYS   5  75.720  11.056 -14.472
   37    HZ3  LYS   5           HZ3      LYS   5  77.401  10.844 -14.601
   38    H    GLY   6           H        GLY   6  76.792   4.470 -10.885
   39    HA2  GLY   6           HA2      GLY   6  79.299   4.233  -9.518
   40    HA3  GLY   6           HA3      GLY   6  77.712   3.818  -8.863
   41    H    LYS   7           H        LYS   7  76.961   2.052 -10.962
   42    HA   LYS   7           HA       LYS   7  78.124  -0.375 -10.025
   43    HB2  LYS   7           HB2      LYS   7  75.775  -0.109 -10.905
   44    HB3  LYS   7           HB3      LYS   7  76.465   0.030 -12.521
   45    HG2  LYS   7           HG2      LYS   7  77.706  -2.244 -11.477
   46    HG3  LYS   7           HG3      LYS   7  76.055  -2.361 -10.878
   47    HD2  LYS   7           HD2      LYS   7  76.026  -3.448 -12.995
   48    HD3  LYS   7           HD3      LYS   7  75.297  -1.868 -13.274
   49    HE2  LYS   7           HE2      LYS   7  77.154  -1.064 -14.432
   50    HE3  LYS   7           HE3      LYS   7  78.263  -2.185 -13.643
   51    HZ1  LYS   7           HZ1      LYS   7  76.178  -3.430 -15.210
   52    HZ2  LYS   7           HZ2      LYS   7  77.836  -3.787 -15.123
   53    HZ3  LYS   7           HZ3      LYS   7  77.289  -2.518 -16.110
   54    H    LYS   8           H        LYS   8  78.446   1.554 -12.998
   55    HA   LYS   8           HA       LYS   8  80.103  -0.217 -14.421
   56    HB2  LYS   8           HB2      LYS   8  79.066   1.676 -15.517
   57    HB3  LYS   8           HB3      LYS   8  79.949   2.803 -14.488
   58    HG2  LYS   8           HG2      LYS   8  81.680   0.873 -15.904
   59    HG3  LYS   8           HG3      LYS   8  80.796   1.956 -16.976
   60    HD2  LYS   8           HD2      LYS   8  82.347   2.963 -14.577
   61    HD3  LYS   8           HD3      LYS   8  83.081   2.786 -16.170
   62    HE2  LYS   8           HE2      LYS   8  80.960   4.182 -16.947
   63    HE3  LYS   8           HE3      LYS   8  80.961   4.704 -15.263
   64    HZ1  LYS   8           HZ1      LYS   8  82.978   5.723 -15.478
   65    HZ2  LYS   8           HZ2      LYS   8  82.349   5.972 -17.038
   66    HZ3  LYS   8           HZ3      LYS   8  83.481   4.735 -16.763
   67    H    ILE   9           H        ILE   9  80.943   2.480 -12.256
   68    HA   ILE   9           HA       ILE   9  83.753   2.162 -12.488
   69    HB   ILE   9           HB       ILE   9  82.102   3.418 -10.288
   70   HG12  ILE   9          HG12      ILE   9  83.588   4.785 -12.540
   71   HG13  ILE   9          HG13      ILE   9  81.900   4.301 -12.697
   72   HG21  ILE   9          HG21      ILE   9  84.260   4.681  -9.887
   73   HG22  ILE   9          HG22      ILE   9  85.052   3.528 -10.961
   74   HG23  ILE   9          HG23      ILE   9  84.318   2.972  -9.458
   75   HD11  ILE   9          HD11      ILE   9  82.957   6.060 -10.466
   76   HD12  ILE   9          HD12      ILE   9  81.269   5.678 -10.800
   77   HD13  ILE   9          HD13      ILE   9  82.186   6.675 -11.928
   78    H    PHE  10           H        PHE  10  81.336   0.511 -10.661
   79    HA   PHE  10           HA       PHE  10  83.158  -0.502  -8.659
   80    HB2  PHE  10           HB2      PHE  10  81.000  -0.364  -7.813
   81    HB3  PHE  10           HB1      PHE  10  80.265  -0.911  -9.320
   82    HD1  PHE  10           HD1      PHE  10  80.225  -3.287  -9.919
   83    HD2  PHE  10           HD2      PHE  10  81.913  -1.955  -6.207
   84    HE1  PHE  10           HE1      PHE  10  80.218  -5.619  -9.086
   85    HE2  PHE  10           HE2      PHE  10  81.909  -4.290  -5.369
   86    HZ   PHE  10           HZ       PHE  10  81.062  -6.123  -6.812
   87    H    VAL  11           H        VAL  11  81.364  -1.985 -11.378
   88    HA   VAL  11           HA       VAL  11  82.373  -4.565 -11.134
   89    HB   VAL  11           HB       VAL  11  81.845  -4.825 -13.542
   90   HG11  VAL  11          HG11      VAL  11  79.731  -3.180 -12.150
   91   HG12  VAL  11          HG12      VAL  11  80.116  -4.830 -11.665
   92   HG13  VAL  11          HG13      VAL  11  79.496  -4.508 -13.285
   93   HG21  VAL  11          HG21      VAL  11  80.950  -2.884 -14.764
   94   HG22  VAL  11          HG22      VAL  11  82.612  -2.579 -14.259
   95   HG23  VAL  11          HG23      VAL  11  81.273  -1.855 -13.372
   96    H    GLN  12           H        GLN  12  83.824  -1.723 -12.570
   97    HA   GLN  12           HA       GLN  12  86.033  -3.329 -13.641
   98    HB2  GLN  12           HB2      GLN  12  86.727  -1.332 -14.775
   99    HB3  GLN  12           HB1      GLN  12  84.988  -1.521 -14.994
  100    HG2  GLN  12           HG2      GLN  12  84.680   0.016 -12.992
  101    HG3  GLN  12           HG1      GLN  12  86.411   0.346 -13.086
  102   HE21  GLN  12          HE21      GLN  12  85.716  -0.196 -16.214
  103   HE22  GLN  12          HE22      GLN  12  85.281   1.364 -16.714
  104    H    LYS  13           H        LYS  13  85.370  -1.191 -10.949
  105    HA   LYS  13           HA       LYS  13  88.253  -0.987 -10.387
  106    HB2  LYS  13           HB2      LYS  13  86.638   1.020 -10.399
  107    HB3  LYS  13           HB3      LYS  13  86.113   0.422  -8.825
  108    HG2  LYS  13           HG2      LYS  13  87.836   1.866  -8.209
  109    HG3  LYS  13           HG3      LYS  13  88.700   0.333  -8.320
  110    HD2  LYS  13           HD2      LYS  13  90.097   1.683  -9.593
  111    HD3  LYS  13           HD3      LYS  13  89.021   1.084 -10.855
  112    HE2  LYS  13           HE2      LYS  13  89.113   3.436 -11.189
  113    HE3  LYS  13           HE3      LYS  13  87.572   3.150 -10.379
  114    HZ1  LYS  13           HZ1      LYS  13  90.096   4.131  -9.176
  115    HZ2  LYS  13           HZ2      LYS  13  88.777   3.597  -8.249
  116    HZ3  LYS  13           HZ3      LYS  13  88.609   4.941  -9.273
  117    H    CYS  14           H        CYS  14  85.353  -1.480  -8.302
  118    HA   CYS  14           HA       CYS  14  87.046  -2.722  -6.312
  119    HB2  CYS  14           HB2      CYS  14  84.068  -2.657  -6.110
  120    HB3  CYS  14           HB1      CYS  14  85.271  -2.514  -4.834
  121    H    ALA  15           H        ALA  15  84.538  -3.921  -8.521
  122    HA   ALA  15           HA       ALA  15  84.048  -6.394  -7.441
  123    HB1  ALA  15           HB1      ALA  15  82.837  -5.919  -9.377
  124    HB2  ALA  15           HB2      ALA  15  83.953  -7.170  -9.924
  125    HB3  ALA  15           HB3      ALA  15  84.281  -5.476 -10.287
  126    H    GLN  16           H        GLN  16  86.989  -5.272  -8.927
  127    HA   GLN  16           HA       GLN  16  88.268  -7.578  -9.691
  128    HB2  GLN  16           HB2      GLN  16  89.308  -5.101  -8.338
  129    HB3  GLN  16           HB1      GLN  16  90.387  -6.407  -8.826
  130    HG2  GLN  16           HG2      GLN  16  89.650  -6.213 -11.137
  131    HG3  GLN  16           HG1      GLN  16  88.446  -5.008 -10.687
  132   HE21  GLN  16          HE21      GLN  16  89.562  -3.059  -9.366
  133   HE22  GLN  16          HE22      GLN  16  90.992  -2.470 -10.064
  134    H    CYS  17           H        CYS  17  88.488  -6.178  -6.391
  135    HA   CYS  17           HA       CYS  17  88.936  -8.929  -5.383
  136    HB2  CYS  17           HB2      CYS  17  90.128  -6.723  -3.820
  137    HB3  CYS  17           HB1      CYS  17  90.782  -8.306  -4.210
  138    H    HIS  18           H        HSD  18  86.364  -8.092  -5.432
  139    HA   HIS  18           HA       HSD  18  85.744  -7.948  -2.602
  140    HB2  HIS  18           HB2      HSD  18  85.187  -5.653  -4.454
  141    HB3  HIS  18           HB1      HSD  18  84.086  -5.994  -3.122
  142    HD1  HIS  18           HD1      HSD  18  85.018  -5.734  -0.695
  143    HD2  HIS  18           HD2      HSD  18  87.713  -4.645  -3.676
  144    HE1  HIS  18           HE1      HSD  18  86.886  -4.468   0.458
  145    H    THR  19           H        THR  19  83.155  -7.600  -2.495
  146    HA   THR  19           HA       THR  19  81.874  -9.221  -4.596
  147    HB   THR  19           HB       THR  19  80.805 -10.067  -2.097
  148    HG1  THR  19           HG1      THR  19  83.297 -10.969  -1.871
  149   HG21  THR  19          HG21      THR  19  80.899 -11.401  -4.160
  150   HG22  THR  19          HG22      THR  19  81.678 -12.259  -2.831
  151   HG23  THR  19          HG23      THR  19  82.659 -11.452  -4.055
  152    H    VAL  20           H        VAL  20  81.536  -7.182  -1.736
  153    HA   VAL  20           HA       VAL  20  79.777  -5.917  -0.954
  154    HB   VAL  20           HB       VAL  20  79.156  -4.170  -2.471
  155   HG11  VAL  20          HG11      VAL  20  81.534  -4.303  -1.697
  156   HG12  VAL  20          HG12      VAL  20  81.353  -3.471  -3.240
  157   HG13  VAL  20          HG13      VAL  20  81.936  -5.134  -3.197
  158   HG21  VAL  20          HG21      VAL  20  80.304  -5.841  -4.715
  159   HG22  VAL  20          HG22      VAL  20  79.439  -4.314  -4.849
  160   HG23  VAL  20          HG23      VAL  20  78.579  -5.770  -4.366
  161    H    GLU  21           H        GLU  21  79.020  -8.656  -1.940
  162    HA   GLU  21           HA       GLU  21  76.159  -8.078  -2.447
  163    HB2  GLU  21           HB2      GLU  21  75.978  -9.996  -3.816
  164    HB3  GLU  21           HB3      GLU  21  77.464  -9.207  -4.340
  165    HG2  GLU  21           HG2      GLU  21  78.623 -10.756  -2.591
  166    HG3  GLU  21           HG3      GLU  21  77.133 -11.695  -2.683
  167    H    LYS  22           H        LYS  22  74.985  -8.481  -0.713
  168    HA   LYS  22           HA       LYS  22  75.771  -9.683   1.629
  169    HB2  LYS  22           HB2      LYS  22  73.696  -8.374   1.363
  170    HB3  LYS  22           HB3      LYS  22  72.979  -9.705   0.459
  171    HG2  LYS  22           HG2      LYS  22  74.136 -10.449   3.092
  172    HG3  LYS  22           HG3      LYS  22  72.728  -9.394   3.167
  173    HD2  LYS  22           HD2      LYS  22  72.611 -11.769   1.338
  174    HD3  LYS  22           HD3      LYS  22  72.456 -12.042   3.072
  175    HE2  LYS  22           HE2      LYS  22  70.253 -11.683   1.934
  176    HE3  LYS  22           HE3      LYS  22  70.579 -10.504   3.203
  177    HZ1  LYS  22           HZ1      LYS  22  71.343  -8.953   1.520
  178    HZ2  LYS  22           HZ2      LYS  22  69.748  -9.442   1.201
  179    HZ3  LYS  22           HZ3      LYS  22  71.034 -10.087   0.298
  180    H    GLY  23           H        GLY  23  75.635 -11.723   2.530
  181    HA2  GLY  23           HA2      GLY  23  75.772 -14.018   2.572
  182    HA3  GLY  23           HA3      GLY  23  74.429 -13.990   1.432
  183    H    GLY  24           H        GLY  24  77.425 -12.423   0.618
  184    HA2  GLY  24           HA2      GLY  24  77.790 -14.279  -1.609
  185    HA3  GLY  24           HA3      GLY  24  78.625 -12.748  -1.373
  186    H    LYS  25           H        LYS  25  80.703 -13.409  -1.561
  187    HA   LYS  25           HA       LYS  25  81.804 -14.928   0.669
  188    HB2  LYS  25           HB2      LYS  25  83.169 -16.293  -1.075
  189    HB3  LYS  25           HB3      LYS  25  81.516 -16.794  -0.718
  190    HG2  LYS  25           HG2      LYS  25  80.684 -15.661  -2.696
  191    HG3  LYS  25           HG3      LYS  25  82.274 -14.969  -3.017
  192    HD2  LYS  25           HD2      LYS  25  83.211 -17.122  -3.505
  193    HD3  LYS  25           HD3      LYS  25  81.779 -17.951  -2.896
  194    HE2  LYS  25           HE2      LYS  25  81.632 -16.018  -5.212
  195    HE3  LYS  25           HE3      LYS  25  81.982 -17.729  -5.449
  196    HZ1  LYS  25           HZ1      LYS  25  79.689 -16.997  -3.782
  197    HZ2  LYS  25           HZ2      LYS  25  79.908 -18.347  -4.790
  198    HZ3  LYS  25           HZ3      LYS  25  79.537 -16.833  -5.464
  199    H    HIS  26           H        HIS  26  83.372 -13.639   1.384
  200    HA   HIS  26           HA       HIS  26  84.509 -11.501   0.012
  201    HB2  HIS  26           HB2      HIS  26  86.473 -11.988   1.747
  202    HB3  HIS  26           HB1      HIS  26  84.916 -11.349   2.272
  203    HD1  HIS  26           HD1      HIS  26  83.184 -13.136   3.248
  204    HD2  HIS  26           HD2      HIS  26  87.075 -14.538   2.725
  205    HE1  HIS  26           HE1      HIS  26  83.358 -15.282   4.581
  206    HE2  HIS  26           HE2      HIS  26  85.724 -16.149   4.273
  207    H    LYS  27           H        LYS  27  85.799 -11.434  -1.685
  208    HA   LYS  27           HA       LYS  27  87.586 -13.735  -2.230
  209    HB2  LYS  27           HB2      LYS  27  85.720 -13.297  -3.883
  210    HB3  LYS  27           HB3      LYS  27  86.511 -11.765  -4.253
  211    HG2  LYS  27           HG2      LYS  27  88.625 -13.092  -4.726
  212    HG3  LYS  27           HG3      LYS  27  87.643 -14.552  -4.614
  213    HD2  LYS  27           HD2      LYS  27  86.774 -12.316  -6.434
  214    HD3  LYS  27           HD3      LYS  27  88.030 -13.434  -6.962
  215    HE2  LYS  27           HE2      LYS  27  85.388 -14.407  -5.863
  216    HE3  LYS  27           HE3      LYS  27  85.621 -14.061  -7.575
  217    HZ1  LYS  27           HZ1      LYS  27  86.123 -16.424  -6.493
  218    HZ2  LYS  27           HZ2      LYS  27  87.651 -15.707  -6.303
  219    HZ3  LYS  27           HZ3      LYS  27  86.955 -15.836  -7.848
  220    H    THR  28           H        THR  28  89.705 -13.340  -2.178
  221    HA   THR  28           HA       THR  28  91.637 -12.128  -1.742
  222    HB   THR  28           HB       THR  28  90.643 -10.596  -4.153
  223    HG1  THR  28           HG1      THR  28  91.897 -13.122  -3.918
  224   HG21  THR  28          HG21      THR  28  92.645  -9.574  -3.524
  225   HG22  THR  28          HG22      THR  28  93.227 -10.836  -4.605
  226   HG23  THR  28          HG23      THR  28  93.315 -11.064  -2.861
  227    H    GLY  29           H        GLY  29  89.173 -11.120  -0.434
  228    HA2  GLY  29           HA2      GLY  29  90.131  -8.916   0.904
  229    HA3  GLY  29           HA3      GLY  29  89.234  -8.256  -0.461
  230    HA   PRO  30           HA       PRO  30  86.429  -9.723   3.151
  231    HB2  PRO  30           HB2      PRO  30  86.018  -7.326   4.427
  232    HB3  PRO  30           HB1      PRO  30  87.285  -8.478   4.890
  233    HG2  PRO  30           HG2      PRO  30  87.492  -5.996   3.255
  234    HG3  PRO  30           HG1      PRO  30  88.597  -6.632   4.486
  235    HD2  PRO  30           HD2      PRO  30  89.070  -6.896   1.809
  236    HD3  PRO  30           HD1      PRO  30  89.624  -8.090   3.004
  237    H    ASN  31           H        ASN  31  84.158  -9.029   3.474
  238    HA   ASN  31           HA       ASN  31  83.041  -7.972   0.994
  239    HB2  ASN  31           HB2      ASN  31  80.955  -8.819   1.773
  240    HB3  ASN  31           HB1      ASN  31  82.159 -10.024   2.229
  241   HD21  ASN  31          HD21      ASN  31  83.063  -7.919   4.390
  242   HD22  ASN  31          HD22      ASN  31  81.951  -8.179   5.646
  243    H    LEU  32           H        LEU  32  81.296  -6.329   1.104
  244    HA   LEU  32           HA       LEU  32  81.831  -4.335   3.230
  245    HB2  LEU  32           HB2      LEU  32  80.809  -3.732   0.449
  246    HB3  LEU  32           HB3      LEU  32  81.357  -2.582   1.663
  247    HG   LEU  32           HG       LEU  32  83.026  -4.557   0.086
  248   HD11  LEU  32          HD11      LEU  32  84.313  -2.349  -0.300
  249   HD12  LEU  32          HD12      LEU  32  82.886  -1.548   0.353
  250   HD13  LEU  32          HD13      LEU  32  82.758  -2.523  -1.109
  251   HD21  LEU  32          HD21      LEU  32  83.602  -3.170   2.684
  252   HD22  LEU  32          HD22      LEU  32  84.904  -3.348   1.516
  253   HD23  LEU  32          HD23      LEU  32  84.088  -4.772   2.146
  254    H    HIS  33           H        HIS  33  79.911  -6.485   3.417
  255    HA   HIS  33           HA       HIS  33  77.280  -5.641   2.803
  256    HB2  HIS  33           HB2      HIS  33  78.227  -7.457   5.036
  257    HB3  HIS  33           HB1      HIS  33  76.568  -7.323   4.453
  258    HD1  HIS  33           HD1      HIS  33  78.068 -10.019   4.262
  259    HD2  HIS  33           HD2      HIS  33  77.951  -7.214   1.181
  260    HE1  HIS  33           HE1      HIS  33  78.529 -11.289   2.121
  261    HE2  HIS  33           HE2      HIS  33  78.458  -9.594   0.232
  262    H    GLY  34           H        GLY  34  75.776  -4.465   3.958
  263    HA2  GLY  34           HA2      GLY  34  75.233  -2.595   5.258
  264    HA3  GLY  34           HA3      GLY  34  75.548  -3.761   6.540
  265    H    LEU  35           H        LEU  35  78.024  -2.668   4.365
  266    HA   LEU  35           HA       LEU  35  79.987  -2.111   6.165
  267    HB2  LEU  35           HB2      LEU  35  80.401  -2.141   3.785
  268    HB3  LEU  35           HB3      LEU  35  79.368  -0.737   3.545
  269    HG   LEU  35           HG       LEU  35  81.087   0.349   5.301
  270   HD11  LEU  35          HD11      LEU  35  83.261  -0.522   5.217
  271   HD12  LEU  35          HD12      LEU  35  82.926  -1.462   3.769
  272   HD13  LEU  35          HD13      LEU  35  82.271  -1.978   5.321
  273   HD21  LEU  35          HD21      LEU  35  80.562   1.034   2.912
  274   HD22  LEU  35          HD22      LEU  35  81.869  -0.035   2.404
  275   HD23  LEU  35          HD23      LEU  35  82.215   1.353   3.437
  276    H    PHE  36           H        PHE  36  77.843   0.361   4.760
  277    HA   PHE  36           HA       PHE  36  78.700   2.524   6.271
  278    HB2  PHE  36           HB2      PHE  36  75.836   2.093   5.414
  279    HB3  PHE  36           HB1      PHE  36  76.681   3.625   5.629
  280    HD1  PHE  36           HD2      PHE  36  76.552   0.531   3.556
  281    HD2  PHE  36           HD1      PHE  36  78.036   4.552   3.886
  282    HE1  PHE  36           HE2      PHE  36  77.327   0.442   1.205
  283    HE2  PHE  36           HE1      PHE  36  78.797   4.463   1.539
  284    HZ   PHE  36           HZ       PHE  36  78.447   2.410   0.193
  285    H    GLY  37           H        GLY  37  79.068   1.973   8.448
  286    HA2  GLY  37           HA2      GLY  37  77.577   2.685  10.445
  287    HA3  GLY  37           HA3      GLY  37  76.699   1.222  10.036
  288    H    ARG  38           H        ARG  38  79.320  -0.137   9.307
  289    HA   ARG  38           HA       ARG  38  79.885  -1.045  12.021
  290    HB2  ARG  38           HB2      ARG  38  80.263  -2.106   9.294
  291    HB3  ARG  38           HB3      ARG  38  81.532  -2.530  10.442
  292    HG2  ARG  38           HG2      ARG  38  79.696  -3.264  12.037
  293    HG3  ARG  38           HG3      ARG  38  78.563  -3.072  10.698
  294    HD2  ARG  38           HD2      ARG  38  81.017  -4.678  10.160
  295    HD3  ARG  38           HD3      ARG  38  79.809  -5.405  11.213
  296    HE   ARG  38           HE       ARG  38  78.285  -4.599   9.158
  297   HH11  ARG  38          HH21      ARG  38  81.346  -6.230   9.268
  298   HH12  ARG  38          HH22      ARG  38  81.084  -7.100   7.795
  299   HH21  ARG  38          HH11      ARG  38  77.939  -5.757   7.241
  300   HH22  ARG  38          HH12      ARG  38  79.157  -6.840   6.655
  301    H    LYS  39           H        LYS  39  81.997  -1.281  12.880
  302    HA   LYS  39           HA       LYS  39  83.662   1.030  12.454
  303    HB2  LYS  39           HB2      LYS  39  83.139  -0.019  14.691
  304    HB3  LYS  39           HB3      LYS  39  84.190  -1.352  14.232
  305    HG2  LYS  39           HG2      LYS  39  85.653   0.029  15.421
  306    HG3  LYS  39           HG3      LYS  39  85.952   0.530  13.764
  307    HD2  LYS  39           HD2      LYS  39  85.707   2.524  15.108
  308    HD3  LYS  39           HD3      LYS  39  84.275   2.385  14.093
  309    HE2  LYS  39           HE2      LYS  39  82.891   1.921  15.877
  310    HE3  LYS  39           HE3      LYS  39  84.154   1.084  16.778
  311    HZ1  LYS  39           HZ1      LYS  39  84.410   2.936  17.938
  312    HZ2  LYS  39           HZ2      LYS  39  83.346   3.796  16.930
  313    HZ3  LYS  39           HZ3      LYS  39  84.996   3.697  16.540
  314    H    THR  40           H        THR  40  85.919   0.994  11.960
  315    HA   THR  40           HA       THR  40  86.661  -0.413   9.700
  316    HB   THR  40           HB       THR  40  89.040   0.208  10.409
  317    HG1  THR  40           HG1      THR  40  87.570   1.504  12.457
  318   HG21  THR  40          HG21      THR  40  86.878   2.329  10.334
  319   HG22  THR  40          HG22      THR  40  87.689   1.623   8.937
  320   HG23  THR  40          HG23      THR  40  88.596   2.623  10.071
  321    H    GLY  41           H        GLY  41  87.790  -2.237   9.246
  322    HA2  GLY  41           HA2      GLY  41  88.354  -4.451   9.534
  323    HA3  GLY  41           HA3      GLY  41  89.383  -3.805  10.808
  324    H    GLN  42           H        GLN  42  85.854  -4.199  10.483
  325    HA   GLN  42           HA       GLN  42  85.879  -5.626  13.082
  326    HB2  GLN  42           HB2      GLN  42  84.687  -3.357  12.891
  327    HB3  GLN  42           HB1      GLN  42  83.491  -4.203  11.911
  328    HG2  GLN  42           HG2      GLN  42  84.310  -5.232  14.631
  329    HG3  GLN  42           HG1      GLN  42  83.043  -4.023  14.451
  330   HE21  GLN  42          HE21      GLN  42  81.656  -4.872  12.205
  331   HE22  GLN  42          HE22      GLN  42  81.028  -6.429  12.457
  332    H    ALA  43           H        ALA  43  85.078  -5.824   9.737
  333    HA   ALA  43           HA       ALA  43  83.050  -7.787   9.853
  334    HB1  ALA  43           HB1      ALA  43  83.066  -7.295   7.664
  335    HB2  ALA  43           HB2      ALA  43  84.569  -8.201   7.497
  336    HB3  ALA  43           HB3      ALA  43  84.615  -6.471   7.834
  337    HA   PRO  44           HA       PRO  44  85.786 -11.119  11.140
  338    HB2  PRO  44           HB2      PRO  44  83.911 -13.048  11.452
  339    HB3  PRO  44           HB1      PRO  44  84.067 -11.696  12.593
  340    HG2  PRO  44           HG2      PRO  44  82.113 -12.081  10.375
  341    HG3  PRO  44           HG1      PRO  44  81.857 -11.431  12.003
  342    HD2  PRO  44           HD2      PRO  44  82.153  -9.858   9.749
  343    HD3  PRO  44           HD1      PRO  44  82.517  -9.308  11.400
  344    H    GLY  45           H        GLY  45  87.058 -12.185   9.723
  345    HA2  GLY  45           HA2      GLY  45  86.542 -14.325   8.185
  346    HA3  GLY  45           HA3      GLY  45  86.023 -13.012   7.131
  347    H    PHE  46           H        PHE  46  87.585 -11.442   6.455
  348    HA   PHE  46           HA       PHE  46  90.129 -12.584   5.839
  349    HB2  PHE  46           HB2      PHE  46  89.002 -11.031   4.313
  350    HB3  PHE  46           HB1      PHE  46  89.131  -9.746   5.514
  351    HD1  PHE  46           HD2      PHE  46  90.990 -11.873   3.145
  352    HD2  PHE  46           HD1      PHE  46  91.268  -8.695   6.021
  353    HE1  PHE  46           HE2      PHE  46  93.272 -11.338   2.334
  354    HE2  PHE  46           HE1      PHE  46  93.550  -8.161   5.211
  355    HZ   PHE  46           HZ       PHE  46  94.552  -9.483   3.368
  356    H    THR  47           H        THR  47  92.206 -11.760   6.419
  357    HA   THR  47           HA       THR  47  92.403 -11.083   9.217
  358    HB   THR  47           HB       THR  47  94.608 -11.257   7.155
  359    HG1  THR  47           HG1      THR  47  93.154 -13.148   7.520
  360   HG21  THR  47          HG21      THR  47  94.581 -11.479  10.177
  361   HG22  THR  47          HG22      THR  47  95.256 -10.147   9.239
  362   HG23  THR  47          HG23      THR  47  95.994 -11.745   9.155
  363    H    TYR  48           H        TYR  48  91.372  -9.014   9.230
  364    HA   TYR  48           HA       TYR  48  92.121  -6.802   7.685
  365    HB2  TYR  48           HB2      TYR  48  90.769  -7.200  10.309
  366    HB3  TYR  48           HB3      TYR  48  91.355  -5.581   9.947
  367    HD1  TYR  48           HD2      TYR  48  90.780  -4.633   7.596
  368    HD2  TYR  48           HD1      TYR  48  88.693  -7.894   9.452
  369    HE1  TYR  48           HE2      TYR  48  88.836  -4.226   6.119
  370    HE2  TYR  48           HE1      TYR  48  86.743  -7.486   7.974
  371    HH   TYR  48           HH       TYR  48  86.277  -4.700   6.285
  372    H    THR  49           H        THR  49  93.455  -5.009   8.155
  373    HA   THR  49           HA       THR  49  95.968  -5.737   9.382
  374    HB   THR  49           HB       THR  49  96.697  -3.501   8.653
  375    HG1  THR  49           HG1      THR  49  94.115  -3.156   7.580
  376   HG21  THR  49          HG21      THR  49  96.069  -3.804   6.177
  377   HG22  THR  49          HG22      THR  49  95.138  -5.204   6.708
  378   HG23  THR  49          HG23      THR  49  96.882  -5.157   6.965
  379    H    ASP  50           H        ASP  50  97.017  -4.416  11.037
  380    HA   ASP  50           HA       ASP  50  95.479  -4.128  13.359
  381    HB2  ASP  50           HB2      ASP  50  98.029  -2.606  12.855
  382    HB3  ASP  50           HB1      ASP  50  97.419  -3.244  14.381
  383    H    ALA  51           H        ALA  51  96.538  -1.708  10.994
  384    HA   ALA  51           HA       ALA  51  95.617   0.585  12.318
  385    HB1  ALA  51           HB1      ALA  51  95.545   1.607  10.055
  386    HB2  ALA  51           HB2      ALA  51  95.795   0.008   9.354
  387    HB3  ALA  51           HB3      ALA  51  97.047   0.734  10.361
  388    H    ASN  52           H        ASN  52  93.946  -1.728  10.248
  389    HA   ASN  52           HA       ASN  52  91.471  -0.218  10.260
  390    HB2  ASN  52           HB2      ASN  52  92.565  -2.535   8.875
  391    HB3  ASN  52           HB1      ASN  52  90.924  -2.843   9.433
  392   HD21  ASN  52          HD21      ASN  52  90.142  -2.762   7.189
  393   HD22  ASN  52          HD22      ASN  52  89.986  -1.276   6.382
  394    H    LYS  53           H        LYS  53  92.967  -2.741  12.104
  395    HA   LYS  53           HA       LYS  53  90.512  -3.512  13.457
  396    HB2  LYS  53           HB2      LYS  53  91.788  -5.400  13.452
  397    HB3  LYS  53           HB3      LYS  53  93.287  -4.498  13.269
  398    HG2  LYS  53           HG2      LYS  53  93.291  -3.957  15.660
  399    HG3  LYS  53           HG3      LYS  53  91.739  -4.773  15.863
  400    HD2  LYS  53           HD2      LYS  53  92.922  -6.851  14.885
  401    HD3  LYS  53           HD3      LYS  53  94.424  -5.984  15.209
  402    HE2  LYS  53           HE2      LYS  53  93.751  -5.737  17.583
  403    HE3  LYS  53           HE3      LYS  53  92.284  -6.655  17.251
  404    HZ1  LYS  53           HZ1      LYS  53  93.595  -8.357  17.887
  405    HZ2  LYS  53           HZ2      LYS  53  95.038  -7.566  17.468
  406    HZ3  LYS  53           HZ3      LYS  53  94.094  -8.309  16.267
  407    H    ASN  54           H        ASN  54  92.800  -1.073  13.651
  408    HA   ASN  54           HA       ASN  54  93.034  -0.700  16.449
  409    HB2  ASN  54           HB2      ASN  54  94.076   1.291  15.919
  410    HB3  ASN  54           HB1      ASN  54  94.308   0.394  14.422
  411   HD21  ASN  54          HD21      ASN  54  91.583   0.673  13.428
  412   HD22  ASN  54          HD22      ASN  54  91.352   2.308  13.038
  413    H    LYS  55           H        LYS  55  90.496  -0.197  14.230
  414    HA   LYS  55           HA       LYS  55  88.375   0.690  14.432
  415    HB2  LYS  55           HB2      LYS  55  89.009   0.233  17.354
  416    HB3  LYS  55           HB3      LYS  55  87.419   0.696  16.754
  417    HG2  LYS  55           HG2      LYS  55  87.540  -1.335  15.220
  418    HG3  LYS  55           HG3      LYS  55  88.956  -1.837  16.145
  419    HD2  LYS  55           HD2      LYS  55  86.213  -1.285  17.319
  420    HD3  LYS  55           HD3      LYS  55  86.879  -2.888  17.007
  421    HE2  LYS  55           HE2      LYS  55  87.403  -2.577  19.267
  422    HE3  LYS  55           HE3      LYS  55  88.887  -2.050  18.474
  423    HZ1  LYS  55           HZ1      LYS  55  87.272  -0.579  20.176
  424    HZ2  LYS  55           HZ2      LYS  55  87.057   0.096  18.631
  425    HZ3  LYS  55           HZ3      LYS  55  88.615  -0.029  19.299
  426    H    GLY  56           H        GLY  56  89.768   2.660  13.689
  427    HA2  GLY  56           HA2      GLY  56  89.922   4.785  15.688
  428    HA3  GLY  56           HA3      GLY  56  90.496   4.871  14.028
  429    H    ILE  57           H        ILE  57  88.063   3.966  12.787
  430    HA   ILE  57           HA       ILE  57  86.056   5.956  13.577
  431    HB   ILE  57           HB       ILE  57  85.915   6.896  11.336
  432   HG12  ILE  57          HG12      ILE  57  88.106   6.234   9.902
  433   HG13  ILE  57          HG13      ILE  57  87.889   4.716  10.767
  434   HG21  ILE  57          HG21      ILE  57  88.819   6.932  12.180
  435   HG22  ILE  57          HG22      ILE  57  87.558   7.769  13.086
  436   HG23  ILE  57          HG23      ILE  57  87.894   8.227  11.417
  437   HD11  ILE  57          HD11      ILE  57  85.769   4.332   9.810
  438   HD12  ILE  57          HD12      ILE  57  86.692   5.017   8.477
  439   HD13  ILE  57          HD13      ILE  57  85.556   6.026   9.369
  440    H    THR  58           H        THR  58  84.202   5.791  11.774
  441    HA   THR  58           HA       THR  58  83.672   2.907  11.365
  442    HB   THR  58           HB       THR  58  81.891   5.106  12.389
  443    HG1  THR  58           HG1      THR  58  81.952   3.901  14.097
  444   HG21  THR  58          HG21      THR  58  80.089   3.200  12.116
  445   HG22  THR  58          HG22      THR  58  81.139   2.672  10.802
  446   HG23  THR  58          HG23      THR  58  80.433   4.285  10.770
  447    H    TRP  59           H        TRP  59  82.820   2.278   9.434
  448    HA   TRP  59           HA       TRP  59  83.209   3.927   7.170
  449    HB2  TRP  59           HB2      TRP  59  81.372   1.538   7.213
  450    HB3  TRP  59           HB1      TRP  59  82.370   2.136   5.887
  451    HD1  TRP  59           HD1      TRP  59  85.116   2.457   7.325
  452    HE1  TRP  59           HE1      TRP  59  86.435   0.378   8.097
  453    HE3  TRP  59           HE3      TRP  59  81.342  -0.970   7.564
  454    HZ2  TRP  59           HZ2      TRP  59  85.945  -2.359   8.767
  455    HZ3  TRP  59           HZ3      TRP  59  81.797  -3.302   8.261
  456    HH2  TRP  59           HH2      TRP  59  84.093  -3.998   8.863
  457    H    LYS  60           H        LYS  60  81.873   5.231   6.055
  458    HA   LYS  60           HA       LYS  60  79.000   5.217   6.537
  459    HB2  LYS  60           HB2      LYS  60  80.742   7.607   7.193
  460    HB3  LYS  60           HB3      LYS  60  78.987   7.669   7.045
  461    HG2  LYS  60           HG2      LYS  60  78.948   5.765   8.783
  462    HG3  LYS  60           HG3      LYS  60  80.634   6.178   9.088
  463    HD2  LYS  60           HD2      LYS  60  78.428   8.246   9.166
  464    HD3  LYS  60           HD3      LYS  60  78.904   7.322  10.590
  465    HE2  LYS  60           HE2      LYS  60  81.265   8.108  10.229
  466    HE3  LYS  60           HE3      LYS  60  80.667   9.156   8.943
  467    HZ1  LYS  60           HZ1      LYS  60  79.562  10.490  10.410
  468    HZ2  LYS  60           HZ2      LYS  60  80.880  10.027  11.376
  469    HZ3  LYS  60           HZ3      LYS  60  79.373   9.269  11.572
  470    H    GLU  61           H        GLU  61  78.401   7.644   5.292
  471    HA   GLU  61           HA       GLU  61  78.899   6.932   2.550
  472    HB2  GLU  61           HB2      GLU  61  76.757   7.954   3.483
  473    HB3  GLU  61           HB3      GLU  61  77.627   9.487   3.531
  474    HG2  GLU  61           HG2      GLU  61  78.063   9.360   1.133
  475    HG3  GLU  61           HG3      GLU  61  77.305   7.771   1.053
  476    H    GLU  62           H        GLU  62  79.563   9.925   4.409
  477    HA   GLU  62           HA       GLU  62  81.287  10.971   2.386
  478    HB2  GLU  62           HB2      GLU  62  81.644  12.802   3.840
  479    HB3  GLU  62           HB3      GLU  62  79.988  12.289   4.153
  480    HG2  GLU  62           HG2      GLU  62  80.815  12.491   6.321
  481    HG3  GLU  62           HG3      GLU  62  81.099  10.782   6.002
  482    H    THR  63           H        THR  63  81.815   9.117   5.343
  483    HA   THR  63           HA       THR  63  84.607   9.433   5.536
  484    HB   THR  63           HB       THR  63  84.571   7.317   6.796
  485    HG1  THR  63           HG1      THR  63  83.070   6.232   5.477
  486   HG21  THR  63          HG21      THR  63  82.337   9.279   7.293
  487   HG22  THR  63          HG22      THR  63  83.922   9.218   8.063
  488   HG23  THR  63          HG23      THR  63  82.720   7.978   8.419
  489    H    LEU  64           H        LEU  64  82.578   7.282   3.643
  490    HA   LEU  64           HA       LEU  64  84.667   5.643   2.641
  491    HB2  LEU  64           HB2      LEU  64  81.809   5.958   2.226
  492    HB3  LEU  64           HB3      LEU  64  82.644   5.657   0.711
  493    HG   LEU  64           HG       LEU  64  83.043   3.971   3.196
  494   HD11  LEU  64          HD11      LEU  64  80.928   3.261   2.731
  495   HD12  LEU  64          HD12      LEU  64  81.701   2.388   1.407
  496   HD13  LEU  64          HD13      LEU  64  80.945   3.951   1.111
  497   HD21  LEU  64          HD21      LEU  64  83.992   3.867   0.337
  498   HD22  LEU  64          HD22      LEU  64  83.780   2.365   1.233
  499   HD23  LEU  64          HD23      LEU  64  84.904   3.587   1.821
  500    H    MET  65           H        MET  65  83.199   8.670   1.556
  501    HA   MET  65           HA       MET  65  84.285   8.795  -1.022
  502    HB2  MET  65           HB2      MET  65  83.759  11.063   0.912
  503    HB3  MET  65           HB1      MET  65  84.032  11.247  -0.820
  504    HG2  MET  65           HG2      MET  65  82.049   9.965  -1.334
  505    HG3  MET  65           HG1      MET  65  81.824   9.552   0.364
  506    HE1  MET  65           HE1      MET  65  81.809  12.134  -2.371
  507    HE2  MET  65           HE2      MET  65  80.451  13.158  -1.909
  508    HE3  MET  65           HE3      MET  65  80.191  11.440  -2.200
  509    H    GLU  66           H        GLU  66  85.599  10.296   1.944
  510    HA   GLU  66           HA       GLU  66  88.020  11.139   0.778
  511    HB2  GLU  66           HB2      GLU  66  87.396  10.428   3.654
  512    HB3  GLU  66           HB3      GLU  66  88.841  11.284   3.118
  513    HG2  GLU  66           HG2      GLU  66  86.021  12.244   2.575
  514    HG3  GLU  66           HG3      GLU  66  86.999  12.799   3.932
  515    H    TYR  67           H        TYR  67  86.962   8.089   2.069
  516    HA   TYR  67           HA       TYR  67  89.590   6.904   2.203
  517    HB2  TYR  67           HB2      TYR  67  87.959   6.024   3.699
  518    HB3  TYR  67           HB3      TYR  67  86.784   5.823   2.408
  519    HD1  TYR  67           HD2      TYR  67  87.053   4.036   0.715
  520    HD2  TYR  67           HD1      TYR  67  89.719   4.405   4.063
  521    HE1  TYR  67           HE2      TYR  67  87.866   1.725   0.323
  522    HE2  TYR  67           HE1      TYR  67  90.530   2.094   3.672
  523    HH   TYR  67           HH       TYR  67  89.812   0.356   0.807
  524    H    LEU  68           H        LEU  68  87.060   7.244  -0.160
  525    HA   LEU  68           HA       LEU  68  88.047   5.180  -1.918
  526    HB2  LEU  68           HB2      LEU  68  85.902   7.276  -2.061
  527    HB3  LEU  68           HB3      LEU  68  86.432   6.489  -3.540
  528    HG   LEU  68           HG       LEU  68  85.417   5.061  -1.065
  529   HD11  LEU  68          HD11      LEU  68  83.408   4.667  -2.254
  530   HD12  LEU  68          HD12      LEU  68  84.107   5.206  -3.782
  531   HD13  LEU  68          HD13      LEU  68  83.751   6.378  -2.515
  532   HD21  LEU  68          HD21      LEU  68  86.760   4.162  -3.540
  533   HD22  LEU  68          HD22      LEU  68  85.284   3.291  -3.144
  534   HD23  LEU  68          HD23      LEU  68  86.605   3.356  -1.980
  535    H    GLU  69           H        GLU  69  88.706   8.521  -1.352
  536    HA   GLU  69           HA       GLU  69  89.974   8.915  -3.947
  537    HB2  GLU  69           HB2      GLU  69  88.931  10.884  -3.315
  538    HB3  GLU  69           HB3      GLU  69  89.255  10.630  -1.602
  539    HG2  GLU  69           HG2      GLU  69  91.528  11.291  -1.832
  540    HG3  GLU  69           HG3      GLU  69  91.455  11.191  -3.591
  541    H    ASN  70           H        ASN  70  90.773   7.729  -0.877
  542    HA   ASN  70           HA       ASN  70  93.483   7.257  -1.570
  543    HB2  ASN  70           HB2      ASN  70  93.292   9.811  -0.889
  544    HB3  ASN  70           HB1      ASN  70  93.329   9.153   0.743
  545   HD21  ASN  70          HD21      ASN  70  95.120   6.991   0.421
  546   HD22  ASN  70          HD22      ASN  70  96.642   7.590  -0.030
  547    HA   PRO  71           HA       PRO  71  91.237   4.570   1.578
  548    HB2  PRO  71           HB2      PRO  71  92.949   2.652   0.045
  549    HB3  PRO  71           HB1      PRO  71  91.275   2.475   0.601
  550    HG2  PRO  71           HG2      PRO  71  91.849   2.983  -1.950
  551    HG3  PRO  71           HG1      PRO  71  90.420   3.673  -1.163
  552    HD2  PRO  71           HD2      PRO  71  92.972   5.010  -1.932
  553    HD3  PRO  71           HD1      PRO  71  91.336   5.691  -1.803
  554    H    LYS  72           H        LYS  72  94.626   4.679   0.536
  555    HA   LYS  72           HA       LYS  72  95.648   3.389   2.882
  556    HB2  LYS  72           HB2      LYS  72  96.800   3.398   0.673
  557    HB3  LYS  72           HB3      LYS  72  97.113   5.118   0.884
  558    HG2  LYS  72           HG2      LYS  72  98.957   4.621   2.084
  559    HG3  LYS  72           HG3      LYS  72  97.939   3.850   3.296
  560    HD2  LYS  72           HD2      LYS  72  98.870   2.434   0.783
  561    HD3  LYS  72           HD3      LYS  72  99.748   2.366   2.310
  562    HE2  LYS  72           HE2      LYS  72  96.907   1.427   1.814
  563    HE3  LYS  72           HE3      LYS  72  98.308   0.420   2.174
  564    HZ1  LYS  72           HZ1      LYS  72  97.219   0.660   4.201
  565    HZ2  LYS  72           HZ2      LYS  72  96.902   2.311   3.956
  566    HZ3  LYS  72           HZ3      LYS  72  98.484   1.787   4.287
  567    H    LYS  73           H        LYS  73  95.598   6.781   1.782
  568    HA   LYS  73           HA       LYS  73  96.959   7.823   4.016
  569    HB2  LYS  73           HB2      LYS  73  96.562   8.985   1.804
  570    HB3  LYS  73           HB3      LYS  73  94.922   9.308   2.363
  571    HG2  LYS  73           HG2      LYS  73  96.581  10.074   4.508
  572    HG3  LYS  73           HG3      LYS  73  97.399  10.671   3.066
  573    HD2  LYS  73           HD2      LYS  73  94.520  11.210   3.855
  574    HD3  LYS  73           HD3      LYS  73  95.846  12.369   3.877
  575    HE2  LYS  73           HE2      LYS  73  95.981  11.474   1.290
  576    HE3  LYS  73           HE3      LYS  73  94.245  11.388   1.592
  577    HZ1  LYS  73           HZ1      LYS  73  95.324  13.590   0.780
  578    HZ2  LYS  73           HZ2      LYS  73  95.729  13.784   2.418
  579    HZ3  LYS  73           HZ3      LYS  73  94.102  13.630   1.955
  580    H    TYR  74           H        TYR  74  93.585   7.018   3.513
  581    HA   TYR  74           HA       TYR  74  92.523   8.546   5.650
  582    HB2  TYR  74           HB2      TYR  74  91.390   7.150   3.655
  583    HB3  TYR  74           HB3      TYR  74  91.226   5.959   4.945
  584    HD1  TYR  74           HD1      TYR  74  90.851   9.677   4.507
  585    HD2  TYR  74           HD2      TYR  74  89.254   6.060   6.191
  586    HE1  TYR  74           HE1      TYR  74  88.938  10.952   5.436
  587    HE2  TYR  74           HE2      TYR  74  87.341   7.336   7.117
  588    HH   TYR  74           HH       TYR  74  87.108  10.868   6.685
  589    H    ILE  75           H        ILE  75  93.237   5.052   5.480
  590    HA   ILE  75           HA       ILE  75  93.726   5.104   8.399
  591    HB   ILE  75           HB       ILE  75  92.418   2.854   6.851
  592   HG12  ILE  75          HG12      ILE  75  91.119   4.650   8.908
  593   HG13  ILE  75          HG13      ILE  75  91.080   5.039   7.189
  594   HG21  ILE  75          HG21      ILE  75  93.120   3.300   9.760
  595   HG22  ILE  75          HG22      ILE  75  93.558   1.936   8.731
  596   HG23  ILE  75          HG23      ILE  75  91.890   2.137   9.266
  597   HD11  ILE  75          HD11      ILE  75  89.899   3.025   6.665
  598   HD12  ILE  75          HD12      ILE  75  89.079   3.728   8.059
  599   HD13  ILE  75          HD13      ILE  75  90.176   2.365   8.277
  600    HA   PRO  76           HA       PRO  76  97.542   3.888   5.900
  601    HB2  PRO  76           HB2      PRO  76  98.497   4.694   8.632
  602    HB3  PRO  76           HB1      PRO  76  99.245   4.985   7.049
  603    HG2  PRO  76           HG2      PRO  76  97.885   6.897   8.316
  604    HG3  PRO  76           HG1      PRO  76  97.840   6.734   6.552
  605    HD2  PRO  76           HD2      PRO  76  95.713   6.147   8.535
  606    HD3  PRO  76           HD1      PRO  76  95.567   6.517   6.804
  607    H    GLY  77           H        GLY  77  98.069   1.790   5.809
  608    HA2  GLY  77           HA2      GLY  77  99.127  -0.098   7.005
  609    HA3  GLY  77           HA3      GLY  77  97.944   0.161   8.283
  610    H    THR  78           H        THR  78  95.817   0.746   6.300
  611    HA   THR  78           HA       THR  78  94.625  -1.765   6.102
  612    HB   THR  78           HB       THR  78  93.464   0.449   5.881
  613    HG1  THR  78           HG1      THR  78  92.123  -0.350   4.089
  614   HG21  THR  78          HG21      THR  78  93.526   1.629   3.809
  615   HG22  THR  78          HG22      THR  78  94.400   0.321   3.012
  616   HG23  THR  78          HG23      THR  78  95.208   1.305   4.232
  617    H    LYS  79           H        LYS  79  94.580  -3.356   4.557
  618    HA   LYS  79           HA       LYS  79  96.728  -3.269   2.581
  619    HB2  LYS  79           HB2      LYS  79  95.834  -5.278   4.154
  620    HB3  LYS  79           HB3      LYS  79  94.923  -5.620   2.682
  621    HG2  LYS  79           HG2      LYS  79  96.975  -5.643   1.363
  622    HG3  LYS  79           HG3      LYS  79  97.921  -5.163   2.772
  623    HD2  LYS  79           HD2      LYS  79  98.257  -7.448   2.829
  624    HD3  LYS  79           HD3      LYS  79  96.818  -7.326   3.841
  625    HE2  LYS  79           HE2      LYS  79  95.391  -7.843   1.912
  626    HE3  LYS  79           HE3      LYS  79  96.807  -7.907   0.863
  627    HZ1  LYS  79           HZ1      LYS  79  95.942 -10.096   1.752
  628    HZ2  LYS  79           HZ2      LYS  79  96.555  -9.617   3.262
  629    HZ3  LYS  79           HZ3      LYS  79  97.602  -9.806   1.938
  630    H    MET  80           H        MET  80  96.026  -1.848   0.995
  631    HA   MET  80           HA       MET  80  94.437  -2.903  -1.077
  632    HB2  MET  80           HB2      MET  80  92.504  -2.502   0.285
  633    HB3  MET  80           HB1      MET  80  93.063  -0.883   0.705
  634    HG2  MET  80           HG2      MET  80  92.663  -0.054  -1.474
  635    HG3  MET  80           HG1      MET  80  92.576  -1.673  -2.167
  636    HE1  MET  80           HE1      MET  80  90.353   1.297  -1.185
  637    HE2  MET  80           HE2      MET  80  89.136   0.492  -2.171
  638    HE3  MET  80           HE3      MET  80  90.801   0.583  -2.740
  639    H    ILE  81           H        ILE  81  96.075  -2.194  -2.395
  640    HA   ILE  81           HA       ILE  81  96.261   0.736  -2.765
  641    HB   ILE  81           HB       ILE  81  98.537  -1.259  -2.937
  642   HG12  ILE  81          HG12      ILE  81  99.376   0.458  -1.101
  643   HG13  ILE  81          HG13      ILE  81  97.654   0.764  -0.887
  644   HG21  ILE  81          HG21      ILE  81  99.842   0.955  -3.178
  645   HG22  ILE  81          HG22      ILE  81  98.286   1.681  -3.582
  646   HG23  ILE  81          HG23      ILE  81  98.944   0.391  -4.587
  647   HD11  ILE  81          HD11      ILE  81  97.766  -2.005  -0.943
  648   HD12  ILE  81          HD12      ILE  81  97.691  -1.017   0.512
  649   HD13  ILE  81          HD13      ILE  81  99.250  -1.570  -0.096
  650    H    PHE  82           H        PHE  82  94.789   0.657  -4.490
  651    HA   PHE  82           HA       PHE  82  95.784  -0.723  -6.917
  652    HB2  PHE  82           HB2      PHE  82  93.668  -1.693  -6.059
  653    HB3  PHE  82           HB1      PHE  82  92.906  -0.110  -6.206
  654    HD1  PHE  82           HD1      PHE  82  94.878  -2.583  -8.221
  655    HD2  PHE  82           HD2      PHE  82  91.850   0.465  -8.219
  656    HE1  PHE  82           HE1      PHE  82  94.430  -3.026 -10.620
  657    HE2  PHE  82           HE2      PHE  82  91.402   0.021 -10.617
  658    HZ   PHE  82           HZ       PHE  82  92.692  -1.724 -11.818
  659    H    ALA  83           H        ALA  83  93.340   1.781  -6.231
  660    HA   ALA  83           HA       ALA  83  94.796   3.942  -7.320
  661    HB1  ALA  83           HB1      ALA  83  94.633   2.883  -9.459
  662    HB2  ALA  83           HB2      ALA  83  93.437   4.178  -9.446
  663    HB3  ALA  83           HB3      ALA  83  92.928   2.505  -9.213
  664    H    GLY  84           H        GLY  84  93.929   5.521  -6.145
  665    HA2  GLY  84           HA2      GLY  84  91.321   5.416  -5.018
  666    HA3  GLY  84           HA3      GLY  84  92.391   6.814  -5.019
  667    H    ILE  85           H        ILE  85  89.760   7.291  -5.304
  668    HA   ILE  85           HA       ILE  85  89.030   7.442  -8.115
  669    HB   ILE  85           HB       ILE  85  87.704   8.434  -5.585
  670   HG12  ILE  85          HG12      ILE  85  87.895   5.888  -6.302
  671   HG13  ILE  85          HG13      ILE  85  86.373   6.526  -5.694
  672   HG21  ILE  85          HG21      ILE  85  86.902   8.656  -8.485
  673   HG22  ILE  85          HG22      ILE  85  86.946   9.924  -7.261
  674   HG23  ILE  85          HG23      ILE  85  85.704   8.674  -7.192
  675   HD11  ILE  85          HD11      ILE  85  86.354   5.121  -7.892
  676   HD12  ILE  85          HD12      ILE  85  86.950   6.600  -8.644
  677   HD13  ILE  85          HD13      ILE  85  85.393   6.597  -7.815
  678    H    LYS  86           H        LYS  86  88.424   9.535  -9.106
  679    HA   LYS  86           HA       LYS  86  90.345  11.631  -8.316
  680    HB2  LYS  86           HB2      LYS  86  89.039  10.939 -10.945
  681    HB3  LYS  86           HB3      LYS  86  89.890  12.463 -10.687
  682    HG2  LYS  86           HG2      LYS  86  91.234   9.869  -9.961
  683    HG3  LYS  86           HG3      LYS  86  91.202  10.392 -11.644
  684    HD2  LYS  86           HD2      LYS  86  92.649  12.131 -11.275
  685    HD3  LYS  86           HD3      LYS  86  91.991  12.478  -9.678
  686    HE2  LYS  86           HE2      LYS  86  94.370  11.554  -9.722
  687    HE3  LYS  86           HE3      LYS  86  93.236  10.706  -8.672
  688    HZ1  LYS  86           HZ1      LYS  86  94.578   9.788 -11.045
  689    HZ2  LYS  86           HZ2      LYS  86  92.913   9.452 -11.041
  690    HZ3  LYS  86           HZ3      LYS  86  93.898   8.898  -9.772
  691    H    LYS  87           H        LYS  87  87.190  11.641 -10.020
  692    HA   LYS  87           HA       LYS  87  86.577  14.242  -8.917
  693    HB2  LYS  87           HB2      LYS  87  85.067  12.342 -10.710
  694    HB3  LYS  87           HB3      LYS  87  84.391  13.874 -10.161
  695    HG2  LYS  87           HG2      LYS  87  87.131  13.890 -11.380
  696    HG3  LYS  87           HG3      LYS  87  85.740  13.721 -12.451
  697    HD2  LYS  87           HD2      LYS  87  84.816  15.800 -11.757
  698    HD3  LYS  87           HD3      LYS  87  85.889  15.899 -10.361
  699    HE2  LYS  87           HE2      LYS  87  86.902  15.889 -13.212
  700    HE3  LYS  87           HE3      LYS  87  86.540  17.371 -12.327
  701    HZ1  LYS  87           HZ1      LYS  87  88.675  15.415 -11.888
  702    HZ2  LYS  87           HZ2      LYS  87  88.043  16.227 -10.536
  703    HZ3  LYS  87           HZ3      LYS  87  88.730  17.109 -11.816
  704    H    LYS  88           H        LYS  88  84.529  14.700  -7.812
  705    HA   LYS  88           HA       LYS  88  84.194  13.007  -5.532
  706    HB2  LYS  88           HB2      LYS  88  83.888  15.538  -5.604
  707    HB3  LYS  88           HB3      LYS  88  82.332  15.228  -6.377
  708    HG2  LYS  88           HG2      LYS  88  81.791  13.694  -4.419
  709    HG3  LYS  88           HG3      LYS  88  83.234  14.328  -3.629
  710    HD2  LYS  88           HD2      LYS  88  81.661  15.807  -2.793
  711    HD3  LYS  88           HD3      LYS  88  82.126  16.672  -4.258
  712    HE2  LYS  88           HE2      LYS  88  80.222  15.669  -5.462
  713    HE3  LYS  88           HE3      LYS  88  79.762  14.786  -4.006
  714    HZ1  LYS  88           HZ1      LYS  88  80.094  17.690  -3.824
  715    HZ2  LYS  88           HZ2      LYS  88  79.039  16.664  -2.975
  716    HZ3  LYS  88           HZ3      LYS  88  78.701  17.094  -4.584
  717    H    THR  89           H        THR  89  82.074  13.855  -8.280
  718    HA   THR  89           HA       THR  89  79.881  12.289  -7.613
  719    HB   THR  89           HB       THR  89  79.437  12.175 -10.068
  720    HG1  THR  89           HG1      THR  89  81.782  13.720 -10.332
  721   HG21  THR  89          HG21      THR  89  80.359  14.903  -9.125
  722   HG22  THR  89          HG22      THR  89  78.840  14.150  -8.637
  723   HG23  THR  89          HG23      THR  89  79.117  14.562 -10.329
  724    H    GLU  90           H        GLU  90  83.006  11.339  -8.818
  725    HA   GLU  90           HA       GLU  90  82.276   8.738  -9.725
  726    HB2  GLU  90           HB2      GLU  90  84.884   9.994  -8.880
  727    HB3  GLU  90           HB3      GLU  90  84.781   8.284  -9.287
  728    HG2  GLU  90           HG2      GLU  90  84.047   8.765 -11.510
  729    HG3  GLU  90           HG3      GLU  90  83.777  10.463 -11.124
  730    H    ARG  91           H        ARG  91  83.304  10.107  -6.648
  731    HA   ARG  91           HA       ARG  91  83.389   7.572  -5.275
  732    HB2  ARG  91           HB2      ARG  91  83.244  10.383  -4.147
  733    HB3  ARG  91           HB3      ARG  91  83.666   8.922  -3.255
  734    HG2  ARG  91           HG2      ARG  91  85.580   8.593  -4.857
  735    HG3  ARG  91           HG3      ARG  91  85.213  10.179  -5.532
  736    HD2  ARG  91           HD2      ARG  91  85.370  10.304  -2.628
  737    HD3  ARG  91           HD3      ARG  91  86.854   9.647  -3.312
  738    HE   ARG  91           HE       ARG  91  86.286  11.846  -4.866
  739   HH11  ARG  91          HH21      ARG  91  86.725  11.185  -1.496
  740   HH12  ARG  91          HH22      ARG  91  87.364  12.753  -1.130
  741   HH21  ARG  91          HH11      ARG  91  87.124  13.904  -4.393
  742   HH22  ARG  91          HH12      ARG  91  87.588  14.293  -2.770
  743    H    GLU  92           H        GLU  92  81.162  10.360  -5.317
  744    HA   GLU  92           HA       GLU  92  79.258   9.341  -3.530
  745    HB2  GLU  92           HB2      GLU  92  79.307  11.687  -4.379
  746    HB3  GLU  92           HB3      GLU  92  78.726  11.101  -5.938
  747    HG2  GLU  92           HG2      GLU  92  76.691  10.246  -4.911
  748    HG3  GLU  92           HG3      GLU  92  77.280  10.681  -3.307
  749    H    ASP  93           H        ASP  93  79.286   9.207  -7.103
  750    HA   ASP  93           HA       ASP  93  77.001   7.601  -7.397
  751    HB2  ASP  93           HB2      ASP  93  79.464   7.771  -9.149
  752    HB3  ASP  93           HB1      ASP  93  77.932   7.040  -9.623
  753    H    LEU  94           H        LEU  94  80.440   6.706  -7.217
  754    HA   LEU  94           HA       LEU  94  80.129   3.925  -7.431
  755    HB2  LEU  94           HB2      LEU  94  82.328   4.978  -7.587
  756    HB3  LEU  94           HB3      LEU  94  82.202   5.525  -5.917
  757    HG   LEU  94           HG       LEU  94  82.201   3.239  -5.104
  758   HD11  LEU  94          HD11      LEU  94  81.045   1.973  -6.695
  759   HD12  LEU  94          HD12      LEU  94  82.709   1.451  -6.950
  760   HD13  LEU  94          HD13      LEU  94  81.978   2.628  -8.041
  761   HD21  LEU  94          HD21      LEU  94  84.460   2.839  -5.410
  762   HD22  LEU  94          HD22      LEU  94  84.376   4.502  -5.983
  763   HD23  LEU  94          HD23      LEU  94  84.400   3.171  -7.139
  764    H    ILE  95           H        ILE  95  79.890   6.108  -4.699
  765    HA   ILE  95           HA       ILE  95  79.682   4.012  -2.767
  766    HB   ILE  95           HB       ILE  95  79.340   6.993  -2.657
  767   HG12  ILE  95          HG12      ILE  95  81.190   5.250  -1.041
  768   HG13  ILE  95          HG13      ILE  95  81.566   5.615  -2.721
  769   HG21  ILE  95          HG21      ILE  95  79.258   6.389  -0.062
  770   HG22  ILE  95          HG22      ILE  95  78.514   4.908  -0.666
  771   HG23  ILE  95          HG23      ILE  95  77.778   6.471  -1.016
  772   HD11  ILE  95          HD11      ILE  95  80.846   7.846  -0.856
  773   HD12  ILE  95          HD12      ILE  95  81.837   7.885  -2.311
  774   HD13  ILE  95          HD13      ILE  95  82.476   7.181  -0.831
  775    H    ALA  96           H        ALA  96  77.481   5.828  -4.741
  776    HA   ALA  96           HA       ALA  96  75.104   5.289  -3.278
  777    HB1  ALA  96           HB1      ALA  96  73.954   5.857  -5.384
  778    HB2  ALA  96           HB2      ALA  96  75.497   5.803  -6.238
  779    HB3  ALA  96           HB3      ALA  96  75.212   7.032  -5.006
  780    H    TYR  97           H        TYR  97  76.971   3.561  -5.691
  781    HA   TYR  97           HA       TYR  97  75.018   1.477  -6.074
  782    HB2  TYR  97           HB2      TYR  97  76.532   1.911  -7.893
  783    HB3  TYR  97           HB3      TYR  97  77.935   1.715  -6.841
  784    HD1  TYR  97           HD1      TYR  97  75.030  -0.083  -8.329
  785    HD2  TYR  97           HD2      TYR  97  78.842  -0.438  -6.380
  786    HE1  TYR  97           HE1      TYR  97  75.038  -2.521  -8.787
  787    HE2  TYR  97           HE2      TYR  97  78.849  -2.875  -6.840
  788    HH   TYR  97           HH       TYR  97  76.101  -4.444  -8.485
  789    H    LEU  98           H        LEU  98  78.025   1.892  -4.231
  790    HA   LEU  98           HA       LEU  98  78.236  -0.717  -3.226
  791    HB2  LEU  98           HB2      LEU  98  79.174   1.971  -2.270
  792    HB3  LEU  98           HB3      LEU  98  79.409   0.550  -1.260
  793    HG   LEU  98           HG       LEU  98  80.234   0.462  -4.154
  794   HD11  LEU  98          HD11      LEU  98  82.019   1.450  -1.920
  795   HD12  LEU  98          HD12      LEU  98  81.246   2.517  -3.092
  796   HD13  LEU  98          HD13      LEU  98  82.417   1.321  -3.632
  797   HD21  LEU  98          HD21      LEU  98  81.353  -0.795  -1.634
  798   HD22  LEU  98          HD22      LEU  98  81.819  -1.182  -3.290
  799   HD23  LEU  98          HD23      LEU  98  80.203  -1.583  -2.711
  800    H    LYS  99           H        LYS  99  76.086   1.883  -2.439
  801    HA   LYS  99           HA       LYS  99  75.345   0.879   0.166
  802    HB2  LYS  99           HB2      LYS  99  74.315   3.050  -1.642
  803    HB3  LYS  99           HB3      LYS  99  73.397   2.555  -0.220
  804    HG2  LYS  99           HG2      LYS  99  75.358   2.997   1.209
  805    HG3  LYS  99           HG3      LYS  99  76.283   3.483  -0.211
  806    HD2  LYS  99           HD2      LYS  99  75.434   5.478   0.900
  807    HD3  LYS  99           HD3      LYS  99  74.608   5.282  -0.645
  808    HE2  LYS  99           HE2      LYS  99  72.601   4.645   0.353
  809    HE3  LYS  99           HE3      LYS  99  73.393   4.063   1.818
  810    HZ1  LYS  99           HZ1      LYS  99  73.142   6.905   0.996
  811    HZ2  LYS  99           HZ2      LYS  99  73.910   6.346   2.404
  812    HZ3  LYS  99           HZ3      LYS  99  72.235   6.142   2.209
  813    H    LYS 100           H        LYS 100  73.715   1.055  -3.005
  814    HA   LYS 100           HA       LYS 100  71.522  -0.588  -2.139
  815    HB2  LYS 100           HB2      LYS 100  71.549   1.182  -4.019
  816    HB3  LYS 100           HB3      LYS 100  72.275  -0.081  -5.012
  817    HG2  LYS 100           HG2      LYS 100  70.363  -1.569  -4.513
  818    HG3  LYS 100           HG3      LYS 100  69.628  -0.292  -3.543
  819    HD2  LYS 100           HD2      LYS 100  70.407   0.261  -6.399
  820    HD3  LYS 100           HD3      LYS 100  68.898  -0.579  -6.050
  821    HE2  LYS 100           HE2      LYS 100  68.236   1.288  -4.542
  822    HE3  LYS 100           HE3      LYS 100  69.715   2.141  -4.982
  823    HZ1  LYS 100           HZ1      LYS 100  67.309   1.657  -6.558
  824    HZ2  LYS 100           HZ2      LYS 100  68.792   1.633  -7.386
  825    HZ3  LYS 100           HZ3      LYS 100  68.324   3.015  -6.517
  826    H    ALA 101           H        ALA 101  74.677  -1.184  -3.316
  827    HA   ALA 101           HA       ALA 101  74.091  -3.844  -4.338
  828    HB1  ALA 101           HB1      ALA 101  76.751  -2.475  -3.883
  829    HB2  ALA 101           HB2      ALA 101  75.834  -2.431  -5.388
  830    HB3  ALA 101           HB3      ALA 101  76.484  -3.960  -4.796
  831    H    THR 102           H        THR 102  75.297  -2.337  -1.424
  832    HA   THR 102           HA       THR 102  76.099  -4.913  -0.278
  833    HB   THR 102           HB       THR 102  76.804  -3.533   1.663
  834    HG1  THR 102           HG1      THR 102  75.415  -1.643   0.187
  835   HG21  THR 102          HG21      THR 102  77.740  -2.893  -1.123
  836   HG22  THR 102          HG22      THR 102  78.539  -3.848   0.124
  837   HG23  THR 102          HG23      THR 102  78.474  -2.091   0.266
  838    H    ASN 103           H        ASN 103  73.333  -3.105  -0.632
  839    HA   ASN 103           HA       ASN 103  72.147  -3.783   1.949
  840    HB2  ASN 103           HB2      ASN 103  71.286  -2.180  -0.440
  841    HB3  ASN 103           HB1      ASN 103  70.107  -2.687   0.762
  842   HD21  ASN 103          HD21      ASN 103  73.426  -2.000   1.712
  843   HD22  ASN 103          HD22      ASN 103  73.077  -0.562   2.541
  844    H    GLU 104           H        GLU 104  72.232  -4.922  -1.330
  845    HA   GLU 104           HA       GLU 104  70.711  -7.285  -0.570
  846    HB2  GLU 104           HB2      GLU 104  69.192  -7.051  -2.557
  847    HB3  GLU 104           HB3      GLU 104  68.893  -5.870  -1.280
  848    HG2  GLU 104           HG2      GLU 104  70.184  -4.184  -2.491
  849    HG3  GLU 104           HG3      GLU 104  70.591  -5.359  -3.739
  850    HHA  HEC 201           HA       HEC 105  89.445  -3.584   3.098
  851    HHB  HEC 201           HB       HEC 105  85.557  -0.111  -0.480
  852    HHC  HEC 201           HC       HEC 105  88.839  -1.778  -5.628
  853    HHD  HEC 201           HD       HEC 105  92.251  -5.789  -2.124
  854   HMA1  HEC 201          HMA1      HEC 105  84.626  -0.433   1.597
  855   HMA2  HEC 201          HMA2      HEC 105  85.773   0.756   2.214
  856   HMA3  HEC 201          HMA3      HEC 105  85.221  -0.560   3.251
  857   HAA1  HEC 201          HAA1      HEC 105  87.150  -0.956   4.415
  858   HAA2  HEC 201          HAA2      HEC 105  88.488  -2.082   4.357
  859   HBA1  HEC 201          HBA1      HEC 105  87.146  -3.914   4.704
  860   HBA2  HEC 201          HBA2      HEC 105  85.758  -3.189   3.902
  861   HMB1  HEC 201          HMB1      HEC 105  84.098  -0.027  -2.901
  862   HMB2  HEC 201          HMB2      HEC 105  84.852   1.166  -3.953
  863   HMB3  HEC 201          HMB3      HEC 105  85.018   1.304  -2.206
  864    HAB  HEC 201           HAB      HEC 105  87.337  -0.560  -6.262
  865   HBB1  HEC 201          HBB1      HEC 105  86.681   1.960  -4.781
  866   HBB2  HEC 201          HBB2      HEC 105  87.947   1.655  -5.965
  867   HBB3  HEC 201          HBB3      HEC 105  86.277   1.863  -6.493
  868   HMC1  HEC 201          HMC1      HEC 105  91.345  -2.547  -6.748
  869   HMC2  HEC 201          HMC2      HEC 105  89.796  -3.349  -6.994
  870   HMC3  HEC 201          HMC3      HEC 105  91.284  -4.287  -7.023
  871    HAC  HEC 201           HAC      HEC 105  92.690  -6.186  -4.054
  872   HBC1  HEC 201          HBC1      HEC 105  93.333  -5.306  -6.743
  873   HBC2  HEC 201          HBC2      HEC 105  94.393  -5.450  -5.342
  874   HBC3  HEC 201          HBC3      HEC 105  93.480  -3.966  -5.607
  875   HMD1  HEC 201          HMD1      HEC 105  93.755  -6.162   0.421
  876   HMD2  HEC 201          HMD2      HEC 105  92.639  -7.196  -0.467
  877   HMD3  HEC 201          HMD3      HEC 105  92.690  -7.267   1.288
  878   HAD1  HEC 201          HAD1      HEC 105  92.063  -6.322   3.046
  879   HAD2  HEC 201          HAD2      HEC 105  90.512  -5.678   3.544
  880   HBD1  HEC 201          HBD1      HEC 105  91.694  -3.382   3.593
  881   HBD2  HEC 201          HBD2      HEC 105  93.192  -4.308   3.533
  882    H1   HOH 301           H2       HOH 200  80.605   2.186  -0.478
  883    H2   HOH 301           H1       HOH 200  79.961   3.553  -0.559
  884    H1   HOH 302           H2       HOH 201  86.553   4.821   6.058
  885    H2   HOH 302           H1       HOH 201  86.063   6.174   5.590
  886    H1   HOH 303           H2       HOH 202  83.259  -6.600   5.771
  887    H2   HOH 303           H1       HOH 202  81.773  -6.639   6.063
  888    H1   HOH 304           H2       HOH 203  81.867  -9.464  -0.101
  889    H2   HOH 304           H1       HOH 203  81.940 -10.938  -0.436
  Start of MODEL   27
    1    H1   GLY   1           H1       GLY   1  73.837  10.188  -4.859
    2    H2   GLY   1           H2       GLY   1  72.617   9.579  -5.873
    3    H3   GLY   1           H3       GLY   1  73.241  11.137  -6.133
    4    HA2  GLY   1           HA2      GLY   1  75.076  10.407  -7.187
    5    HA3  GLY   1           HA3      GLY   1  75.171   8.963  -6.178
    6    H    ASP   2           H        ASP   2  75.546   8.701  -8.873
    7    HA   ASP   2           HA       ASP   2  72.998   7.750 -10.002
    8    HB2  ASP   2           HB2      ASP   2  75.721   8.209 -11.228
    9    HB3  ASP   2           HB1      ASP   2  74.362   7.491 -12.093
   10    H    VAL   3           H        VAL   3  72.791   5.882  -8.697
   11    HA   VAL   3           HA       VAL   3  74.612   3.905  -8.168
   12    HB   VAL   3           HB       VAL   3  72.363   3.788  -7.293
   13   HG11  VAL   3          HG11      VAL   3  71.135   4.785  -9.130
   14   HG12  VAL   3          HG12      VAL   3  70.473   3.177  -8.836
   15   HG13  VAL   3          HG13      VAL   3  71.561   3.447 -10.197
   16   HG21  VAL   3          HG21      VAL   3  73.716   1.647  -7.889
   17   HG22  VAL   3          HG22      VAL   3  72.540   1.443  -9.185
   18   HG23  VAL   3          HG23      VAL   3  72.007   1.467  -7.504
   19    H    GLU   4           H        GLU   4  73.358   4.854 -11.227
   20    HA   GLU   4           HA       GLU   4  73.822   2.389 -12.618
   21    HB2  GLU   4           HB2      GLU   4  73.398   5.239 -13.517
   22    HB3  GLU   4           HB3      GLU   4  73.711   3.929 -14.657
   23    HG2  GLU   4           HG2      GLU   4  71.526   3.746 -12.579
   24    HG3  GLU   4           HG3      GLU   4  71.246   4.464 -14.164
   25    H    LYS   5           H        LYS   5  75.551   5.516 -12.697
   26    HA   LYS   5           HA       LYS   5  77.811   4.406 -14.057
   27    HB2  LYS   5           HB2      LYS   5  77.221   7.031 -12.708
   28    HB3  LYS   5           HB3      LYS   5  78.871   6.644 -13.183
   29    HG2  LYS   5           HG2      LYS   5  78.067   7.744 -15.086
   30    HG3  LYS   5           HG3      LYS   5  77.798   6.055 -15.503
   31    HD2  LYS   5           HD2      LYS   5  75.720   6.972 -16.020
   32    HD3  LYS   5           HD3      LYS   5  75.448   6.460 -14.358
   33    HE2  LYS   5           HE2      LYS   5  75.932   8.723 -13.550
   34    HE3  LYS   5           HE3      LYS   5  76.295   9.248 -15.193
   35    HZ1  LYS   5           HZ1      LYS   5  73.883   9.434 -14.044
   36    HZ2  LYS   5           HZ2      LYS   5  73.731   7.958 -14.871
   37    HZ3  LYS   5           HZ3      LYS   5  74.139   9.372 -15.720
   38    H    GLY   6           H        GLY   6  76.768   4.518 -10.801
   39    HA2  GLY   6           HA2      GLY   6  79.324   4.310  -9.533
   40    HA3  GLY   6           HA3      GLY   6  77.767   3.890  -8.812
   41    H    LYS   7           H        LYS   7  76.964   2.089 -10.868
   42    HA   LYS   7           HA       LYS   7  78.155  -0.318  -9.928
   43    HB2  LYS   7           HB2      LYS   7  75.795  -0.065 -10.804
   44    HB3  LYS   7           HB3      LYS   7  76.485   0.033 -12.423
   45    HG2  LYS   7           HG2      LYS   7  77.679  -2.179 -11.860
   46    HG3  LYS   7           HG3      LYS   7  76.574  -2.289 -10.494
   47    HD2  LYS   7           HD2      LYS   7  75.550  -3.501 -12.295
   48    HD3  LYS   7           HD3      LYS   7  74.668  -1.982 -12.143
   49    HE2  LYS   7           HE2      LYS   7  75.509  -1.135 -14.127
   50    HE3  LYS   7           HE3      LYS   7  77.010  -2.054 -14.009
   51    HZ1  LYS   7           HZ1      LYS   7  74.452  -3.460 -14.374
   52    HZ2  LYS   7           HZ2      LYS   7  76.019  -3.950 -14.808
   53    HZ3  LYS   7           HZ3      LYS   7  75.220  -2.753 -15.711
   54    H    LYS   8           H        LYS   8  78.433   1.577 -12.926
   55    HA   LYS   8           HA       LYS   8  80.096  -0.186 -14.350
   56    HB2  LYS   8           HB2      LYS   8  79.028   1.723 -15.419
   57    HB3  LYS   8           HB3      LYS   8  79.963   2.838 -14.423
   58    HG2  LYS   8           HG2      LYS   8  81.589   0.854 -15.907
   59    HG3  LYS   8           HG3      LYS   8  80.721   1.999 -16.927
   60    HD2  LYS   8           HD2      LYS   8  82.270   2.997 -14.544
   61    HD3  LYS   8           HD3      LYS   8  83.109   2.631 -16.050
   62    HE2  LYS   8           HE2      LYS   8  80.671   4.416 -15.958
   63    HE3  LYS   8           HE3      LYS   8  82.308   5.044 -15.774
   64    HZ1  LYS   8           HZ1      LYS   8  82.595   3.524 -17.936
   65    HZ2  LYS   8           HZ2      LYS   8  82.192   5.173 -17.999
   66    HZ3  LYS   8           HZ3      LYS   8  80.976   3.994 -18.128
   67    H    ILE   9           H        ILE   9  80.928   2.525 -12.205
   68    HA   ILE   9           HA       ILE   9  83.739   2.233 -12.435
   69    HB   ILE   9           HB       ILE   9  82.086   3.456 -10.217
   70   HG12  ILE   9          HG12      ILE   9  83.520   4.851 -12.487
   71   HG13  ILE   9          HG13      ILE   9  81.835   4.345 -12.616
   72   HG21  ILE   9          HG21      ILE   9  84.321   3.042  -9.419
   73   HG22  ILE   9          HG22      ILE   9  84.226   4.753  -9.836
   74   HG23  ILE   9          HG23      ILE   9  85.026   3.622 -10.928
   75   HD11  ILE   9          HD11      ILE   9  81.207   5.720 -10.730
   76   HD12  ILE   9          HD12      ILE   9  82.134   6.727 -11.841
   77   HD13  ILE   9          HD13      ILE   9  82.895   6.096 -10.381
   78    H    PHE  10           H        PHE  10  81.347   0.546 -10.604
   79    HA   PHE  10           HA       PHE  10  83.192  -0.455  -8.615
   80    HB2  PHE  10           HB2      PHE  10  81.049  -0.331  -7.743
   81    HB3  PHE  10           HB1      PHE  10  80.295  -0.859  -9.247
   82    HD1  PHE  10           HD1      PHE  10  80.252  -3.233  -9.875
   83    HD2  PHE  10           HD2      PHE  10  81.955  -1.938  -6.156
   84    HE1  PHE  10           HE1      PHE  10  80.240  -5.573  -9.060
   85    HE2  PHE  10           HE2      PHE  10  81.945  -4.279  -5.337
   86    HZ   PHE  10           HZ       PHE  10  81.089  -6.098  -6.794
   87    H    VAL  11           H        VAL  11  81.382  -1.947 -11.318
   88    HA   VAL  11           HA       VAL  11  82.401  -4.524 -11.092
   89    HB   VAL  11           HB       VAL  11  81.870  -4.771 -13.503
   90   HG11  VAL  11          HG11      VAL  11  80.145  -4.783 -11.610
   91   HG12  VAL  11          HG12      VAL  11  79.525  -4.484 -13.234
   92   HG13  VAL  11          HG13      VAL  11  79.742  -3.143 -12.112
   93   HG21  VAL  11          HG21      VAL  11  82.622  -2.522 -14.212
   94   HG22  VAL  11          HG22      VAL  11  81.295  -1.801 -13.303
   95   HG23  VAL  11          HG23      VAL  11  80.954  -2.818 -14.700
   96    H    GLN  12           H        GLN  12  83.836  -1.666 -12.505
   97    HA   GLN  12           HA       GLN  12  86.050  -3.255 -13.595
   98    HB2  GLN  12           HB2      GLN  12  86.715  -1.258 -14.739
   99    HB3  GLN  12           HB1      GLN  12  84.973  -1.453 -14.935
  100    HG2  GLN  12           HG2      GLN  12  84.696   0.078 -12.917
  101    HG3  GLN  12           HG1      GLN  12  86.420   0.426 -13.058
  102   HE21  GLN  12          HE21      GLN  12  85.566  -0.141 -16.171
  103   HE22  GLN  12          HE22      GLN  12  85.134   1.423 -16.654
  104    H    LYS  13           H        LYS  13  85.379  -1.130 -10.892
  105    HA   LYS  13           HA       LYS  13  88.264  -0.905 -10.345
  106    HB2  LYS  13           HB2      LYS  13  86.631   1.090 -10.343
  107    HB3  LYS  13           HB3      LYS  13  86.128   0.486  -8.764
  108    HG2  LYS  13           HG2      LYS  13  87.848   1.935  -8.156
  109    HG3  LYS  13           HG3      LYS  13  88.731   0.417  -8.302
  110    HD2  LYS  13           HD2      LYS  13  90.081   1.814  -9.578
  111    HD3  LYS  13           HD3      LYS  13  89.003   1.195 -10.828
  112    HE2  LYS  13           HE2      LYS  13  89.008   3.540 -11.168
  113    HE3  LYS  13           HE3      LYS  13  87.511   3.231 -10.291
  114    HZ1  LYS  13           HZ1      LYS  13  88.580   5.052  -9.251
  115    HZ2  LYS  13           HZ2      LYS  13  90.072   4.241  -9.190
  116    HZ3  LYS  13           HZ3      LYS  13  88.779   3.722  -8.218
  117    H    CYS  14           H        CYS  14  85.377  -1.419  -8.248
  118    HA   CYS  14           HA       CYS  14  87.082  -2.659  -6.265
  119    HB2  CYS  14           HB2      CYS  14  84.105  -2.600  -6.055
  120    HB3  CYS  14           HB1      CYS  14  85.310  -2.460  -4.780
  121    H    ALA  15           H        ALA  15  84.594  -3.857  -8.488
  122    HA   ALA  15           HA       ALA  15  84.088  -6.331  -7.415
  123    HB1  ALA  15           HB1      ALA  15  84.352  -5.394 -10.250
  124    HB2  ALA  15           HB2      ALA  15  82.904  -5.877  -9.367
  125    HB3  ALA  15           HB3      ALA  15  84.052  -7.098  -9.911
  126    H    GLN  16           H        GLN  16  87.038  -5.199  -8.859
  127    HA   GLN  16           HA       GLN  16  88.352  -7.478  -9.619
  128    HB2  GLN  16           HB2      GLN  16  89.393  -5.068  -8.139
  129    HB3  GLN  16           HB1      GLN  16  90.445  -6.321  -8.790
  130    HG2  GLN  16           HG2      GLN  16  88.477  -5.432 -10.763
  131    HG3  GLN  16           HG1      GLN  16  89.467  -4.095 -10.185
  132   HE21  GLN  16          HE21      GLN  16  89.439  -5.861 -12.790
  133   HE22  GLN  16          HE22      GLN  16  91.080  -6.247 -12.991
  134    H    CYS  17           H        CYS  17  88.567  -6.116  -6.300
  135    HA   CYS  17           HA       CYS  17  88.981  -8.885  -5.326
  136    HB2  CYS  17           HB2      CYS  17  90.177  -6.719  -3.713
  137    HB3  CYS  17           HB1      CYS  17  90.829  -8.296  -4.144
  138    H    HIS  18           H        HSD  18  86.417  -8.036  -5.378
  139    HA   HIS  18           HA       HSD  18  85.790  -7.912  -2.542
  140    HB2  HIS  18           HB2      HSD  18  85.220  -5.626  -4.400
  141    HB3  HIS  18           HB1      HSD  18  84.103  -5.980  -3.086
  142    HD1  HIS  18           HD1      HSD  18  84.982  -5.682  -0.645
  143    HD2  HIS  18           HD2      HSD  18  87.736  -4.612  -3.580
  144    HE1  HIS  18           HE1      HSD  18  86.815  -4.388   0.532
  145    H    THR  19           H        THR  19  83.200  -7.595  -2.440
  146    HA   THR  19           HA       THR  19  81.936  -9.233  -4.532
  147    HB   THR  19           HB       THR  19  81.076  -9.929  -1.807
  148    HG1  THR  19           HG1      THR  19  82.991 -11.207  -1.492
  149   HG21  THR  19          HG21      THR  19  82.190 -11.728  -3.952
  150   HG22  THR  19          HG22      THR  19  80.566 -11.052  -4.071
  151   HG23  THR  19          HG23      THR  19  80.986 -12.103  -2.720
  152    H    VAL  20           H        VAL  20  81.582  -7.199  -1.673
  153    HA   VAL  20           HA       VAL  20  79.841  -5.910  -0.902
  154    HB   VAL  20           HB       VAL  20  79.138  -4.222  -2.477
  155   HG11  VAL  20          HG11      VAL  20  81.513  -4.261  -1.649
  156   HG12  VAL  20          HG12      VAL  20  81.317  -3.447  -3.201
  157   HG13  VAL  20          HG13      VAL  20  81.967  -5.083  -3.140
  158   HG21  VAL  20          HG21      VAL  20  79.436  -4.417  -4.836
  159   HG22  VAL  20          HG22      VAL  20  78.687  -5.930  -4.335
  160   HG23  VAL  20          HG23      VAL  20  80.416  -5.868  -4.664
  161    H    GLU  21           H        GLU  21  79.016  -8.631  -1.524
  162    HA   GLU  21           HA       GLU  21  76.159  -8.071  -2.039
  163    HB2  GLU  21           HB2      GLU  21  75.908  -9.954  -3.430
  164    HB3  GLU  21           HB3      GLU  21  77.396  -9.197  -3.995
  165    HG2  GLU  21           HG2      GLU  21  78.600 -10.777  -2.340
  166    HG3  GLU  21           HG3      GLU  21  77.078 -11.665  -2.294
  167    H    LYS  22           H        LYS  22  74.984  -8.590  -0.331
  168    HA   LYS  22           HA       LYS  22  75.972  -9.892   1.945
  169    HB2  LYS  22           HB2      LYS  22  73.910  -8.369   1.705
  170    HB3  LYS  22           HB3      LYS  22  73.048  -9.821   1.206
  171    HG2  LYS  22           HG2      LYS  22  74.678 -10.012   3.707
  172    HG3  LYS  22           HG3      LYS  22  73.202  -9.056   3.786
  173    HD2  LYS  22           HD2      LYS  22  71.931 -10.987   2.863
  174    HD3  LYS  22           HD3      LYS  22  73.411 -11.945   2.890
  175    HE2  LYS  22           HE2      LYS  22  73.543 -11.876   5.259
  176    HE3  LYS  22           HE3      LYS  22  72.362 -10.571   5.365
  177    HZ1  LYS  22           HZ1      LYS  22  70.631 -11.977   5.034
  178    HZ2  LYS  22           HZ2      LYS  22  71.700 -13.067   5.777
  179    HZ3  LYS  22           HZ3      LYS  22  71.527 -13.062   4.087
  180    H    GLY  23           H        GLY  23  76.038 -11.965   2.602
  181    HA2  GLY  23           HA2      GLY  23  75.752 -14.256   2.609
  182    HA3  GLY  23           HA3      GLY  23  74.441 -14.049   1.452
  183    H    GLY  24           H        GLY  24  77.550 -12.677   0.756
  184    HA2  GLY  24           HA2      GLY  24  77.860 -14.560  -1.483
  185    HA3  GLY  24           HA3      GLY  24  78.657 -12.999  -1.323
  186    H    LYS  25           H        LYS  25  80.758 -13.577  -1.486
  187    HA   LYS  25           HA       LYS  25  81.920 -15.017   0.766
  188    HB2  LYS  25           HB2      LYS  25  83.329 -16.355  -0.967
  189    HB3  LYS  25           HB3      LYS  25  81.699 -16.915  -0.590
  190    HG2  LYS  25           HG2      LYS  25  80.809 -16.092  -2.605
  191    HG3  LYS  25           HG3      LYS  25  82.156 -14.983  -2.856
  192    HD2  LYS  25           HD2      LYS  25  83.639 -16.758  -3.444
  193    HD3  LYS  25           HD3      LYS  25  82.514 -17.985  -2.862
  194    HE2  LYS  25           HE2      LYS  25  81.653 -16.114  -5.051
  195    HE3  LYS  25           HE3      LYS  25  82.673 -17.498  -5.441
  196    HZ1  LYS  25           HZ1      LYS  25  80.870 -18.755  -5.386
  197    HZ2  LYS  25           HZ2      LYS  25  79.908 -17.443  -4.895
  198    HZ3  LYS  25           HZ3      LYS  25  80.686 -18.413  -3.736
  199    H    HIS  26           H        HIS  26  83.656 -13.920   1.412
  200    HA   HIS  26           HA       HIS  26  84.620 -11.619   0.183
  201    HB2  HIS  26           HB2      HIS  26  86.781 -12.323   1.619
  202    HB3  HIS  26           HB1      HIS  26  85.316 -11.688   2.365
  203    HD1  HIS  26           HD1      HIS  26  86.586 -15.128   1.269
  204    HD2  HIS  26           HD2      HIS  26  84.416 -13.356   4.357
  205    HE1  HIS  26           HE1      HIS  26  86.025 -16.979   2.904
  206    HE2  HIS  26           HE2      HIS  26  84.703 -15.915   4.793
  207    H    LYS  27           H        LYS  27  85.608 -11.388  -1.688
  208    HA   LYS  27           HA       LYS  27  87.276 -13.585  -2.742
  209    HB2  LYS  27           HB2      LYS  27  85.298 -12.657  -4.074
  210    HB3  LYS  27           HB3      LYS  27  86.260 -11.194  -4.278
  211    HG2  LYS  27           HG2      LYS  27  86.900 -12.371  -6.176
  212    HG3  LYS  27           HG3      LYS  27  88.131 -12.915  -5.039
  213    HD2  LYS  27           HD2      LYS  27  87.398 -14.953  -5.897
  214    HD3  LYS  27           HD3      LYS  27  86.356 -14.797  -4.483
  215    HE2  LYS  27           HE2      LYS  27  84.898 -15.377  -6.276
  216    HE3  LYS  27           HE3      LYS  27  84.672 -13.645  -6.039
  217    HZ1  LYS  27           HZ1      LYS  27  85.055 -14.540  -8.403
  218    HZ2  LYS  27           HZ2      LYS  27  86.688 -14.633  -7.945
  219    HZ3  LYS  27           HZ3      LYS  27  85.879 -13.139  -7.919
  220    H    THR  28           H        THR  28  89.364 -13.316  -2.236
  221    HA   THR  28           HA       THR  28  91.370 -12.274  -1.747
  222    HB   THR  28           HB       THR  28  90.583 -10.607  -4.149
  223    HG1  THR  28           HG1      THR  28  91.507 -13.247  -3.863
  224   HG21  THR  28          HG21      THR  28  92.600  -9.693  -3.489
  225   HG22  THR  28          HG22      THR  28  93.203 -11.047  -4.441
  226   HG23  THR  28          HG23      THR  28  93.129 -11.171  -2.684
  227    H    GLY  29           H        GLY  29  88.924 -11.147  -0.516
  228    HA2  GLY  29           HA2      GLY  29  90.003  -9.005   0.887
  229    HA3  GLY  29           HA3      GLY  29  89.072  -8.311  -0.438
  230    HA   PRO  30           HA       PRO  30  86.343  -9.752   3.216
  231    HB2  PRO  30           HB2      PRO  30  85.931  -7.348   4.464
  232    HB3  PRO  30           HB1      PRO  30  87.243  -8.460   4.901
  233    HG2  PRO  30           HG2      PRO  30  87.329  -6.002   3.217
  234    HG3  PRO  30           HG1      PRO  30  88.490  -6.585   4.422
  235    HD2  PRO  30           HD2      PRO  30  88.875  -6.894   1.730
  236    HD3  PRO  30           HD1      PRO  30  89.514  -8.036   2.933
  237    H    ASN  31           H        ASN  31  84.065  -9.070   3.578
  238    HA   ASN  31           HA       ASN  31  82.900  -8.058   1.097
  239    HB2  ASN  31           HB2      ASN  31  80.883  -9.014   1.827
  240    HB3  ASN  31           HB1      ASN  31  82.100 -10.122   2.455
  241   HD21  ASN  31          HD21      ASN  31  81.985 -10.555   4.664
  242   HD22  ASN  31          HD22      ASN  31  81.139  -9.606   5.790
  243    H    LEU  32           H        LEU  32  81.206  -6.391   1.168
  244    HA   LEU  32           HA       LEU  32  81.711  -4.413   3.317
  245    HB2  LEU  32           HB2      LEU  32  80.734  -3.812   0.518
  246    HB3  LEU  32           HB3      LEU  32  81.236  -2.655   1.744
  247    HG   LEU  32           HG       LEU  32  82.960  -4.587   0.179
  248   HD11  LEU  32          HD11      LEU  32  84.253  -2.375  -0.110
  249   HD12  LEU  32          HD12      LEU  32  82.822  -1.587   0.551
  250   HD13  LEU  32          HD13      LEU  32  82.709  -2.509  -0.947
  251   HD21  LEU  32          HD21      LEU  32  84.813  -3.463   1.682
  252   HD22  LEU  32          HD22      LEU  32  83.944  -4.867   2.282
  253   HD23  LEU  32          HD23      LEU  32  83.492  -3.256   2.825
  254    H    HIS  33           H        HIS  33  79.782  -6.538   3.523
  255    HA   HIS  33           HA       HIS  33  77.156  -5.702   2.878
  256    HB2  HIS  33           HB2      HIS  33  77.974  -7.395   5.250
  257    HB3  HIS  33           HB1      HIS  33  76.408  -7.378   4.441
  258    HD1  HIS  33           HD1      HIS  33  78.473  -9.862   4.700
  259    HD2  HIS  33           HD2      HIS  33  77.784  -7.528   1.315
  260    HE1  HIS  33           HE1      HIS  33  79.154 -11.271   2.709
  261    HE2  HIS  33           HE2      HIS  33  78.734  -9.865   0.637
  262    H    GLY  34           H        GLY  34  75.641  -4.492   4.011
  263    HA2  GLY  34           HA2      GLY  34  75.160  -2.540   5.241
  264    HA3  GLY  34           HA3      GLY  34  75.384  -3.699   6.550
  265    H    LEU  35           H        LEU  35  77.810  -2.463   4.338
  266    HA   LEU  35           HA       LEU  35  79.855  -2.094   6.131
  267    HB2  LEU  35           HB2      LEU  35  80.194  -2.036   3.739
  268    HB3  LEU  35           HB3      LEU  35  79.203  -0.589   3.592
  269    HG   LEU  35           HG       LEU  35  80.990   0.383   5.318
  270   HD11  LEU  35          HD11      LEU  35  82.088  -1.980   5.300
  271   HD12  LEU  35          HD12      LEU  35  83.133  -0.564   5.193
  272   HD13  LEU  35          HD13      LEU  35  82.741  -1.480   3.742
  273   HD21  LEU  35          HD21      LEU  35  81.790   0.031   2.427
  274   HD22  LEU  35          HD22      LEU  35  82.094   1.413   3.477
  275   HD23  LEU  35          HD23      LEU  35  80.459   1.081   2.911
  276    H    PHE  36           H        PHE  36  77.760   0.511   4.886
  277    HA   PHE  36           HA       PHE  36  78.730   2.551   6.514
  278    HB2  PHE  36           HB2      PHE  36  75.815   2.519   5.859
  279    HB3  PHE  36           HB1      PHE  36  76.986   3.831   5.709
  280    HD1  PHE  36           HD2      PHE  36  75.909   0.589   4.250
  281    HD2  PHE  36           HD1      PHE  36  78.183   4.187   3.662
  282    HE1  PHE  36           HE2      PHE  36  76.254  -0.014   1.880
  283    HE2  PHE  36           HE1      PHE  36  78.524   3.580   1.285
  284    HZ   PHE  36           HZ       PHE  36  77.558   1.478   0.390
  285    H    GLY  37           H        GLY  37  79.045   2.047   8.663
  286    HA2  GLY  37           HA2      GLY  37  77.500   2.649  10.663
  287    HA3  GLY  37           HA3      GLY  37  76.708   1.147  10.219
  288    H    ARG  38           H        ARG  38  79.241  -0.200   9.500
  289    HA   ARG  38           HA       ARG  38  79.969  -0.993  12.211
  290    HB2  ARG  38           HB2      ARG  38  80.119  -2.176   9.526
  291    HB3  ARG  38           HB3      ARG  38  81.532  -2.509  10.526
  292    HG2  ARG  38           HG2      ARG  38  79.999  -3.276  12.352
  293    HG3  ARG  38           HG3      ARG  38  78.640  -3.064  11.248
  294    HD2  ARG  38           HD2      ARG  38  80.989  -4.731  10.397
  295    HD3  ARG  38           HD3      ARG  38  79.781  -5.425  11.471
  296    HE   ARG  38           HE       ARG  38  78.230  -4.423   9.521
  297   HH11  ARG  38          HH21      ARG  38  81.160  -6.282   9.433
  298   HH12  ARG  38          HH22      ARG  38  80.781  -7.051   7.930
  299   HH21  ARG  38          HH11      ARG  38  77.734  -5.445   7.561
  300   HH22  ARG  38          HH12      ARG  38  78.843  -6.586   6.876
  301    H    LYS  39           H        LYS  39  82.038  -0.981  13.080
  302    HA   LYS  39           HA       LYS  39  83.677   1.245  12.351
  303    HB2  LYS  39           HB2      LYS  39  83.722  -0.866  14.451
  304    HB3  LYS  39           HB3      LYS  39  85.244  -0.053  14.095
  305    HG2  LYS  39           HG2      LYS  39  82.765   1.601  14.491
  306    HG3  LYS  39           HG3      LYS  39  83.593   0.947  15.903
  307    HD2  LYS  39           HD2      LYS  39  85.727   1.974  15.052
  308    HD3  LYS  39           HD3      LYS  39  84.788   2.744  13.773
  309    HE2  LYS  39           HE2      LYS  39  83.524   4.029  15.344
  310    HE3  LYS  39           HE3      LYS  39  84.121   3.078  16.703
  311    HZ1  LYS  39           HZ1      LYS  39  85.973   4.282  16.814
  312    HZ2  LYS  39           HZ2      LYS  39  85.187   5.409  15.813
  313    HZ3  LYS  39           HZ3      LYS  39  86.220   4.243  15.136
  314    H    THR  40           H        THR  40  86.099   0.971  12.077
  315    HA   THR  40           HA       THR  40  86.615  -0.459   9.702
  316    HB   THR  40           HB       THR  40  89.041   0.134  10.253
  317    HG1  THR  40           HG1      THR  40  87.895   1.773  12.217
  318   HG21  THR  40          HG21      THR  40  88.452   2.663  10.093
  319   HG22  THR  40          HG22      THR  40  86.781   2.107  10.016
  320   HG23  THR  40          HG23      THR  40  87.937   1.599   8.784
  321    H    GLY  41           H        GLY  41  87.671  -2.336   9.262
  322    HA2  GLY  41           HA2      GLY  41  88.401  -4.483   9.581
  323    HA3  GLY  41           HA3      GLY  41  89.197  -3.877  11.030
  324    H    GLN  42           H        GLN  42  85.778  -4.300  10.095
  325    HA   GLN  42           HA       GLN  42  85.368  -5.779  12.634
  326    HB2  GLN  42           HB2      GLN  42  83.571  -3.915  11.095
  327    HB3  GLN  42           HB1      GLN  42  82.936  -5.032  12.301
  328    HG2  GLN  42           HG2      GLN  42  85.276  -3.316  13.048
  329    HG3  GLN  42           HG1      GLN  42  83.681  -2.572  12.975
  330   HE21  GLN  42          HE21      GLN  42  83.782  -5.962  13.801
  331   HE22  GLN  42          HE22      GLN  42  83.472  -5.765  15.458
  332    H    ALA  43           H        ALA  43  85.120  -5.952   9.193
  333    HA   ALA  43           HA       ALA  43  83.082  -7.890   8.973
  334    HB1  ALA  43           HB1      ALA  43  83.476  -7.600   6.785
  335    HB2  ALA  43           HB2      ALA  43  85.110  -8.239   6.944
  336    HB3  ALA  43           HB3      ALA  43  84.803  -6.524   7.221
  337    HA   PRO  44           HA       PRO  44  85.522 -11.248  10.715
  338    HB2  PRO  44           HB2      PRO  44  83.563 -13.111  10.821
  339    HB3  PRO  44           HB1      PRO  44  83.605 -11.730  11.936
  340    HG2  PRO  44           HG2      PRO  44  81.963 -12.129   9.479
  341    HG3  PRO  44           HG1      PRO  44  81.503 -11.429  11.041
  342    HD2  PRO  44           HD2      PRO  44  82.153  -9.928   8.813
  343    HD3  PRO  44           HD1      PRO  44  82.301  -9.341  10.486
  344    H    GLY  45           H        GLY  45  86.986 -12.063   9.276
  345    HA2  GLY  45           HA2      GLY  45  86.697 -14.352   7.848
  346    HA3  GLY  45           HA3      GLY  45  86.180 -13.118   6.705
  347    H    PHE  46           H        PHE  46  87.714 -11.359   6.242
  348    HA   PHE  46           HA       PHE  46  90.313 -12.398   5.686
  349    HB2  PHE  46           HB2      PHE  46  88.930 -10.614   4.394
  350    HB3  PHE  46           HB1      PHE  46  89.620  -9.474   5.549
  351    HD1  PHE  46           HD1      PHE  46  90.660 -12.283   3.287
  352    HD2  PHE  46           HD2      PHE  46  91.705  -8.522   5.080
  353    HE1  PHE  46           HE1      PHE  46  92.768 -12.246   1.982
  354    HE2  PHE  46           HE2      PHE  46  93.813  -8.485   3.774
  355    HZ   PHE  46           HZ       PHE  46  94.344 -10.347   2.225
  356    H    THR  47           H        THR  47  92.340 -11.553   6.409
  357    HA   THR  47           HA       THR  47  92.364 -10.987   9.252
  358    HB   THR  47           HB       THR  47  94.620 -11.292   7.259
  359    HG1  THR  47           HG1      THR  47  93.860 -13.263   7.478
  360   HG21  THR  47          HG21      THR  47  94.553 -10.966  10.261
  361   HG22  THR  47          HG22      THR  47  95.463 -10.017   9.085
  362   HG23  THR  47          HG23      THR  47  95.929 -11.684   9.423
  363    H    TYR  48           H        TYR  48  91.436  -8.907   9.335
  364    HA   TYR  48           HA       TYR  48  92.263  -6.676   7.848
  365    HB2  TYR  48           HB2      TYR  48  90.850  -7.082  10.447
  366    HB3  TYR  48           HB3      TYR  48  91.419  -5.463  10.058
  367    HD1  TYR  48           HD2      TYR  48  90.967  -4.743   7.527
  368    HD2  TYR  48           HD1      TYR  48  88.705  -7.657   9.722
  369    HE1  TYR  48           HE2      TYR  48  89.047  -4.394   6.006
  370    HE2  TYR  48           HE1      TYR  48  86.782  -7.301   8.203
  371    HH   TYR  48           HH       TYR  48  86.306  -4.793   6.400
  372    H    THR  49           H        THR  49  93.624  -4.942   8.350
  373    HA   THR  49           HA       THR  49  96.049  -5.716   9.745
  374    HB   THR  49           HB       THR  49  96.918  -3.568   8.928
  375    HG1  THR  49           HG1      THR  49  94.564  -2.739   9.111
  376   HG21  THR  49          HG21      THR  49  95.451  -5.414   7.069
  377   HG22  THR  49          HG22      THR  49  97.188  -5.192   7.280
  378   HG23  THR  49          HG23      THR  49  96.243  -3.981   6.416
  379    H    ASP  50           H        ASP  50  96.970  -4.581  11.507
  380    HA   ASP  50           HA       ASP  50  95.356  -4.038  13.663
  381    HB2  ASP  50           HB2      ASP  50  98.058  -2.844  13.001
  382    HB3  ASP  50           HB1      ASP  50  97.285  -2.732  14.582
  383    H    ALA  51           H        ALA  51  96.547  -1.748  11.228
  384    HA   ALA  51           HA       ALA  51  95.618   0.633  12.327
  385    HB1  ALA  51           HB1      ALA  51  95.733  -0.196   9.416
  386    HB2  ALA  51           HB2      ALA  51  97.016   0.595  10.333
  387    HB3  ALA  51           HB3      ALA  51  95.518   1.459   9.987
  388    H    ASN  52           H        ASN  52  93.903  -1.803  10.417
  389    HA   ASN  52           HA       ASN  52  91.433  -0.286  10.414
  390    HB2  ASN  52           HB2      ASN  52  92.375  -2.889   9.311
  391    HB3  ASN  52           HB1      ASN  52  90.649  -2.734   9.625
  392   HD21  ASN  52          HD21      ASN  52  90.352  -2.788   7.219
  393   HD22  ASN  52          HD22      ASN  52  90.624  -1.371   6.321
  394    H    LYS  53           H        LYS  53  92.991  -2.669  12.385
  395    HA   LYS  53           HA       LYS  53  90.566  -3.426  13.794
  396    HB2  LYS  53           HB2      LYS  53  91.794  -5.198  14.475
  397    HB3  LYS  53           HB3      LYS  53  93.059  -4.618  13.397
  398    HG2  LYS  53           HG2      LYS  53  93.946  -3.211  15.279
  399    HG3  LYS  53           HG3      LYS  53  92.747  -3.949  16.342
  400    HD2  LYS  53           HD2      LYS  53  94.289  -5.936  14.815
  401    HD3  LYS  53           HD3      LYS  53  95.297  -4.943  15.867
  402    HE2  LYS  53           HE2      LYS  53  94.463  -6.965  17.035
  403    HE3  LYS  53           HE3      LYS  53  93.869  -5.484  17.786
  404    HZ1  LYS  53           HZ1      LYS  53  92.039  -6.944  17.576
  405    HZ2  LYS  53           HZ2      LYS  53  92.403  -7.294  15.953
  406    HZ3  LYS  53           HZ3      LYS  53  91.837  -5.752  16.386
  407    H    ASN  54           H        ASN  54  92.805  -0.920  13.847
  408    HA   ASN  54           HA       ASN  54  92.942  -0.332  16.617
  409    HB2  ASN  54           HB2      ASN  54  94.070   1.555  15.963
  410    HB3  ASN  54           HB1      ASN  54  94.263   0.591  14.508
  411   HD21  ASN  54          HD21      ASN  54  91.574   0.912  13.475
  412   HD22  ASN  54          HD22      ASN  54  91.382   2.540  13.035
  413    H    LYS  55           H        LYS  55  90.493   0.002  14.279
  414    HA   LYS  55           HA       LYS  55  88.380   0.921  14.314
  415    HB2  LYS  55           HB2      LYS  55  88.501   1.171  17.296
  416    HB3  LYS  55           HB3      LYS  55  87.178   0.620  16.269
  417    HG2  LYS  55           HG2      LYS  55  88.810  -1.358  15.692
  418    HG3  LYS  55           HG3      LYS  55  89.616  -0.883  17.185
  419    HD2  LYS  55           HD2      LYS  55  88.000  -2.581  17.750
  420    HD3  LYS  55           HD3      LYS  55  87.389  -1.042  18.355
  421    HE2  LYS  55           HE2      LYS  55  85.626  -1.024  16.898
  422    HE3  LYS  55           HE3      LYS  55  86.572  -1.717  15.583
  423    HZ1  LYS  55           HZ1      LYS  55  86.483  -3.756  17.310
  424    HZ2  LYS  55           HZ2      LYS  55  85.384  -3.542  16.034
  425    HZ3  LYS  55           HZ3      LYS  55  84.977  -3.034  17.603
  426    H    GLY  56           H        GLY  56  89.835   2.796  13.468
  427    HA2  GLY  56           HA2      GLY  56  90.060   5.070  15.254
  428    HA3  GLY  56           HA3      GLY  56  90.514   5.025  13.554
  429    H    ILE  57           H        ILE  57  88.146   4.245  12.360
  430    HA   ILE  57           HA       ILE  57  86.109   6.171  13.242
  431    HB   ILE  57           HB       ILE  57  85.922   7.163  11.033
  432   HG12  ILE  57          HG12      ILE  57  87.891   6.580   9.413
  433   HG13  ILE  57          HG13      ILE  57  88.028   5.103  10.364
  434   HG21  ILE  57          HG21      ILE  57  88.835   7.140  11.864
  435   HG22  ILE  57          HG22      ILE  57  87.585   8.055  12.707
  436   HG23  ILE  57          HG23      ILE  57  87.974   8.434  11.029
  437   HD11  ILE  57          HD11      ILE  57  86.138   4.214   9.467
  438   HD12  ILE  57          HD12      ILE  57  86.366   5.413   8.201
  439   HD13  ILE  57          HD13      ILE  57  85.265   5.742   9.534
  440    H    THR  58           H        THR  58  84.134   5.974  11.718
  441    HA   THR  58           HA       THR  58  83.639   3.093  11.278
  442    HB   THR  58           HB       THR  58  81.728   5.334  11.965
  443    HG1  THR  58           HG1      THR  58  82.916   3.199  13.342
  444   HG21  THR  58          HG21      THR  58  81.266   2.412  11.338
  445   HG22  THR  58          HG22      THR  58  80.585   3.805  10.500
  446   HG23  THR  58          HG23      THR  58  80.077   3.431  12.146
  447    H    TRP  59           H        TRP  59  82.795   2.378   9.372
  448    HA   TRP  59           HA       TRP  59  83.181   3.934   7.037
  449    HB2  TRP  59           HB2      TRP  59  81.329   1.563   7.176
  450    HB3  TRP  59           HB1      TRP  59  82.327   2.105   5.827
  451    HD1  TRP  59           HD1      TRP  59  85.082   2.440   7.296
  452    HE1  TRP  59           HE1      TRP  59  86.369   0.350   8.097
  453    HE3  TRP  59           HE3      TRP  59  81.265  -0.936   7.524
  454    HZ2  TRP  59           HZ2      TRP  59  85.833  -2.380   8.783
  455    HZ3  TRP  59           HZ3      TRP  59  81.675  -3.265   8.246
  456    HH2  TRP  59           HH2      TRP  59  83.957  -3.992   8.871
  457    H    LYS  60           H        LYS  60  81.818   5.152   5.847
  458    HA   LYS  60           HA       LYS  60  78.958   5.162   6.307
  459    HB2  LYS  60           HB2      LYS  60  80.683   7.534   7.060
  460    HB3  LYS  60           HB3      LYS  60  78.939   7.629   6.820
  461    HG2  LYS  60           HG2      LYS  60  78.758   5.731   8.542
  462    HG3  LYS  60           HG3      LYS  60  80.445   6.071   8.926
  463    HD2  LYS  60           HD2      LYS  60  78.343   8.242   8.922
  464    HD3  LYS  60           HD3      LYS  60  78.683   7.271  10.354
  465    HE2  LYS  60           HE2      LYS  60  81.088   7.932  10.175
  466    HE3  LYS  60           HE3      LYS  60  80.659   9.001   8.840
  467    HZ1  LYS  60           HZ1      LYS  60  79.017  10.035  10.413
  468    HZ2  LYS  60           HZ2      LYS  60  80.654  10.319  10.771
  469    HZ3  LYS  60           HZ3      LYS  60  79.772   9.170  11.660
  470    H    GLU  61           H        GLU  61  78.352   7.577   5.076
  471    HA   GLU  61           HA       GLU  61  78.913   6.934   2.339
  472    HB2  GLU  61           HB2      GLU  61  76.784   8.011   3.273
  473    HB3  GLU  61           HB3      GLU  61  77.705   9.514   3.336
  474    HG2  GLU  61           HG2      GLU  61  78.221   9.267   0.914
  475    HG3  GLU  61           HG3      GLU  61  77.215   7.821   0.870
  476    H    GLU  62           H        GLU  62  79.612   9.846   4.297
  477    HA   GLU  62           HA       GLU  62  81.396  10.959   2.383
  478    HB2  GLU  62           HB2      GLU  62  80.954  11.505   5.321
  479    HB3  GLU  62           HB3      GLU  62  82.090  12.424   4.334
  480    HG2  GLU  62           HG2      GLU  62  79.191  12.062   3.554
  481    HG3  GLU  62           HG3      GLU  62  79.741  13.411   4.550
  482    H    THR  63           H        THR  63  81.929   9.134   5.391
  483    HA   THR  63           HA       THR  63  84.696   9.246   5.521
  484    HB   THR  63           HB       THR  63  84.578   7.079   6.696
  485    HG1  THR  63           HG1      THR  63  82.797   6.440   5.130
  486   HG21  THR  63          HG21      THR  63  82.789   7.764   8.363
  487   HG22  THR  63          HG22      THR  63  82.418   9.104   7.278
  488   HG23  THR  63          HG23      THR  63  84.015   8.983   8.016
  489    H    LEU  64           H        LEU  64  82.610   7.211   3.544
  490    HA   LEU  64           HA       LEU  64  84.690   5.576   2.497
  491    HB2  LEU  64           HB2      LEU  64  81.825   5.989   1.996
  492    HB3  LEU  64           HB3      LEU  64  82.742   5.545   0.563
  493    HG   LEU  64           HG       LEU  64  82.980   4.025   3.166
  494   HD11  LEU  64          HD11      LEU  64  80.808   4.041   1.203
  495   HD12  LEU  64          HD12      LEU  64  80.876   3.287   2.792
  496   HD13  LEU  64          HD13      LEU  64  81.529   2.443   1.388
  497   HD21  LEU  64          HD21      LEU  64  83.625   2.230   1.366
  498   HD22  LEU  64          HD22      LEU  64  84.809   3.463   1.790
  499   HD23  LEU  64          HD23      LEU  64  83.867   3.619   0.308
  500    H    MET  65           H        MET  65  83.284   8.670   1.559
  501    HA   MET  65           HA       MET  65  84.368   8.832  -1.037
  502    HB2  MET  65           HB2      MET  65  83.747  11.050   0.921
  503    HB3  MET  65           HB1      MET  65  84.078  11.278  -0.796
  504    HG2  MET  65           HG2      MET  65  82.142  10.005  -1.424
  505    HG3  MET  65           HG1      MET  65  81.884   9.474   0.236
  506    HE1  MET  65           HE1      MET  65  81.861  12.164  -2.335
  507    HE2  MET  65           HE2      MET  65  80.524  13.203  -1.845
  508    HE3  MET  65           HE3      MET  65  80.219  11.512  -2.233
  509    H    GLU  66           H        GLU  66  85.622  10.295   1.978
  510    HA   GLU  66           HA       GLU  66  88.053  11.181   0.862
  511    HB2  GLU  66           HB2      GLU  66  87.370  10.407   3.710
  512    HB3  GLU  66           HB3      GLU  66  88.855  11.231   3.228
  513    HG2  GLU  66           HG2      GLU  66  86.094  12.300   2.602
  514    HG3  GLU  66           HG3      GLU  66  87.002  12.761   4.041
  515    H    TYR  67           H        TYR  67  86.989   8.110   2.098
  516    HA   TYR  67           HA       TYR  67  89.615   6.913   2.188
  517    HB2  TYR  67           HB2      TYR  67  88.019   6.010   3.696
  518    HB3  TYR  67           HB3      TYR  67  86.804   5.861   2.435
  519    HD1  TYR  67           HD2      TYR  67  86.955   4.090   0.725
  520    HD2  TYR  67           HD1      TYR  67  89.793   4.370   3.939
  521    HE1  TYR  67           HE2      TYR  67  87.716   1.777   0.256
  522    HE2  TYR  67           HE1      TYR  67  90.551   2.056   3.471
  523    HH   TYR  67           HH       TYR  67  90.304   0.522   0.915
  524    H    LEU  68           H        LEU  68  87.069   7.320  -0.140
  525    HA   LEU  68           HA       LEU  68  88.020   5.268  -1.938
  526    HB2  LEU  68           HB2      LEU  68  85.797   7.247  -1.894
  527    HB3  LEU  68           HB3      LEU  68  86.347   6.721  -3.478
  528    HG   LEU  68           HG       LEU  68  85.560   4.837  -1.234
  529   HD11  LEU  68          HD11      LEU  68  83.543   5.857  -1.862
  530   HD12  LEU  68          HD12      LEU  68  83.591   4.419  -2.876
  531   HD13  LEU  68          HD13      LEU  68  84.015   5.992  -3.553
  532   HD21  LEU  68          HD21      LEU  68  85.317   3.422  -3.521
  533   HD22  LEU  68          HD22      LEU  68  86.807   3.469  -2.583
  534   HD23  LEU  68          HD23      LEU  68  86.622   4.504  -3.995
  535    H    GLU  69           H        GLU  69  88.863   8.507  -1.263
  536    HA   GLU  69           HA       GLU  69  90.043   8.917  -3.929
  537    HB2  GLU  69           HB2      GLU  69  89.990  11.171  -3.510
  538    HB3  GLU  69           HB3      GLU  69  88.698  10.680  -2.419
  539    HG2  GLU  69           HG2      GLU  69  90.544  10.425  -0.636
  540    HG3  GLU  69           HG3      GLU  69  91.563  11.344  -1.742
  541    H    ASN  70           H        ASN  70  90.839   7.745  -0.888
  542    HA   ASN  70           HA       ASN  70  93.569   7.320  -1.548
  543    HB2  ASN  70           HB2      ASN  70  93.349   9.852  -0.844
  544    HB3  ASN  70           HB1      ASN  70  93.316   9.186   0.785
  545   HD21  ASN  70          HD21      ASN  70  95.128   7.012   0.474
  546   HD22  ASN  70          HD22      ASN  70  96.668   7.632   0.118
  547    HA   PRO  71           HA       PRO  71  91.179   4.592   1.503
  548    HB2  PRO  71           HB2      PRO  71  92.940   2.725  -0.040
  549    HB3  PRO  71           HB1      PRO  71  91.267   2.504   0.507
  550    HG2  PRO  71           HG2      PRO  71  91.851   3.097  -2.031
  551    HG3  PRO  71           HG1      PRO  71  90.394   3.712  -1.235
  552    HD2  PRO  71           HD2      PRO  71  92.864   5.168  -2.003
  553    HD3  PRO  71           HD1      PRO  71  91.218   5.790  -1.756
  554    H    LYS  72           H        LYS  72  94.615   4.665   0.585
  555    HA   LYS  72           HA       LYS  72  95.485   3.353   2.987
  556    HB2  LYS  72           HB2      LYS  72  96.753   3.222   0.876
  557    HB3  LYS  72           HB3      LYS  72  97.068   4.951   0.966
  558    HG2  LYS  72           HG2      LYS  72  99.016   4.030   1.897
  559    HG3  LYS  72           HG3      LYS  72  98.060   4.426   3.320
  560    HD2  LYS  72           HD2      LYS  72  99.001   2.172   3.537
  561    HD3  LYS  72           HD3      LYS  72  97.248   2.080   3.413
  562    HE2  LYS  72           HE2      LYS  72  97.316   1.047   1.367
  563    HE3  LYS  72           HE3      LYS  72  98.732   1.958   0.838
  564    HZ1  LYS  72           HZ1      LYS  72  99.903   0.559   2.668
  565    HZ2  LYS  72           HZ2      LYS  72  99.608  -0.119   1.137
  566    HZ3  LYS  72           HZ3      LYS  72  98.594  -0.495   2.447
  567    H    LYS  73           H        LYS  73  95.635   6.726   1.835
  568    HA   LYS  73           HA       LYS  73  96.961   7.755   4.074
  569    HB2  LYS  73           HB2      LYS  73  96.659   8.966   1.922
  570    HB3  LYS  73           HB3      LYS  73  94.963   9.207   2.329
  571    HG2  LYS  73           HG2      LYS  73  96.876  10.009   4.450
  572    HG3  LYS  73           HG3      LYS  73  96.961  10.969   2.976
  573    HD2  LYS  73           HD2      LYS  73  94.279  10.377   4.211
  574    HD3  LYS  73           HD3      LYS  73  95.282  11.667   4.871
  575    HE2  LYS  73           HE2      LYS  73  95.430  12.684   2.607
  576    HE3  LYS  73           HE3      LYS  73  94.360  11.424   1.992
  577    HZ1  LYS  73           HZ1      LYS  73  93.720  13.786   3.465
  578    HZ2  LYS  73           HZ2      LYS  73  93.067  12.396   4.188
  579    HZ3  LYS  73           HZ3      LYS  73  92.704  12.766   2.570
  580    H    TYR  74           H        TYR  74  93.579   6.988   3.562
  581    HA   TYR  74           HA       TYR  74  92.538   8.485   5.737
  582    HB2  TYR  74           HB2      TYR  74  91.380   7.152   3.710
  583    HB3  TYR  74           HB3      TYR  74  91.205   5.933   4.971
  584    HD1  TYR  74           HD1      TYR  74  90.857   9.658   4.593
  585    HD2  TYR  74           HD2      TYR  74  89.256   6.033   6.254
  586    HE1  TYR  74           HE1      TYR  74  88.961  10.935   5.554
  587    HE2  TYR  74           HE2      TYR  74  87.362   7.311   7.216
  588    HH   TYR  74           HH       TYR  74  87.005  10.802   6.610
  589    H    ILE  75           H        ILE  75  93.222   4.991   5.460
  590    HA   ILE  75           HA       ILE  75  93.739   4.948   8.376
  591    HB   ILE  75           HB       ILE  75  92.417   2.729   6.797
  592   HG12  ILE  75          HG12      ILE  75  91.085   4.523   8.834
  593   HG13  ILE  75          HG13      ILE  75  91.077   4.919   7.116
  594   HG21  ILE  75          HG21      ILE  75  93.596   1.885   8.722
  595   HG22  ILE  75          HG22      ILE  75  91.886   1.946   9.149
  596   HG23  ILE  75          HG23      ILE  75  92.986   3.193   9.738
  597   HD11  ILE  75          HD11      ILE  75  89.965   2.833   6.578
  598   HD12  ILE  75          HD12      ILE  75  89.050   3.633   7.856
  599   HD13  ILE  75          HD13      ILE  75  90.109   2.279   8.247
  600    HA   PRO  76           HA       PRO  76  97.484   3.717   5.773
  601    HB2  PRO  76           HB2      PRO  76  98.543   4.522   8.465
  602    HB3  PRO  76           HB1      PRO  76  99.227   4.816   6.852
  603    HG2  PRO  76           HG2      PRO  76  97.932   6.729   8.181
  604    HG3  PRO  76           HG1      PRO  76  97.807   6.570   6.420
  605    HD2  PRO  76           HD2      PRO  76  95.773   5.968   8.501
  606    HD3  PRO  76           HD1      PRO  76  95.547   6.378   6.787
  607    H    GLY  77           H        GLY  77  98.102   1.639   5.697
  608    HA2  GLY  77           HA2      GLY  77  99.168  -0.236   6.894
  609    HA3  GLY  77           HA3      GLY  77  97.984   0.012   8.174
  610    H    THR  78           H        THR  78  95.803   0.530   6.284
  611    HA   THR  78           HA       THR  78  94.696  -2.016   6.064
  612    HB   THR  78           HB       THR  78  93.438   0.139   5.944
  613    HG1  THR  78           HG1      THR  78  92.222  -0.677   3.945
  614   HG21  THR  78          HG21      THR  78  94.310   0.173   3.053
  615   HG22  THR  78          HG22      THR  78  95.110   1.133   4.297
  616   HG23  THR  78          HG23      THR  78  93.408   1.410   3.928
  617    H    LYS  79           H        LYS  79  94.734  -3.608   4.545
  618    HA   LYS  79           HA       LYS  79  96.783  -3.427   2.489
  619    HB2  LYS  79           HB2      LYS  79  94.874  -5.652   3.246
  620    HB3  LYS  79           HB3      LYS  79  96.116  -5.786   2.003
  621    HG2  LYS  79           HG2      LYS  79  97.568  -4.802   4.130
  622    HG3  LYS  79           HG3      LYS  79  96.388  -5.827   4.944
  623    HD2  LYS  79           HD2      LYS  79  98.142  -6.713   2.633
  624    HD3  LYS  79           HD3      LYS  79  98.454  -7.071   4.331
  625    HE2  LYS  79           HE2      LYS  79  96.091  -8.089   4.377
  626    HE3  LYS  79           HE3      LYS  79  96.159  -8.027   2.617
  627    HZ1  LYS  79           HZ1      LYS  79  97.469  -9.796   2.575
  628    HZ2  LYS  79           HZ2      LYS  79  97.202  -9.986   4.243
  629    HZ3  LYS  79           HZ3      LYS  79  98.551  -9.113   3.689
  630    H    MET  80           H        MET  80  96.014  -1.905   1.008
  631    HA   MET  80           HA       MET  80  94.364  -2.918  -1.064
  632    HB2  MET  80           HB2      MET  80  92.496  -2.455   0.389
  633    HB3  MET  80           HB1      MET  80  93.114  -0.843   0.750
  634    HG2  MET  80           HG2      MET  80  92.645  -0.043  -1.420
  635    HG3  MET  80           HG1      MET  80  92.521  -1.669  -2.090
  636    HE1  MET  80           HE1      MET  80  90.565   1.309  -1.361
  637    HE2  MET  80           HE2      MET  80  89.069   0.576  -1.927
  638    HE3  MET  80           HE3      MET  80  90.549   0.368  -2.858
  639    H    ILE  81           H        ILE  81  95.947  -2.252  -2.447
  640    HA   ILE  81           HA       ILE  81  96.227   0.667  -2.803
  641    HB   ILE  81           HB       ILE  81  98.467  -1.371  -2.929
  642   HG12  ILE  81          HG12      ILE  81  99.314   0.391  -1.120
  643   HG13  ILE  81          HG13      ILE  81  97.589   0.681  -0.913
  644   HG21  ILE  81          HG21      ILE  81  98.324   1.586  -3.556
  645   HG22  ILE  81          HG22      ILE  81  98.844   0.280  -4.621
  646   HG23  ILE  81          HG23      ILE  81  99.845   0.747  -3.246
  647   HD11  ILE  81          HD11      ILE  81  99.208  -1.687  -0.178
  648   HD12  ILE  81          HD12      ILE  81  97.639  -2.050  -0.893
  649   HD13  ILE  81          HD13      ILE  81  97.737  -1.059   0.559
  650    H    PHE  82           H        PHE  82  94.908   0.764  -4.588
  651    HA   PHE  82           HA       PHE  82  95.872  -0.679  -6.985
  652    HB2  PHE  82           HB2      PHE  82  93.802  -1.740  -6.197
  653    HB3  PHE  82           HB1      PHE  82  92.984  -0.178  -6.222
  654    HD1  PHE  82           HD1      PHE  82  95.109  -2.285  -8.497
  655    HD2  PHE  82           HD2      PHE  82  91.714   0.322  -8.115
  656    HE1  PHE  82           HE1      PHE  82  94.599  -2.596 -10.902
  657    HE2  PHE  82           HE2      PHE  82  91.207   0.009 -10.522
  658    HZ   PHE  82           HZ       PHE  82  92.648  -1.450 -11.915
  659    H    ALA  83           H        ALA  83  93.323   1.731  -6.361
  660    HA   ALA  83           HA       ALA  83  94.757   3.933  -7.435
  661    HB1  ALA  83           HB1      ALA  83  94.453   2.587  -9.522
  662    HB2  ALA  83           HB2      ALA  83  93.678   4.169  -9.587
  663    HB3  ALA  83           HB3      ALA  83  92.709   2.723  -9.305
  664    H    GLY  84           H        GLY  84  93.886   5.490  -6.235
  665    HA2  GLY  84           HA2      GLY  84  91.296   5.366  -5.080
  666    HA3  GLY  84           HA3      GLY  84  92.345   6.780  -5.111
  667    H    ILE  85           H        ILE  85  89.810   7.395  -5.354
  668    HA   ILE  85           HA       ILE  85  88.991   7.429  -8.160
  669    HB   ILE  85           HB       ILE  85  87.710   8.465  -5.628
  670   HG12  ILE  85          HG12      ILE  85  87.895   5.906  -6.342
  671   HG13  ILE  85          HG13      ILE  85  86.399   6.545  -5.671
  672   HG21  ILE  85          HG21      ILE  85  86.869   8.652  -8.519
  673   HG22  ILE  85          HG22      ILE  85  86.922   9.932  -7.307
  674   HG23  ILE  85          HG23      ILE  85  85.684   8.679  -7.215
  675   HD11  ILE  85          HD11      ILE  85  86.883   6.571  -8.645
  676   HD12  ILE  85          HD12      ILE  85  85.351   6.660  -7.775
  677   HD13  ILE  85          HD13      ILE  85  86.242   5.139  -7.839
  678    H    LYS  86           H        LYS  86  88.406   9.472  -9.214
  679    HA   LYS  86           HA       LYS  86  90.369  11.564  -8.572
  680    HB2  LYS  86           HB2      LYS  86  88.799  10.894 -11.057
  681    HB3  LYS  86           HB3      LYS  86  89.698  12.402 -10.887
  682    HG2  LYS  86           HG2      LYS  86  91.777  11.238 -10.623
  683    HG3  LYS  86           HG3      LYS  86  90.957   9.686 -10.445
  684    HD2  LYS  86           HD2      LYS  86  90.287   9.663 -12.735
  685    HD3  LYS  86           HD3      LYS  86  90.718  11.360 -12.951
  686    HE2  LYS  86           HE2      LYS  86  93.047  10.895 -12.827
  687    HE3  LYS  86           HE3      LYS  86  92.767   9.277 -12.184
  688    HZ1  LYS  86           HZ1      LYS  86  91.887   8.567 -14.251
  689    HZ2  LYS  86           HZ2      LYS  86  93.353   9.356 -14.586
  690    HZ3  LYS  86           HZ3      LYS  86  91.876  10.143 -14.875
  691    H    LYS  87           H        LYS  87  87.108  11.696 -10.035
  692    HA   LYS  87           HA       LYS  87  86.641  14.279  -8.811
  693    HB2  LYS  87           HB2      LYS  87  84.799  12.534 -10.460
  694    HB3  LYS  87           HB3      LYS  87  84.515  14.221 -10.032
  695    HG2  LYS  87           HG2      LYS  87  87.068  13.459 -11.431
  696    HG3  LYS  87           HG3      LYS  87  85.585  13.633 -12.366
  697    HD2  LYS  87           HD2      LYS  87  85.291  15.919 -11.369
  698    HD3  LYS  87           HD3      LYS  87  86.873  15.740 -10.608
  699    HE2  LYS  87           HE2      LYS  87  87.974  15.592 -12.737
  700    HE3  LYS  87           HE3      LYS  87  86.436  15.444 -13.588
  701    HZ1  LYS  87           HZ1      LYS  87  86.111  17.638 -13.538
  702    HZ2  LYS  87           HZ2      LYS  87  87.772  17.753 -13.195
  703    HZ3  LYS  87           HZ3      LYS  87  86.636  17.791 -11.932
  704    H    LYS  88           H        LYS  88  84.716  14.774  -7.560
  705    HA   LYS  88           HA       LYS  88  84.386  12.974  -5.361
  706    HB2  LYS  88           HB2      LYS  88  84.236  15.541  -5.322
  707    HB3  LYS  88           HB3      LYS  88  82.601  15.332  -5.952
  708    HG2  LYS  88           HG2      LYS  88  82.022  13.910  -4.031
  709    HG3  LYS  88           HG3      LYS  88  83.663  14.066  -3.407
  710    HD2  LYS  88           HD2      LYS  88  82.609  15.738  -2.191
  711    HD3  LYS  88           HD3      LYS  88  83.134  16.665  -3.596
  712    HE2  LYS  88           HE2      LYS  88  80.914  16.301  -4.646
  713    HE3  LYS  88           HE3      LYS  88  80.392  15.426  -3.206
  714    HZ1  LYS  88           HZ1      LYS  88  81.223  17.606  -2.043
  715    HZ2  LYS  88           HZ2      LYS  88  79.661  17.505  -2.704
  716    HZ3  LYS  88           HZ3      LYS  88  80.901  18.286  -3.563
  717    H    THR  89           H        THR  89  82.441  13.848  -8.186
  718    HA   THR  89           HA       THR  89  80.084  12.485  -7.415
  719    HB   THR  89           HB       THR  89  79.572  12.466  -9.860
  720    HG1  THR  89           HG1      THR  89  81.753  12.261 -10.547
  721   HG21  THR  89          HG21      THR  89  79.509  14.936 -10.075
  722   HG22  THR  89          HG22      THR  89  80.613  15.069  -8.706
  723   HG23  THR  89          HG23      THR  89  78.997  14.404  -8.473
  724    H    GLU  90           H        GLU  90  83.115  11.413  -8.752
  725    HA   GLU  90           HA       GLU  90  82.227   8.878  -9.704
  726    HB2  GLU  90           HB2      GLU  90  84.906  10.018  -8.937
  727    HB3  GLU  90           HB3      GLU  90  84.737   8.303  -9.312
  728    HG2  GLU  90           HG2      GLU  90  83.865   8.812 -11.514
  729    HG3  GLU  90           HG3      GLU  90  83.827  10.535 -11.144
  730    H    ARG  91           H        ARG  91  83.335  10.139  -6.625
  731    HA   ARG  91           HA       ARG  91  83.401   7.587  -5.294
  732    HB2  ARG  91           HB2      ARG  91  83.289  10.388  -4.139
  733    HB3  ARG  91           HB3      ARG  91  83.700   8.917  -3.259
  734    HG2  ARG  91           HG2      ARG  91  85.598   8.576  -4.879
  735    HG3  ARG  91           HG3      ARG  91  85.249  10.174  -5.533
  736    HD2  ARG  91           HD2      ARG  91  85.445  10.204  -2.614
  737    HD3  ARG  91           HD3      ARG  91  86.923   9.626  -3.373
  738    HE   ARG  91           HE       ARG  91  86.298  11.853  -4.820
  739   HH11  ARG  91          HH21      ARG  91  86.649  11.138  -1.449
  740   HH12  ARG  91          HH22      ARG  91  87.179  12.732  -1.028
  741   HH21  ARG  91          HH11      ARG  91  86.993  13.941  -4.270
  742   HH22  ARG  91          HH12      ARG  91  87.376  14.317  -2.623
  743    H    GLU  92           H        GLU  92  81.223  10.407  -5.266
  744    HA   GLU  92           HA       GLU  92  79.305   9.403  -3.495
  745    HB2  GLU  92           HB2      GLU  92  79.466  11.759  -4.451
  746    HB3  GLU  92           HB3      GLU  92  78.671  11.129  -5.894
  747    HG2  GLU  92           HG2      GLU  92  76.797  10.316  -4.464
  748    HG3  GLU  92           HG3      GLU  92  77.575  11.060  -3.069
  749    H    ASP  93           H        ASP  93  79.306   9.292  -7.072
  750    HA   ASP  93           HA       ASP  93  76.994   7.721  -7.353
  751    HB2  ASP  93           HB2      ASP  93  79.432   7.753  -9.149
  752    HB3  ASP  93           HB1      ASP  93  77.813   7.217  -9.595
  753    H    LEU  94           H        LEU  94  80.417   6.787  -7.139
  754    HA   LEU  94           HA       LEU  94  80.073   4.010  -7.394
  755    HB2  LEU  94           HB2      LEU  94  82.283   5.038  -7.533
  756    HB3  LEU  94           HB3      LEU  94  82.156   5.569  -5.858
  757    HG   LEU  94           HG       LEU  94  82.106   3.269  -5.075
  758   HD11  LEU  94          HD11      LEU  94  80.981   2.022  -6.695
  759   HD12  LEU  94          HD12      LEU  94  82.648   1.513  -6.950
  760   HD13  LEU  94          HD13      LEU  94  81.919   2.709  -8.022
  761   HD21  LEU  94          HD21      LEU  94  84.302   4.452  -5.660
  762   HD22  LEU  94          HD22      LEU  94  84.323   3.465  -7.121
  763   HD23  LEU  94          HD23      LEU  94  84.369   2.695  -5.537
  764    H    ILE  95           H        ILE  95  79.817   6.171  -4.646
  765    HA   ILE  95           HA       ILE  95  79.610   4.057  -2.731
  766    HB   ILE  95           HB       ILE  95  79.295   7.035  -2.627
  767   HG12  ILE  95          HG12      ILE  95  80.989   5.440  -0.763
  768   HG13  ILE  95          HG13      ILE  95  81.464   5.411  -2.454
  769   HG21  ILE  95          HG21      ILE  95  77.570   6.404  -1.127
  770   HG22  ILE  95          HG22      ILE  95  78.980   6.623  -0.091
  771   HG23  ILE  95          HG23      ILE  95  78.469   4.999  -0.555
  772   HD11  ILE  95          HD11      ILE  95  82.250   7.334  -0.705
  773   HD12  ILE  95          HD12      ILE  95  80.811   8.092  -1.376
  774   HD13  ILE  95          HD13      ILE  95  82.119   7.588  -2.441
  775    H    ALA  96           H        ALA  96  77.398   5.904  -4.686
  776    HA   ALA  96           HA       ALA  96  75.013   5.328  -3.267
  777    HB1  ALA  96           HB1      ALA  96  73.963   5.651  -5.596
  778    HB2  ALA  96           HB2      ALA  96  75.601   5.995  -6.150
  779    HB3  ALA  96           HB3      ALA  96  74.854   7.014  -4.920
  780    H    TYR  97           H        TYR  97  76.903   3.602  -5.678
  781    HA   TYR  97           HA       TYR  97  75.002   1.478  -6.027
  782    HB2  TYR  97           HB2      TYR  97  76.555   1.866  -7.820
  783    HB3  TYR  97           HB3      TYR  97  77.934   1.730  -6.728
  784    HD1  TYR  97           HD1      TYR  97  75.039  -0.188  -8.110
  785    HD2  TYR  97           HD2      TYR  97  78.921  -0.374  -6.284
  786    HE1  TYR  97           HE1      TYR  97  75.095  -2.638  -8.481
  787    HE2  TYR  97           HE2      TYR  97  78.977  -2.826  -6.655
  788    HH   TYR  97           HH       TYR  97  77.850  -4.603  -7.360
  789    H    LEU  98           H        LEU  98  78.169   1.715  -4.380
  790    HA   LEU  98           HA       LEU  98  78.311  -0.764  -3.217
  791    HB2  LEU  98           HB2      LEU  98  79.162   1.955  -2.263
  792    HB3  LEU  98           HB3      LEU  98  79.395   0.550  -1.230
  793    HG   LEU  98           HG       LEU  98  80.306   0.416  -4.093
  794   HD11  LEU  98          HD11      LEU  98  81.209   2.548  -3.061
  795   HD12  LEU  98          HD12      LEU  98  82.431   1.390  -3.570
  796   HD13  LEU  98          HD13      LEU  98  82.015   1.536  -1.864
  797   HD21  LEU  98          HD21      LEU  98  81.526  -0.677  -1.552
  798   HD22  LEU  98          HD22      LEU  98  81.849  -1.193  -3.207
  799   HD23  LEU  98          HD23      LEU  98  80.288  -1.541  -2.460
  800    H    LYS  99           H        LYS  99  76.111   1.820  -2.505
  801    HA   LYS  99           HA       LYS  99  75.310   0.828   0.076
  802    HB2  LYS  99           HB2      LYS  99  74.303   2.969  -1.772
  803    HB3  LYS  99           HB3      LYS  99  73.346   2.471  -0.378
  804    HG2  LYS  99           HG2      LYS  99  75.157   3.012   1.140
  805    HG3  LYS  99           HG3      LYS  99  76.247   3.333  -0.209
  806    HD2  LYS  99           HD2      LYS  99  75.396   5.447   0.688
  807    HD3  LYS  99           HD3      LYS  99  74.768   5.191  -0.938
  808    HE2  LYS  99           HE2      LYS  99  72.617   4.676  -0.170
  809    HE3  LYS  99           HE3      LYS  99  73.189   4.241   1.440
  810    HZ1  LYS  99           HZ1      LYS  99  73.853   6.927   0.840
  811    HZ2  LYS  99           HZ2      LYS  99  72.914   6.315   2.118
  812    HZ3  LYS  99           HZ3      LYS  99  72.188   6.681   0.625
  813    H    LYS 100           H        LYS 100  73.858   0.814  -3.181
  814    HA   LYS 100           HA       LYS 100  71.638  -0.822  -2.300
  815    HB2  LYS 100           HB2      LYS 100  71.643   0.914  -4.211
  816    HB3  LYS 100           HB3      LYS 100  72.417  -0.347  -5.170
  817    HG2  LYS 100           HG2      LYS 100  70.393  -1.800  -4.139
  818    HG3  LYS 100           HG3      LYS 100  69.631  -0.211  -4.102
  819    HD2  LYS 100           HD2      LYS 100  69.057  -0.953  -6.240
  820    HD3  LYS 100           HD3      LYS 100  70.522  -0.031  -6.571
  821    HE2  LYS 100           HE2      LYS 100  71.750  -2.305  -6.183
  822    HE3  LYS 100           HE3      LYS 100  70.160  -3.018  -6.449
  823    HZ1  LYS 100           HZ1      LYS 100  71.970  -1.875  -8.336
  824    HZ2  LYS 100           HZ2      LYS 100  70.427  -1.172  -8.445
  825    HZ3  LYS 100           HZ3      LYS 100  70.611  -2.854  -8.603
  826    H    ALA 101           H        ALA 101  74.836  -1.398  -3.313
  827    HA   ALA 101           HA       ALA 101  74.327  -4.056  -4.379
  828    HB1  ALA 101           HB1      ALA 101  76.637  -4.132  -4.882
  829    HB2  ALA 101           HB2      ALA 101  77.020  -2.887  -3.693
  830    HB3  ALA 101           HB3      ALA 101  76.168  -2.458  -5.176
  831    H    THR 102           H        THR 102  75.413  -2.547  -1.409
  832    HA   THR 102           HA       THR 102  76.154  -5.104  -0.205
  833    HB   THR 102           HB       THR 102  76.632  -3.691   1.797
  834    HG1  THR 102           HG1      THR 102  75.377  -1.851   0.140
  835   HG21  THR 102          HG21      THR 102  77.806  -2.929  -0.881
  836   HG22  THR 102          HG22      THR 102  78.456  -4.056   0.308
  837   HG23  THR 102          HG23      THR 102  78.454  -2.325   0.644
  838    H    ASN 103           H        ASN 103  73.358  -3.508  -0.843
  839    HA   ASN 103           HA       ASN 103  71.983  -4.232   1.647
  840    HB2  ASN 103           HB2      ASN 103  71.276  -2.566  -0.757
  841    HB3  ASN 103           HB1      ASN 103  70.039  -3.103   0.371
  842   HD21  ASN 103          HD21      ASN 103  73.305  -2.393   1.491
  843   HD22  ASN 103          HD22      ASN 103  72.895  -0.977   2.331
  844    H    GLU 104           H        GLU 104  72.438  -5.256  -1.619
  845    HA   GLU 104           HA       GLU 104  70.236  -6.632  -2.373
  846    HB2  GLU 104           HB2      GLU 104  73.092  -7.630  -2.446
  847    HB3  GLU 104           HB3      GLU 104  71.761  -8.359  -3.344
  848    HG2  GLU 104           HG2      GLU 104  71.382  -6.299  -4.568
  849    HG3  GLU 104           HG3      GLU 104  72.573  -5.451  -3.584
  850    HHA  HEC 201           HA       HEC 105  89.372  -3.520   3.206
  851    HHB  HEC 201           HB       HEC 105  85.547  -0.020  -0.412
  852    HHC  HEC 201           HC       HEC 105  88.853  -1.732  -5.528
  853    HHD  HEC 201           HD       HEC 105  92.232  -5.736  -1.982
  854   HMA1  HEC 201          HMA1      HEC 105  85.111  -0.531   3.288
  855   HMA2  HEC 201          HMA2      HEC 105  84.605  -0.296   1.618
  856   HMA3  HEC 201          HMA3      HEC 105  85.751   0.823   2.356
  857   HAA1  HEC 201          HAA1      HEC 105  86.946  -0.961   4.505
  858   HAA2  HEC 201          HAA2      HEC 105  88.411  -1.921   4.463
  859   HBA1  HEC 201          HBA1      HEC 105  87.278  -3.919   4.706
  860   HBA2  HEC 201          HBA2      HEC 105  85.804  -3.302   3.967
  861   HMB1  HEC 201          HMB1      HEC 105  84.141   0.152  -2.684
  862   HMB2  HEC 201          HMB2      HEC 105  84.837   1.185  -3.926
  863   HMB3  HEC 201          HMB3      HEC 105  85.150   1.522  -2.228
  864    HAB  HEC 201           HAB      HEC 105  87.374  -0.504  -6.176
  865   HBB1  HEC 201          HBB1      HEC 105  86.703   2.024  -4.719
  866   HBB2  HEC 201          HBB2      HEC 105  87.981   1.712  -5.887
  867   HBB3  HEC 201          HBB3      HEC 105  86.318   1.916  -6.435
  868   HMC1  HEC 201          HMC1      HEC 105  91.229  -4.288  -6.912
  869   HMC2  HEC 201          HMC2      HEC 105  91.424  -2.558  -6.635
  870   HMC3  HEC 201          HMC3      HEC 105  89.817  -3.239  -6.873
  871    HAC  HEC 201           HAC      HEC 105  92.696  -6.135  -3.906
  872   HBC1  HEC 201          HBC1      HEC 105  93.251  -3.981  -5.871
  873   HBC2  HEC 201          HBC2      HEC 105  93.710  -5.607  -6.377
  874   HBC3  HEC 201          HBC3      HEC 105  94.369  -4.926  -4.890
  875   HMD1  HEC 201          HMD1      HEC 105  93.349  -6.468   1.515
  876   HMD2  HEC 201          HMD2      HEC 105  93.445  -6.280  -0.232
  877   HMD3  HEC 201          HMD3      HEC 105  92.354  -7.476   0.466
  878   HAD1  HEC 201          HAD1      HEC 105  91.954  -6.274   3.189
  879   HAD2  HEC 201          HAD2      HEC 105  90.451  -5.526   3.692
  880   HBD1  HEC 201          HBD1      HEC 105  91.610  -3.350   3.891
  881   HBD2  HEC 201          HBD2      HEC 105  93.122  -4.128   3.431
  882    H1   HOH 301           H2       HOH 200  79.817   3.508  -0.676
  883    H2   HOH 301           H1       HOH 200  80.634   2.237  -0.583
  884    H1   HOH 302           H2       HOH 201  87.206   5.614   6.164
  885    H2   HOH 302           H1       HOH 201  86.239   5.345   5.033
  886    H1   HOH 303           H2       HOH 202  81.161  -6.170   5.300
  887    H2   HOH 303           H1       HOH 202  81.797  -6.485   6.638
  888    H1   HOH 304           H2       HOH 203  82.257 -11.157   0.502
  889    H2   HOH 304           H1       HOH 203  81.350  -9.994   0.169
  Start of MODEL   28
    1    H1   GLY   1           H1       GLY   1  74.819  11.974  -6.662
    2    H2   GLY   1           H2       GLY   1  73.174  11.612  -6.450
    3    H3   GLY   1           H3       GLY   1  73.833  11.697  -8.013
    4    HA2  GLY   1           HA2      GLY   1  75.419   9.842  -6.991
    5    HA3  GLY   1           HA3      GLY   1  73.951   9.549  -6.056
    6    H    ASP   2           H        ASP   2  75.372   8.150  -8.407
    7    HA   ASP   2           HA       ASP   2  72.910   7.665  -9.959
    8    HB2  ASP   2           HB2      ASP   2  75.662   8.139 -11.122
    9    HB3  ASP   2           HB1      ASP   2  74.274   7.537 -12.028
   10    H    VAL   3           H        VAL   3  72.718   5.770  -8.685
   11    HA   VAL   3           HA       VAL   3  74.550   3.795  -8.193
   12    HB   VAL   3           HB       VAL   3  72.265   3.678  -7.364
   13   HG11  VAL   3          HG11      VAL   3  70.407   3.114  -8.878
   14   HG12  VAL   3          HG12      VAL   3  71.510   3.142 -10.254
   15   HG13  VAL   3          HG13      VAL   3  71.165   4.628  -9.368
   16   HG21  VAL   3          HG21      VAL   3  72.701   1.334  -9.230
   17   HG22  VAL   3          HG22      VAL   3  71.890   1.327  -7.664
   18   HG23  VAL   3          HG23      VAL   3  73.633   1.568  -7.753
   19    H    GLU   4           H        GLU   4  73.323   4.810 -11.245
   20    HA   GLU   4           HA       GLU   4  73.819   2.375 -12.677
   21    HB2  GLU   4           HB2      GLU   4  73.690   5.174 -13.811
   22    HB3  GLU   4           HB3      GLU   4  73.388   3.657 -14.659
   23    HG2  GLU   4           HG2      GLU   4  71.508   3.254 -12.976
   24    HG3  GLU   4           HG3      GLU   4  71.711   4.938 -12.494
   25    H    LYS   5           H        LYS   5  75.523   5.521 -12.701
   26    HA   LYS   5           HA       LYS   5  77.802   4.428 -14.056
   27    HB2  LYS   5           HB2      LYS   5  77.352   7.040 -12.595
   28    HB3  LYS   5           HB3      LYS   5  78.851   6.643 -13.433
   29    HG2  LYS   5           HG2      LYS   5  77.581   6.309 -15.533
   30    HG3  LYS   5           HG3      LYS   5  76.094   6.749 -14.692
   31    HD2  LYS   5           HD2      LYS   5  78.525   8.542 -14.974
   32    HD3  LYS   5           HD3      LYS   5  77.056   8.671 -15.941
   33    HE2  LYS   5           HE2      LYS   5  75.885   8.772 -13.562
   34    HE3  LYS   5           HE3      LYS   5  77.481   9.316 -13.044
   35    HZ1  LYS   5           HZ1      LYS   5  75.720  11.010 -13.900
   36    HZ2  LYS   5           HZ2      LYS   5  76.274  10.523 -15.431
   37    HZ3  LYS   5           HZ3      LYS   5  77.356  11.197 -14.307
   38    H    GLY   6           H        GLY   6  76.742   4.536 -10.808
   39    HA2  GLY   6           HA2      GLY   6  79.311   4.373  -9.540
   40    HA3  GLY   6           HA3      GLY   6  77.757   3.964  -8.806
   41    H    LYS   7           H        LYS   7  76.959   2.140 -10.858
   42    HA   LYS   7           HA       LYS   7  78.145  -0.258  -9.880
   43    HB2  LYS   7           HB2      LYS   7  75.785  -0.032 -10.728
   44    HB3  LYS   7           HB3      LYS   7  76.447   0.080 -12.358
   45    HG2  LYS   7           HG2      LYS   7  77.598  -2.120 -11.974
   46    HG3  LYS   7           HG3      LYS   7  76.751  -2.240 -10.434
   47    HD2  LYS   7           HD2      LYS   7  75.291  -3.415 -11.811
   48    HD3  LYS   7           HD3      LYS   7  74.610  -1.794 -11.926
   49    HE2  LYS   7           HE2      LYS   7  75.815  -1.400 -14.018
   50    HE3  LYS   7           HE3      LYS   7  76.602  -2.973 -13.887
   51    HZ1  LYS   7           HZ1      LYS   7  74.015  -2.334 -14.878
   52    HZ2  LYS   7           HZ2      LYS   7  73.917  -3.481 -13.629
   53    HZ3  LYS   7           HZ3      LYS   7  74.881  -3.788 -14.993
   54    H    LYS   8           H        LYS   8  78.400   1.576 -12.922
   55    HA   LYS   8           HA       LYS   8  80.055  -0.223 -14.309
   56    HB2  LYS   8           HB2      LYS   8  78.986   1.645 -15.433
   57    HB3  LYS   8           HB3      LYS   8  79.909   2.795 -14.466
   58    HG2  LYS   8           HG2      LYS   8  81.567   0.790 -15.878
   59    HG3  LYS   8           HG3      LYS   8  80.680   1.877 -16.945
   60    HD2  LYS   8           HD2      LYS   8  82.199   2.999 -14.598
   61    HD3  LYS   8           HD3      LYS   8  83.053   2.588 -16.085
   62    HE2  LYS   8           HE2      LYS   8  80.562   4.289 -16.142
   63    HE3  LYS   8           HE3      LYS   8  82.150   5.001 -15.857
   64    HZ1  LYS   8           HZ1      LYS   8  82.554   4.909 -18.015
   65    HZ2  LYS   8           HZ2      LYS   8  81.011   4.255 -18.293
   66    HZ3  LYS   8           HZ3      LYS   8  82.336   3.227 -18.018
   67    H    ILE   9           H        ILE   9  80.884   2.502 -12.186
   68    HA   ILE   9           HA       ILE   9  83.699   2.229 -12.443
   69    HB   ILE   9           HB       ILE   9  82.049   3.465 -10.230
   70   HG12  ILE   9          HG12      ILE   9  83.501   4.878 -12.475
   71   HG13  ILE   9          HG13      ILE   9  81.837   4.322 -12.665
   72   HG21  ILE   9          HG21      ILE   9  84.201   4.767  -9.872
   73   HG22  ILE   9          HG22      ILE   9  84.992   3.598 -10.928
   74   HG23  ILE   9          HG23      ILE   9  84.270   3.067  -9.409
   75   HD11  ILE   9          HD11      ILE   9  82.017   6.706 -11.886
   76   HD12  ILE   9          HD12      ILE   9  82.771   6.112 -10.405
   77   HD13  ILE   9          HD13      ILE   9  81.107   5.669 -10.787
   78    H    PHE  10           H        PHE  10  81.319   0.558 -10.577
   79    HA   PHE  10           HA       PHE  10  83.180  -0.431  -8.595
   80    HB2  PHE  10           HB2      PHE  10  81.045  -0.310  -7.704
   81    HB3  PHE  10           HB1      PHE  10  80.278  -0.835  -9.201
   82    HD1  PHE  10           HD1      PHE  10  80.221  -3.207  -9.829
   83    HD2  PHE  10           HD2      PHE  10  81.970  -1.919  -6.129
   84    HE1  PHE  10           HE1      PHE  10  80.220  -5.549  -9.019
   85    HE2  PHE  10           HE2      PHE  10  81.972  -4.262  -5.315
   86    HZ   PHE  10           HZ       PHE  10  81.097  -6.078  -6.764
   87    H    VAL  11           H        VAL  11  81.354  -1.932 -11.278
   88    HA   VAL  11           HA       VAL  11  82.352  -4.512 -11.048
   89    HB   VAL  11           HB       VAL  11  81.819  -4.756 -13.461
   90   HG11  VAL  11          HG11      VAL  11  80.093  -4.744 -11.568
   91   HG12  VAL  11          HG12      VAL  11  79.477  -4.442 -13.193
   92   HG13  VAL  11          HG13      VAL  11  79.709  -3.101 -12.075
   93   HG21  VAL  11          HG21      VAL  11  81.285  -1.782 -13.262
   94   HG22  VAL  11          HG22      VAL  11  80.926  -2.794 -14.659
   95   HG23  VAL  11          HG23      VAL  11  82.600  -2.520 -14.173
   96    H    GLN  12           H        GLN  12  83.823  -1.674 -12.477
   97    HA   GLN  12           HA       GLN  12  86.020  -3.294 -13.555
   98    HB2  GLN  12           HB2      GLN  12  86.729  -1.299 -14.684
   99    HB3  GLN  12           HB1      GLN  12  84.988  -1.476 -14.905
  100    HG2  GLN  12           HG2      GLN  12  84.659   0.077 -12.945
  101    HG3  GLN  12           HG1      GLN  12  86.402   0.357 -12.949
  102   HE21  GLN  12          HE21      GLN  12  86.005  -0.100 -16.091
  103   HE22  GLN  12          HE22      GLN  12  85.581   1.457 -16.610
  104    H    LYS  13           H        LYS  13  85.378  -1.155 -10.856
  105    HA   LYS  13           HA       LYS  13  88.265  -0.961 -10.304
  106    HB2  LYS  13           HB2      LYS  13  86.595   1.029 -10.300
  107    HB3  LYS  13           HB3      LYS  13  86.167   0.443  -8.694
  108    HG2  LYS  13           HG2      LYS  13  87.900   1.901  -8.165
  109    HG3  LYS  13           HG3      LYS  13  88.800   0.400  -8.363
  110    HD2  LYS  13           HD2      LYS  13  90.048   1.854  -9.692
  111    HD3  LYS  13           HD3      LYS  13  88.946   1.171 -10.886
  112    HE2  LYS  13           HE2      LYS  13  88.785   3.481 -11.290
  113    HE3  LYS  13           HE3      LYS  13  87.395   3.173 -10.251
  114    HZ1  LYS  13           HZ1      LYS  13  89.416   4.967  -9.791
  115    HZ2  LYS  13           HZ2      LYS  13  89.748   3.683  -8.731
  116    HZ3  LYS  13           HZ3      LYS  13  88.240   4.465  -8.677
  117    H    CYS  14           H        CYS  14  85.370  -1.452  -8.217
  118    HA   CYS  14           HA       CYS  14  87.061  -2.704  -6.230
  119    HB2  CYS  14           HB2      CYS  14  84.090  -2.610  -6.002
  120    HB3  CYS  14           HB1      CYS  14  85.309  -2.451  -4.744
  121    H    ALA  15           H        ALA  15  84.572  -3.875  -8.465
  122    HA   ALA  15           HA       ALA  15  84.026  -6.341  -7.378
  123    HB1  ALA  15           HB1      ALA  15  82.845  -5.913  -9.329
  124    HB2  ALA  15           HB2      ALA  15  84.012  -7.110  -9.889
  125    HB3  ALA  15           HB3      ALA  15  84.284  -5.398 -10.208
  126    H    GLN  16           H        GLN  16  86.992  -5.235  -8.803
  127    HA   GLN  16           HA       GLN  16  88.307  -7.503  -9.571
  128    HB2  GLN  16           HB2      GLN  16  89.310  -5.099  -8.061
  129    HB3  GLN  16           HB1      GLN  16  90.393  -6.368  -8.630
  130    HG2  GLN  16           HG2      GLN  16  89.689  -6.011 -10.927
  131    HG3  GLN  16           HG1      GLN  16  88.462  -4.855 -10.410
  132   HE21  GLN  16          HE21      GLN  16  91.940  -5.310 -10.890
  133   HE22  GLN  16          HE22      GLN  16  92.354  -3.675 -10.702
  134    H    CYS  17           H        CYS  17  88.615  -6.202  -6.234
  135    HA   CYS  17           HA       CYS  17  88.975  -8.998  -5.312
  136    HB2  CYS  17           HB2      CYS  17  90.134  -6.873  -3.623
  137    HB3  CYS  17           HB1      CYS  17  90.814  -8.420  -4.114
  138    H    HIS  18           H        HSD  18  86.385  -8.063  -5.372
  139    HA   HIS  18           HA       HSD  18  85.748  -8.089  -2.537
  140    HB2  HIS  18           HB2      HSD  18  85.171  -5.705  -4.279
  141    HB3  HIS  18           HB1      HSD  18  84.156  -6.084  -2.889
  142    HD1  HIS  18           HD1      HSD  18  86.646  -7.185  -1.139
  143    HD2  HIS  18           HD2      HSD  18  86.371  -3.476  -3.015
  144    HE1  HIS  18           HE1      HSD  18  88.243  -5.643   0.082
  145    H    THR  19           H        THR  19  83.174  -7.704  -2.409
  146    HA   THR  19           HA       THR  19  81.869  -9.199  -4.588
  147    HB   THR  19           HB       THR  19  80.755 -10.087  -2.120
  148    HG1  THR  19           HG1      THR  19  83.133 -11.127  -1.825
  149   HG21  THR  19          HG21      THR  19  81.619 -12.284  -2.919
  150   HG22  THR  19          HG22      THR  19  82.540 -11.438  -4.161
  151   HG23  THR  19          HG23      THR  19  80.777 -11.387  -4.181
  152    H    VAL  20           H        VAL  20  81.578  -7.218  -1.690
  153    HA   VAL  20           HA       VAL  20  79.868  -5.903  -0.885
  154    HB   VAL  20           HB       VAL  20  79.257  -4.136  -2.389
  155   HG11  VAL  20          HG11      VAL  20  82.019  -5.131  -3.146
  156   HG12  VAL  20          HG12      VAL  20  81.642  -4.315  -1.631
  157   HG13  VAL  20          HG13      VAL  20  81.456  -3.460  -3.161
  158   HG21  VAL  20          HG21      VAL  20  78.653  -5.734  -4.286
  159   HG22  VAL  20          HG22      VAL  20  80.374  -5.797  -4.655
  160   HG23  VAL  20          HG23      VAL  20  79.505  -4.269  -4.765
  161    H    GLU  21           H        GLU  21  79.036  -8.621  -1.998
  162    HA   GLU  21           HA       GLU  21  76.185  -7.950  -2.449
  163    HB2  GLU  21           HB2      GLU  21  75.943  -9.886  -3.789
  164    HB3  GLU  21           HB3      GLU  21  77.445  -9.137  -4.330
  165    HG2  GLU  21           HG2      GLU  21  78.570 -10.689  -2.557
  166    HG3  GLU  21           HG3      GLU  21  77.062 -11.600  -2.648
  167    H    LYS  22           H        LYS  22  74.963  -8.332  -0.747
  168    HA   LYS  22           HA       LYS  22  75.697  -9.516   1.624
  169    HB2  LYS  22           HB2      LYS  22  73.574  -8.179   1.053
  170    HB3  LYS  22           HB3      LYS  22  72.885  -9.722   0.556
  171    HG2  LYS  22           HG2      LYS  22  72.240  -9.599   2.805
  172    HG3  LYS  22           HG3      LYS  22  73.709 -10.569   2.889
  173    HD2  LYS  22           HD2      LYS  22  75.007  -8.736   3.662
  174    HD3  LYS  22           HD3      LYS  22  73.779  -7.561   3.192
  175    HE2  LYS  22           HE2      LYS  22  73.216  -9.692   5.254
  176    HE3  LYS  22           HE3      LYS  22  73.940  -8.146   5.695
  177    HZ1  LYS  22           HZ1      LYS  22  71.423  -8.325   5.788
  178    HZ2  LYS  22           HZ2      LYS  22  71.464  -8.294   4.088
  179    HZ3  LYS  22           HZ3      LYS  22  72.071  -6.982   4.979
  180    H    GLY  23           H        GLY  23  75.713 -11.544   2.476
  181    HA2  GLY  23           HA2      GLY  23  75.791 -13.842   2.543
  182    HA3  GLY  23           HA3      GLY  23  74.399 -13.808   1.467
  183    H    GLY  24           H        GLY  24  77.481 -12.364   0.624
  184    HA2  GLY  24           HA2      GLY  24  77.677 -14.163  -1.675
  185    HA3  GLY  24           HA3      GLY  24  78.600 -12.688  -1.419
  186    H    LYS  25           H        LYS  25  80.630 -13.461  -1.682
  187    HA   LYS  25           HA       LYS  25  81.698 -15.095   0.482
  188    HB2  LYS  25           HB2      LYS  25  82.939 -16.484  -1.344
  189    HB3  LYS  25           HB3      LYS  25  81.277 -16.909  -0.933
  190    HG2  LYS  25           HG2      LYS  25  80.407 -15.828  -2.866
  191    HG3  LYS  25           HG3      LYS  25  81.928 -14.989  -3.173
  192    HD2  LYS  25           HD2      LYS  25  83.022 -17.188  -3.590
  193    HD3  LYS  25           HD3      LYS  25  81.459 -17.977  -3.379
  194    HE2  LYS  25           HE2      LYS  25  81.883 -15.765  -5.395
  195    HE3  LYS  25           HE3      LYS  25  82.149 -17.463  -5.793
  196    HZ1  LYS  25           HZ1      LYS  25  79.898 -17.967  -5.259
  197    HZ2  LYS  25           HZ2      LYS  25  79.888 -16.640  -6.319
  198    HZ3  LYS  25           HZ3      LYS  25  79.620 -16.405  -4.658
  199    H    HIS  26           H        HIS  26  83.414 -14.007   1.173
  200    HA   HIS  26           HA       HIS  26  84.620 -11.852  -0.101
  201    HB2  HIS  26           HB2      HIS  26  86.512 -12.227   1.494
  202    HB3  HIS  26           HB1      HIS  26  84.927 -12.215   2.267
  203    HD1  HIS  26           HD1      HIS  26  87.339 -14.785   0.792
  204    HD2  HIS  26           HD2      HIS  26  84.486 -14.460   3.814
  205    HE1  HIS  26           HE1      HIS  26  87.374 -16.983   2.048
  206    HE2  HIS  26           HE2      HIS  26  85.639 -16.801   3.895
  207    H    LYS  27           H        LYS  27  86.254 -11.598  -1.519
  208    HA   LYS  27           HA       LYS  27  87.796 -13.962  -2.375
  209    HB2  LYS  27           HB2      LYS  27  86.180 -12.111  -4.127
  210    HB3  LYS  27           HB3      LYS  27  87.525 -13.058  -4.761
  211    HG2  LYS  27           HG2      LYS  27  86.425 -15.075  -4.487
  212    HG3  LYS  27           HG3      LYS  27  85.482 -14.498  -3.115
  213    HD2  LYS  27           HD2      LYS  27  83.987 -14.779  -5.005
  214    HD3  LYS  27           HD3      LYS  27  84.170 -13.054  -4.697
  215    HE2  LYS  27           HE2      LYS  27  85.943 -12.976  -6.463
  216    HE3  LYS  27           HE3      LYS  27  85.607 -14.671  -6.822
  217    HZ1  LYS  27           HZ1      LYS  27  83.774 -12.359  -7.104
  218    HZ2  LYS  27           HZ2      LYS  27  83.245 -13.971  -7.174
  219    HZ3  LYS  27           HZ3      LYS  27  84.346 -13.385  -8.327
  220    H    THR  28           H        THR  28  89.897 -13.501  -2.248
  221    HA   THR  28           HA       THR  28  91.818 -12.247  -1.933
  222    HB   THR  28           HB       THR  28  90.711 -10.735  -4.309
  223    HG1  THR  28           HG1      THR  28  91.436 -12.379  -5.537
  224   HG21  THR  28          HG21      THR  28  93.170 -10.587  -2.856
  225   HG22  THR  28          HG22      THR  28  92.738  -9.744  -4.344
  226   HG23  THR  28          HG23      THR  28  93.515 -11.323  -4.421
  227    H    GLY  29           H        GLY  29  89.368 -11.326  -0.557
  228    HA2  GLY  29           HA2      GLY  29  90.258  -9.124   0.798
  229    HA3  GLY  29           HA3      GLY  29  89.368  -8.453  -0.565
  230    HA   PRO  30           HA       PRO  30  86.538 -10.065   2.967
  231    HB2  PRO  30           HB2      PRO  30  86.098  -7.734   4.348
  232    HB3  PRO  30           HB1      PRO  30  87.369  -8.898   4.769
  233    HG2  PRO  30           HG2      PRO  30  87.577  -6.338   3.260
  234    HG3  PRO  30           HG1      PRO  30  88.674  -7.032   4.466
  235    HD2  PRO  30           HD2      PRO  30  89.168  -7.159   1.779
  236    HD3  PRO  30           HD1      PRO  30  89.727  -8.401   2.923
  237    H    ASN  31           H        ASN  31  84.279  -9.128   3.468
  238    HA   ASN  31           HA       ASN  31  83.166  -8.082   0.958
  239    HB2  ASN  31           HB2      ASN  31  81.069  -8.923   1.720
  240    HB3  ASN  31           HB1      ASN  31  82.262 -10.159   2.116
  241   HD21  ASN  31          HD21      ASN  31  82.135 -10.915   4.227
  242   HD22  ASN  31          HD22      ASN  31  81.483 -10.048   5.534
  243    H    LEU  32           H        LEU  32  81.427  -6.438   1.115
  244    HA   LEU  32           HA       LEU  32  81.980  -4.491   3.281
  245    HB2  LEU  32           HB2      LEU  32  80.922  -3.849   0.521
  246    HB3  LEU  32           HB3      LEU  32  81.442  -2.709   1.755
  247    HG   LEU  32           HG       LEU  32  83.150  -4.590   0.112
  248   HD11  LEU  32          HD11      LEU  32  82.958  -1.599   0.519
  249   HD12  LEU  32          HD12      LEU  32  82.840  -2.507  -0.986
  250   HD13  LEU  32          HD13      LEU  32  84.396  -2.345  -0.175
  251   HD21  LEU  32          HD21      LEU  32  85.028  -3.474   1.569
  252   HD22  LEU  32          HD22      LEU  32  84.175  -4.875   2.200
  253   HD23  LEU  32          HD23      LEU  32  83.740  -3.261   2.747
  254    H    HIS  33           H        HIS  33  80.072  -6.637   3.486
  255    HA   HIS  33           HA       HIS  33  77.433  -5.824   2.899
  256    HB2  HIS  33           HB2      HIS  33  78.430  -7.602   5.139
  257    HB3  HIS  33           HB1      HIS  33  76.761  -7.493   4.580
  258    HD1  HIS  33           HD1      HIS  33  78.609 -10.099   4.396
  259    HD2  HIS  33           HD2      HIS  33  77.784  -7.461   1.274
  260    HE1  HIS  33           HE1      HIS  33  78.974 -11.392   2.249
  261    HE2  HIS  33           HE2      HIS  33  78.474  -9.798   0.337
  262    H    GLY  34           H        GLY  34  75.903  -4.696   4.074
  263    HA2  GLY  34           HA2      GLY  34  75.336  -2.801   5.333
  264    HA3  GLY  34           HA3      GLY  34  75.685  -3.940   6.632
  265    H    LEU  35           H        LEU  35  78.071  -2.717   4.391
  266    HA   LEU  35           HA       LEU  35  80.050  -2.119   6.188
  267    HB2  LEU  35           HB2      LEU  35  80.401  -2.152   3.777
  268    HB3  LEU  35           HB3      LEU  35  79.392  -0.723   3.587
  269    HG   LEU  35           HG       LEU  35  81.151   0.290   5.342
  270   HD11  LEU  35          HD11      LEU  35  83.321  -0.610   5.182
  271   HD12  LEU  35          HD12      LEU  35  82.913  -1.560   3.759
  272   HD13  LEU  35          HD13      LEU  35  82.295  -2.036   5.338
  273   HD21  LEU  35          HD21      LEU  35  82.262   1.332   3.498
  274   HD22  LEU  35          HD22      LEU  35  80.615   1.017   2.954
  275   HD23  LEU  35          HD23      LEU  35  81.930  -0.038   2.438
  276    H    PHE  36           H        PHE  36  77.830   0.280   4.779
  277    HA   PHE  36           HA       PHE  36  78.640   2.473   6.273
  278    HB2  PHE  36           HB2      PHE  36  75.796   1.961   5.381
  279    HB3  PHE  36           HB1      PHE  36  76.581   3.521   5.626
  280    HD1  PHE  36           HD2      PHE  36  76.619   0.439   3.526
  281    HD2  PHE  36           HD1      PHE  36  77.916   4.521   3.909
  282    HE1  PHE  36           HE2      PHE  36  77.438   0.402   1.189
  283    HE2  PHE  36           HE1      PHE  36  78.722   4.482   1.575
  284    HZ   PHE  36           HZ       PHE  36  78.485   2.426   0.209
  285    H    GLY  37           H        GLY  37  79.008   1.972   8.450
  286    HA2  GLY  37           HA2      GLY  37  77.499   2.661  10.438
  287    HA3  GLY  37           HA3      GLY  37  76.656   1.173  10.044
  288    H    ARG  38           H        ARG  38  79.254  -0.182   9.339
  289    HA   ARG  38           HA       ARG  38  79.894  -0.978  12.076
  290    HB2  ARG  38           HB2      ARG  38  80.131  -2.176   9.400
  291    HB3  ARG  38           HB3      ARG  38  81.503  -2.509  10.456
  292    HG2  ARG  38           HG2      ARG  38  79.802  -3.185  12.238
  293    HG3  ARG  38           HG3      ARG  38  78.585  -3.132  10.962
  294    HD2  ARG  38           HD2      ARG  38  81.126  -4.723  10.636
  295    HD3  ARG  38           HD3      ARG  38  79.723  -5.406  11.449
  296    HE   ARG  38           HE       ARG  38  78.587  -4.593   9.189
  297   HH11  ARG  38          HH21      ARG  38  81.643  -6.161   9.715
  298   HH12  ARG  38          HH22      ARG  38  81.647  -6.953   8.176
  299   HH21  ARG  38          HH11      ARG  38  78.597  -5.648   7.187
  300   HH22  ARG  38          HH12      ARG  38  79.925  -6.670   6.753
  301    H    LYS  39           H        LYS  39  81.913  -0.928  13.023
  302    HA   LYS  39           HA       LYS  39  83.575   1.285  12.360
  303    HB2  LYS  39           HB2      LYS  39  83.647  -0.909  14.388
  304    HB3  LYS  39           HB3      LYS  39  85.111   0.033  14.115
  305    HG2  LYS  39           HG2      LYS  39  82.532   1.519  14.464
  306    HG3  LYS  39           HG3      LYS  39  83.275   0.806  15.895
  307    HD2  LYS  39           HD2      LYS  39  85.396   1.977  15.367
  308    HD3  LYS  39           HD3      LYS  39  84.624   2.718  13.967
  309    HE2  LYS  39           HE2      LYS  39  82.867   3.619  15.598
  310    HE3  LYS  39           HE3      LYS  39  83.970   3.137  16.888
  311    HZ1  LYS  39           HZ1      LYS  39  85.039   5.033  16.562
  312    HZ2  LYS  39           HZ2      LYS  39  84.083   5.411  15.210
  313    HZ3  LYS  39           HZ3      LYS  39  85.497   4.488  15.023
  314    H    THR  40           H        THR  40  86.017   1.008  12.158
  315    HA   THR  40           HA       THR  40  86.588  -0.383   9.763
  316    HB   THR  40           HB       THR  40  88.992   0.209  10.351
  317    HG1  THR  40           HG1      THR  40  87.746   1.682  12.411
  318   HG21  THR  40          HG21      THR  40  87.801   1.688   8.922
  319   HG22  THR  40          HG22      THR  40  88.474   2.712  10.192
  320   HG23  THR  40          HG23      THR  40  86.773   2.249  10.240
  321    H    GLY  41           H        GLY  41  87.774  -2.220   9.345
  322    HA2  GLY  41           HA2      GLY  41  88.401  -4.402   9.677
  323    HA3  GLY  41           HA3      GLY  41  89.238  -3.781  11.098
  324    H    GLN  42           H        GLN  42  85.800  -4.166  10.251
  325    HA   GLN  42           HA       GLN  42  85.378  -5.473  12.869
  326    HB2  GLN  42           HB2      GLN  42  83.537  -3.982  11.004
  327    HB3  GLN  42           HB1      GLN  42  82.916  -5.013  12.292
  328    HG2  GLN  42           HG2      GLN  42  84.936  -2.818  12.784
  329    HG3  GLN  42           HG1      GLN  42  83.196  -2.560  12.894
  330   HE21  GLN  42          HE21      GLN  42  82.298  -4.869  14.157
  331   HE22  GLN  42          HE22      GLN  42  83.018  -5.015  15.687
  332    H    ALA  43           H        ALA  43  85.430  -6.034   9.484
  333    HA   ALA  43           HA       ALA  43  83.707  -8.352   9.546
  334    HB1  ALA  43           HB1      ALA  43  85.007  -8.567   7.188
  335    HB2  ALA  43           HB2      ALA  43  85.248  -6.851   7.514
  336    HB3  ALA  43           HB3      ALA  43  83.616  -7.510   7.430
  337    HA   PRO  44           HA       PRO  44  87.185 -10.872  10.915
  338    HB2  PRO  44           HB2      PRO  44  85.817 -13.165  11.362
  339    HB3  PRO  44           HB1      PRO  44  85.684 -11.763  12.444
  340    HG2  PRO  44           HG2      PRO  44  83.821 -12.685  10.307
  341    HG3  PRO  44           HG1      PRO  44  83.459 -12.045  11.918
  342    HD2  PRO  44           HD2      PRO  44  83.325 -10.545   9.604
  343    HD3  PRO  44           HD1      PRO  44  83.597  -9.854  11.220
  344    H    GLY  45           H        GLY  45  85.198 -11.314   8.156
  345    HA2  GLY  45           HA2      GLY  45  85.871 -13.687   7.008
  346    HA3  GLY  45           HA3      GLY  45  85.716 -12.200   6.080
  347    H    PHE  46           H        PHE  46  87.730 -10.731   6.250
  348    HA   PHE  46           HA       PHE  46  90.073 -12.413   5.670
  349    HB2  PHE  46           HB2      PHE  46  89.115 -10.600   4.076
  350    HB3  PHE  46           HB1      PHE  46  89.893  -9.452   5.166
  351    HD1  PHE  46           HD1      PHE  46  92.368  -9.573   5.550
  352    HD2  PHE  46           HD2      PHE  46  90.391 -11.956   2.571
  353    HE1  PHE  46           HE1      PHE  46  94.549 -10.015   4.455
  354    HE2  PHE  46           HE2      PHE  46  92.573 -12.398   1.477
  355    HZ   PHE  46           HZ       PHE  46  94.652 -11.427   2.419
  356    H    THR  47           H        THR  47  92.162 -11.833   6.479
  357    HA   THR  47           HA       THR  47  92.141 -11.094   9.246
  358    HB   THR  47           HB       THR  47  94.561 -11.350   7.457
  359    HG1  THR  47           HG1      THR  47  94.154 -13.391   7.360
  360   HG21  THR  47          HG21      THR  47  95.727 -11.846   9.482
  361   HG22  THR  47          HG22      THR  47  94.223 -12.013  10.386
  362   HG23  THR  47          HG23      THR  47  94.743 -10.424   9.825
  363    H    TYR  48           H        TYR  48  91.262  -8.977   9.205
  364    HA   TYR  48           HA       TYR  48  92.255  -6.814   7.729
  365    HB2  TYR  48           HB2      TYR  48  90.703  -7.101  10.267
  366    HB3  TYR  48           HB3      TYR  48  91.338  -5.512   9.850
  367    HD1  TYR  48           HD2      TYR  48  89.091  -8.241   8.776
  368    HD2  TYR  48           HD1      TYR  48  90.517  -4.279   7.961
  369    HE1  TYR  48           HE2      TYR  48  87.244  -7.910   7.154
  370    HE2  TYR  48           HE1      TYR  48  88.679  -3.944   6.343
  371    HH   TYR  48           HH       TYR  48  86.423  -4.849   5.932
  372    H    THR  49           H        THR  49  93.604  -5.065   8.330
  373    HA   THR  49           HA       THR  49  95.975  -5.909   9.760
  374    HB   THR  49           HB       THR  49  96.910  -3.780   9.032
  375    HG1  THR  49           HG1      THR  49  94.678  -2.793   9.327
  376   HG21  THR  49          HG21      THR  49  95.250  -5.252   6.976
  377   HG22  THR  49          HG22      THR  49  96.955  -5.489   7.354
  378   HG23  THR  49          HG23      THR  49  96.429  -4.013   6.546
  379    H    ASP  50           H        ASP  50  96.974  -4.523  11.429
  380    HA   ASP  50           HA       ASP  50  95.275  -4.150  13.637
  381    HB2  ASP  50           HB2      ASP  50  97.923  -2.753  13.306
  382    HB3  ASP  50           HB1      ASP  50  97.175  -3.346  14.788
  383    H    ALA  51           H        ALA  51  96.177  -2.021  11.040
  384    HA   ALA  51           HA       ALA  51  95.497   0.439  12.303
  385    HB1  ALA  51           HB1      ALA  51  96.861   0.530  10.344
  386    HB2  ALA  51           HB2      ALA  51  95.315   1.261   9.916
  387    HB3  ALA  51           HB3      ALA  51  95.683  -0.385   9.403
  388    H    ASN  52           H        ASN  52  93.679  -1.902  10.369
  389    HA   ASN  52           HA       ASN  52  91.274  -0.287  10.393
  390    HB2  ASN  52           HB2      ASN  52  91.979  -3.035   9.390
  391    HB3  ASN  52           HB1      ASN  52  90.297  -2.520   9.489
  392   HD21  ASN  52          HD21      ASN  52  90.162  -2.544   7.107
  393   HD22  ASN  52          HD22      ASN  52  90.866  -1.293   6.198
  394    H    LYS  53           H        LYS  53  92.723  -2.763  12.335
  395    HA   LYS  53           HA       LYS  53  90.270  -3.431  13.739
  396    HB2  LYS  53           HB2      LYS  53  91.561  -5.312  13.832
  397    HB3  LYS  53           HB3      LYS  53  93.060  -4.409  13.654
  398    HG2  LYS  53           HG2      LYS  53  93.014  -3.770  16.004
  399    HG3  LYS  53           HG3      LYS  53  91.433  -4.527  16.209
  400    HD2  LYS  53           HD2      LYS  53  92.560  -6.699  15.413
  401    HD3  LYS  53           HD3      LYS  53  94.089  -5.861  15.680
  402    HE2  LYS  53           HE2      LYS  53  93.344  -5.381  18.030
  403    HE3  LYS  53           HE3      LYS  53  91.929  -6.393  17.738
  404    HZ1  LYS  53           HZ1      LYS  53  93.990  -7.936  16.894
  405    HZ2  LYS  53           HZ2      LYS  53  93.222  -8.062  18.403
  406    HZ3  LYS  53           HZ3      LYS  53  94.649  -7.155  18.247
  407    H    ASN  54           H        ASN  54  92.594  -1.008  13.791
  408    HA   ASN  54           HA       ASN  54  92.806  -0.447  16.558
  409    HB2  ASN  54           HB2      ASN  54  93.896   1.476  15.894
  410    HB3  ASN  54           HB1      ASN  54  94.094   0.490  14.452
  411   HD21  ASN  54          HD21      ASN  54  91.398   0.763  13.429
  412   HD22  ASN  54          HD22      ASN  54  91.187   2.380  12.958
  413    H    LYS  55           H        LYS  55  90.294  -0.058  14.291
  414    HA   LYS  55           HA       LYS  55  88.201   0.913  14.387
  415    HB2  LYS  55           HB2      LYS  55  88.736   0.483  17.332
  416    HB3  LYS  55           HB3      LYS  55  87.173   0.971  16.675
  417    HG2  LYS  55           HG2      LYS  55  86.894  -1.063  15.503
  418    HG3  LYS  55           HG3      LYS  55  88.604  -1.473  15.635
  419    HD2  LYS  55           HD2      LYS  55  87.298  -2.829  17.205
  420    HD3  LYS  55           HD3      LYS  55  88.340  -1.717  18.091
  421    HE2  LYS  55           HE2      LYS  55  85.655  -0.649  17.433
  422    HE3  LYS  55           HE3      LYS  55  85.666  -1.995  18.572
  423    HZ1  LYS  55           HZ1      LYS  55  87.618   0.144  18.970
  424    HZ2  LYS  55           HZ2      LYS  55  86.806  -0.812  20.114
  425    HZ3  LYS  55           HZ3      LYS  55  86.002   0.476  19.356
  426    H    GLY  56           H        GLY  56  89.659   2.843  13.662
  427    HA2  GLY  56           HA2      GLY  56  89.797   4.997  15.629
  428    HA3  GLY  56           HA3      GLY  56  90.405   5.049  13.978
  429    H    ILE  57           H        ILE  57  88.032   4.189  12.664
  430    HA   ILE  57           HA       ILE  57  86.000   6.183  13.390
  431    HB   ILE  57           HB       ILE  57  85.940   7.148  11.177
  432   HG12  ILE  57          HG12      ILE  57  87.976   6.434   9.645
  433   HG13  ILE  57          HG13      ILE  57  87.913   4.947  10.587
  434   HG21  ILE  57          HG21      ILE  57  87.971   8.386  11.247
  435   HG22  ILE  57          HG22      ILE  57  88.853   7.042  11.971
  436   HG23  ILE  57          HG23      ILE  57  87.652   7.920  12.917
  437   HD11  ILE  57          HD11      ILE  57  86.455   5.341   8.339
  438   HD12  ILE  57          HD12      ILE  57  85.302   5.918   9.537
  439   HD13  ILE  57          HD13      ILE  57  85.937   4.278   9.640
  440    H    THR  58           H        THR  58  84.108   5.971  11.729
  441    HA   THR  58           HA       THR  58  83.633   3.083  11.296
  442    HB   THR  58           HB       THR  58  81.713   5.289  12.055
  443    HG1  THR  58           HG1      THR  58  81.658   3.025  13.495
  444   HG21  THR  58          HG21      THR  58  80.517   3.942  10.496
  445   HG22  THR  58          HG22      THR  58  80.053   3.338  12.085
  446   HG23  THR  58          HG23      THR  58  81.234   2.458  11.119
  447    H    TRP  59           H        TRP  59  82.817   2.387   9.378
  448    HA   TRP  59           HA       TRP  59  83.226   3.969   7.068
  449    HB2  TRP  59           HB2      TRP  59  81.388   1.582   7.181
  450    HB3  TRP  59           HB1      TRP  59  82.369   2.150   5.829
  451    HD1  TRP  59           HD1      TRP  59  85.138   2.499   7.259
  452    HE1  TRP  59           HE1      TRP  59  86.456   0.418   8.037
  453    HE3  TRP  59           HE3      TRP  59  81.353  -0.907   7.546
  454    HZ2  TRP  59           HZ2      TRP  59  85.956  -2.313   8.722
  455    HZ3  TRP  59           HZ3      TRP  59  81.797  -3.235   8.251
  456    HH2  TRP  59           HH2      TRP  59  84.096  -3.942   8.836
  457    H    LYS  60           H        LYS  60  81.873   5.205   5.880
  458    HA   LYS  60           HA       LYS  60  79.006   5.200   6.325
  459    HB2  LYS  60           HB2      LYS  60  80.718   7.590   7.059
  460    HB3  LYS  60           HB3      LYS  60  78.969   7.656   6.848
  461    HG2  LYS  60           HG2      LYS  60  78.832   5.773   8.576
  462    HG3  LYS  60           HG3      LYS  60  80.528   6.105   8.923
  463    HD2  LYS  60           HD2      LYS  60  78.436   8.287   8.968
  464    HD3  LYS  60           HD3      LYS  60  78.800   7.310  10.391
  465    HE2  LYS  60           HE2      LYS  60  81.214   7.955  10.139
  466    HE3  LYS  60           HE3      LYS  60  80.736   9.057   8.847
  467    HZ1  LYS  60           HZ1      LYS  60  79.184   9.313  11.263
  468    HZ2  LYS  60           HZ2      LYS  60  79.895  10.514  10.294
  469    HZ3  LYS  60           HZ3      LYS  60  80.824   9.697  11.459
  470    H    GLU  61           H        GLU  61  78.458   7.672   5.105
  471    HA   GLU  61           HA       GLU  61  79.002   6.993   2.364
  472    HB2  GLU  61           HB2      GLU  61  76.847   7.998   3.165
  473    HB3  GLU  61           HB3      GLU  61  77.715   9.506   3.450
  474    HG2  GLU  61           HG2      GLU  61  78.364   9.604   1.083
  475    HG3  GLU  61           HG3      GLU  61  77.541   8.073   0.784
  476    H    GLU  62           H        GLU  62  79.677   9.926   4.301
  477    HA   GLU  62           HA       GLU  62  81.455  11.013   2.357
  478    HB2  GLU  62           HB2      GLU  62  82.146  12.458   4.430
  479    HB3  GLU  62           HB3      GLU  62  80.534  12.642   3.741
  480    HG2  GLU  62           HG2      GLU  62  79.508  11.452   5.476
  481    HG3  GLU  62           HG3      GLU  62  80.999  10.630   5.928
  482    H    THR  63           H        THR  63  81.928   9.076   5.282
  483    HA   THR  63           HA       THR  63  84.722   9.321   5.480
  484    HB   THR  63           HB       THR  63  84.643   7.224   6.741
  485    HG1  THR  63           HG1      THR  63  82.664   6.710   5.111
  486   HG21  THR  63          HG21      THR  63  82.712   7.865   8.301
  487   HG22  THR  63          HG22      THR  63  82.399   9.187   7.177
  488   HG23  THR  63          HG23      THR  63  83.947   9.092   8.016
  489    H    LEU  64           H        LEU  64  82.667   7.248   3.520
  490    HA   LEU  64           HA       LEU  64  84.766   5.601   2.521
  491    HB2  LEU  64           HB2      LEU  64  81.898   5.945   2.043
  492    HB3  LEU  64           HB3      LEU  64  82.797   5.542   0.588
  493    HG   LEU  64           HG       LEU  64  83.132   3.995   3.164
  494   HD11  LEU  64          HD11      LEU  64  81.023   3.242   2.836
  495   HD12  LEU  64          HD12      LEU  64  81.668   2.393   1.431
  496   HD13  LEU  64          HD13      LEU  64  80.918   3.975   1.239
  497   HD21  LEU  64          HD21      LEU  64  83.786   2.236   1.354
  498   HD22  LEU  64          HD22      LEU  64  84.936   3.523   1.707
  499   HD23  LEU  64          HD23      LEU  64  83.921   3.619   0.270
  500    H    MET  65           H        MET  65  83.337   8.665   1.536
  501    HA   MET  65           HA       MET  65  84.382   8.798  -1.073
  502    HB2  MET  65           HB2      MET  65  83.774  11.020   0.885
  503    HB3  MET  65           HB1      MET  65  84.122  11.264  -0.826
  504    HG2  MET  65           HG2      MET  65  82.187  10.003  -1.483
  505    HG3  MET  65           HG1      MET  65  81.914   9.458   0.170
  506    HE1  MET  65           HE1      MET  65  81.962  12.277  -2.341
  507    HE2  MET  65           HE2      MET  65  80.533  13.198  -1.879
  508    HE3  MET  65           HE3      MET  65  80.371  11.503  -2.332
  509    H    GLU  66           H        GLU  66  85.681  10.304   1.899
  510    HA   GLU  66           HA       GLU  66  88.098  11.175   0.742
  511    HB2  GLU  66           HB2      GLU  66  87.571  10.382   3.618
  512    HB3  GLU  66           HB3      GLU  66  88.910  11.377   3.046
  513    HG2  GLU  66           HG2      GLU  66  87.134  12.939   2.064
  514    HG3  GLU  66           HG3      GLU  66  85.961  12.040   3.026
  515    H    TYR  67           H        TYR  67  87.047   8.124   2.027
  516    HA   TYR  67           HA       TYR  67  89.669   6.922   2.113
  517    HB2  TYR  67           HB2      TYR  67  88.120   6.015   3.643
  518    HB3  TYR  67           HB3      TYR  67  86.851   5.928   2.433
  519    HD1  TYR  67           HD2      TYR  67  86.978   4.229   0.595
  520    HD2  TYR  67           HD1      TYR  67  89.720   4.243   3.902
  521    HE1  TYR  67           HE2      TYR  67  87.618   1.891   0.074
  522    HE2  TYR  67           HE1      TYR  67  90.358   1.904   3.382
  523    HH   TYR  67           HH       TYR  67  89.025   0.224   0.542
  524    H    LEU  68           H        LEU  68  87.099   7.285  -0.202
  525    HA   LEU  68           HA       LEU  68  88.003   5.195  -1.965
  526    HB2  LEU  68           HB2      LEU  68  85.824   7.204  -1.921
  527    HB3  LEU  68           HB3      LEU  68  86.375   6.723  -3.519
  528    HG   LEU  68           HG       LEU  68  85.595   4.760  -1.345
  529   HD11  LEU  68          HD11      LEU  68  83.569   5.805  -1.867
  530   HD12  LEU  68          HD12      LEU  68  83.589   4.438  -2.976
  531   HD13  LEU  68          HD13      LEU  68  84.006   6.052  -3.556
  532   HD21  LEU  68          HD21      LEU  68  85.293   3.437  -3.663
  533   HD22  LEU  68          HD22      LEU  68  86.823   3.469  -2.793
  534   HD23  LEU  68          HD23      LEU  68  86.564   4.549  -4.158
  535    H    GLU  69           H        GLU  69  88.782   8.531  -1.471
  536    HA   GLU  69           HA       GLU  69  90.013   8.792  -4.116
  537    HB2  GLU  69           HB2      GLU  69  90.087  11.063  -3.735
  538    HB3  GLU  69           HB3      GLU  69  88.727  10.635  -2.700
  539    HG2  GLU  69           HG2      GLU  69  90.506  10.322  -0.842
  540    HG3  GLU  69           HG3      GLU  69  91.576  11.226  -1.908
  541    H    ASN  70           H        ASN  70  90.828   7.732  -1.017
  542    HA   ASN  70           HA       ASN  70  93.514   7.150  -1.713
  543    HB2  ASN  70           HB2      ASN  70  93.308   9.773  -1.073
  544    HB3  ASN  70           HB1      ASN  70  93.564   9.098   0.531
  545   HD21  ASN  70          HD21      ASN  70  95.482   7.382   0.547
  546   HD22  ASN  70          HD22      ASN  70  96.860   7.830  -0.338
  547    HA   PRO  71           HA       PRO  71  91.265   4.679   1.578
  548    HB2  PRO  71           HB2      PRO  71  92.904   2.623   0.161
  549    HB3  PRO  71           HB1      PRO  71  91.215   2.552   0.690
  550    HG2  PRO  71           HG2      PRO  71  91.864   2.895  -1.874
  551    HG3  PRO  71           HG1      PRO  71  90.447   3.681  -1.157
  552    HD2  PRO  71           HD2      PRO  71  93.076   4.870  -1.919
  553    HD3  PRO  71           HD1      PRO  71  91.463   5.615  -1.900
  554    H    LYS  72           H        LYS  72  94.635   4.922   0.609
  555    HA   LYS  72           HA       LYS  72  95.674   3.534   2.897
  556    HB2  LYS  72           HB2      LYS  72  96.843   3.718   0.692
  557    HB3  LYS  72           HB3      LYS  72  97.127   5.421   1.041
  558    HG2  LYS  72           HG2      LYS  72  98.983   4.819   2.178
  559    HG3  LYS  72           HG3      LYS  72  97.941   4.049   3.371
  560    HD2  LYS  72           HD2      LYS  72  98.860   2.667   0.833
  561    HD3  LYS  72           HD3      LYS  72  99.705   2.531   2.373
  562    HE2  LYS  72           HE2      LYS  72  96.815   1.757   1.867
  563    HE3  LYS  72           HE3      LYS  72  98.163   0.640   2.075
  564    HZ1  LYS  72           HZ1      LYS  72  97.201   0.769   4.170
  565    HZ2  LYS  72           HZ2      LYS  72  96.940   2.446   4.067
  566    HZ3  LYS  72           HZ3      LYS  72  98.513   1.839   4.281
  567    H    LYS  73           H        LYS  73  95.525   6.985   1.983
  568    HA   LYS  73           HA       LYS  73  96.827   7.899   4.312
  569    HB2  LYS  73           HB2      LYS  73  96.532  10.001   3.457
  570    HB3  LYS  73           HB3      LYS  73  96.179   9.080   1.999
  571    HG2  LYS  73           HG2      LYS  73  94.364  10.557   2.114
  572    HG3  LYS  73           HG3      LYS  73  93.713   9.100   2.858
  573    HD2  LYS  73           HD2      LYS  73  93.250  10.302   4.718
  574    HD3  LYS  73           HD3      LYS  73  94.975  10.573   4.947
  575    HE2  LYS  73           HE2      LYS  73  93.939  12.736   4.849
  576    HE3  LYS  73           HE3      LYS  73  94.783  12.508   3.318
  577    HZ1  LYS  73           HZ1      LYS  73  92.426  11.474   2.710
  578    HZ2  LYS  73           HZ2      LYS  73  92.791  13.120   2.499
  579    HZ3  LYS  73           HZ3      LYS  73  91.928  12.607   3.869
  580    H    TYR  74           H        TYR  74  93.469   7.098   3.685
  581    HA   TYR  74           HA       TYR  74  92.358   8.476   5.900
  582    HB2  TYR  74           HB2      TYR  74  91.277   7.172   3.802
  583    HB3  TYR  74           HB3      TYR  74  91.085   5.929   5.038
  584    HD1  TYR  74           HD1      TYR  74  90.715   9.660   4.740
  585    HD2  TYR  74           HD2      TYR  74  89.092   5.980   6.250
  586    HE1  TYR  74           HE1      TYR  74  88.781  10.898   5.676
  587    HE2  TYR  74           HE2      TYR  74  87.158   7.220   7.185
  588    HH   TYR  74           HH       TYR  74  87.013  10.143   7.884
  589    H    ILE  75           H        ILE  75  93.121   5.005   5.525
  590    HA   ILE  75           HA       ILE  75  93.587   4.892   8.446
  591    HB   ILE  75           HB       ILE  75  92.309   2.707   6.785
  592   HG12  ILE  75          HG12      ILE  75  90.957   4.439   8.866
  593   HG13  ILE  75          HG13      ILE  75  90.940   4.861   7.154
  594   HG21  ILE  75          HG21      ILE  75  92.926   3.066   9.727
  595   HG22  ILE  75          HG22      ILE  75  93.427   1.751   8.663
  596   HG23  ILE  75          HG23      ILE  75  91.740   1.894   9.153
  597   HD11  ILE  75          HD11      ILE  75  89.980   2.216   8.281
  598   HD12  ILE  75          HD12      ILE  75  89.876   2.738   6.600
  599   HD13  ILE  75          HD13      ILE  75  88.926   3.560   7.838
  600    HA   PRO  76           HA       PRO  76  97.399   3.787   5.885
  601    HB2  PRO  76           HB2      PRO  76  98.386   4.538   8.621
  602    HB3  PRO  76           HB1      PRO  76  99.101   4.883   7.033
  603    HG2  PRO  76           HG2      PRO  76  97.744   6.741   8.380
  604    HG3  PRO  76           HG1      PRO  76  97.664   6.627   6.614
  605    HD2  PRO  76           HD2      PRO  76  95.590   5.942   8.627
  606    HD3  PRO  76           HD1      PRO  76  95.399   6.387   6.917
  607    H    GLY  77           H        GLY  77  98.322   1.793   5.862
  608    HA2  GLY  77           HA2      GLY  77  99.275  -0.137   6.937
  609    HA3  GLY  77           HA3      GLY  77  98.160   0.103   8.280
  610    H    THR  78           H        THR  78  95.946   0.678   6.355
  611    HA   THR  78           HA       THR  78  94.738  -1.830   6.253
  612    HB   THR  78           HB       THR  78  93.545   0.340   6.034
  613    HG1  THR  78           HG1      THR  78  93.113  -1.310   3.778
  614   HG21  THR  78          HG21      THR  78  94.491   0.282   3.166
  615   HG22  THR  78          HG22      THR  78  95.284   1.249   4.410
  616   HG23  THR  78          HG23      THR  78  93.601   1.565   3.987
  617    H    LYS  79           H        LYS  79  94.553  -3.420   4.698
  618    HA   LYS  79           HA       LYS  79  96.666  -3.446   2.680
  619    HB2  LYS  79           HB2      LYS  79  94.809  -5.487   3.852
  620    HB3  LYS  79           HB3      LYS  79  95.552  -5.808   2.286
  621    HG2  LYS  79           HG2      LYS  79  97.295  -4.841   4.530
  622    HG3  LYS  79           HG3      LYS  79  96.773  -6.525   4.531
  623    HD2  LYS  79           HD2      LYS  79  97.689  -6.835   2.275
  624    HD3  LYS  79           HD3      LYS  79  98.177  -5.141   2.226
  625    HE2  LYS  79           HE2      LYS  79  99.756  -5.454   4.006
  626    HE3  LYS  79           HE3      LYS  79  99.135  -7.068   4.353
  627    HZ1  LYS  79           HZ1      LYS  79  99.751  -7.371   1.810
  628    HZ2  LYS  79           HZ2      LYS  79 100.877  -7.640   3.055
  629    HZ3  LYS  79           HZ3      LYS  79 100.885  -6.172   2.201
  630    H    MET  80           H        MET  80  95.966  -1.951   1.149
  631    HA   MET  80           HA       MET  80  94.360  -2.921  -0.941
  632    HB2  MET  80           HB2      MET  80  92.421  -2.548   0.427
  633    HB3  MET  80           HB1      MET  80  92.991  -0.946   0.897
  634    HG2  MET  80           HG2      MET  80  92.630  -0.057  -1.272
  635    HG3  MET  80           HG1      MET  80  92.500  -1.658  -1.997
  636    HE1  MET  80           HE1      MET  80  90.819   0.607  -2.577
  637    HE2  MET  80           HE2      MET  80  90.297   1.344  -1.066
  638    HE3  MET  80           HE3      MET  80  89.123   0.520  -2.084
  639    H    ILE  81           H        ILE  81  95.997  -2.178  -2.236
  640    HA   ILE  81           HA       ILE  81  96.159   0.754  -2.555
  641    HB   ILE  81           HB       ILE  81  98.522  -1.137  -2.682
  642   HG12  ILE  81          HG12      ILE  81  99.131   0.514  -0.658
  643   HG13  ILE  81          HG13      ILE  81  97.377   0.575  -0.501
  644   HG21  ILE  81          HG21      ILE  81  98.230   1.867  -2.947
  645   HG22  ILE  81          HG22      ILE  81  98.793   0.740  -4.180
  646   HG23  ILE  81          HG23      ILE  81  99.778   1.047  -2.749
  647   HD11  ILE  81          HD11      ILE  81  99.246  -1.708  -0.061
  648   HD12  ILE  81          HD12      ILE  81  97.666  -2.089  -0.743
  649   HD13  ILE  81          HD13      ILE  81  97.779  -1.272   0.814
  650    H    PHE  82           H        PHE  82  94.662   0.416  -4.311
  651    HA   PHE  82           HA       PHE  82  95.893  -0.836  -6.697
  652    HB2  PHE  82           HB2      PHE  82  93.880  -2.019  -6.088
  653    HB3  PHE  82           HB1      PHE  82  92.980  -0.512  -5.943
  654    HD1  PHE  82           HD2      PHE  82  95.263  -2.065  -8.502
  655    HD2  PHE  82           HD1      PHE  82  91.514  -0.119  -7.713
  656    HE1  PHE  82           HE2      PHE  82  94.697  -2.174 -10.913
  657    HE2  PHE  82           HE1      PHE  82  90.951  -0.233 -10.124
  658    HZ   PHE  82           HZ       PHE  82  92.541  -1.259 -11.724
  659    H    ALA  83           H        ALA  83  93.143   1.379  -6.372
  660    HA   ALA  83           HA       ALA  83  94.593   3.635  -7.424
  661    HB1  ALA  83           HB1      ALA  83  93.101   3.768  -9.488
  662    HB2  ALA  83           HB2      ALA  83  92.716   2.071  -9.196
  663    HB3  ALA  83           HB3      ALA  83  94.380   2.554  -9.530
  664    H    GLY  84           H        GLY  84  93.718   5.310  -6.409
  665    HA2  GLY  84           HA2      GLY  84  91.144   5.165  -5.144
  666    HA3  GLY  84           HA3      GLY  84  92.209   6.568  -5.190
  667    H    ILE  85           H        ILE  85  89.749   7.307  -5.432
  668    HA   ILE  85           HA       ILE  85  88.898   7.306  -8.238
  669    HB   ILE  85           HB       ILE  85  87.635   8.371  -5.707
  670   HG12  ILE  85          HG12      ILE  85  87.782   5.807  -6.402
  671   HG13  ILE  85          HG13      ILE  85  86.292   6.470  -5.744
  672   HG21  ILE  85          HG21      ILE  85  86.872   9.840  -7.400
  673   HG22  ILE  85          HG22      ILE  85  85.612   8.613  -7.287
  674   HG23  ILE  85          HG23      ILE  85  86.787   8.549  -8.598
  675   HD11  ILE  85          HD11      ILE  85  85.262   6.593  -7.861
  676   HD12  ILE  85          HD12      ILE  85  86.121   5.054  -7.901
  677   HD13  ILE  85          HD13      ILE  85  86.799   6.464  -8.715
  678    H    LYS  86           H        LYS  86  88.299   9.381  -9.260
  679    HA   LYS  86           HA       LYS  86  90.295  11.449  -8.609
  680    HB2  LYS  86           HB2      LYS  86  88.797  10.773 -11.138
  681    HB3  LYS  86           HB3      LYS  86  89.738  12.253 -10.952
  682    HG2  LYS  86           HG2      LYS  86  91.732  10.873 -10.367
  683    HG3  LYS  86           HG3      LYS  86  90.783   9.419 -10.674
  684    HD2  LYS  86           HD2      LYS  86  90.923  11.531 -12.806
  685    HD3  LYS  86           HD3      LYS  86  92.298  10.451 -12.585
  686    HE2  LYS  86           HE2      LYS  86  89.485   9.383 -12.840
  687    HE3  LYS  86           HE3      LYS  86  90.482   9.709 -14.258
  688    HZ1  LYS  86           HZ1      LYS  86  91.693   7.901 -13.888
  689    HZ2  LYS  86           HZ2      LYS  86  90.507   7.428 -12.767
  690    HZ3  LYS  86           HZ3      LYS  86  91.895   8.256 -12.242
  691    H    LYS  87           H        LYS  87  87.083  11.561 -10.175
  692    HA   LYS  87           HA       LYS  87  86.591  14.173  -9.032
  693    HB2  LYS  87           HB2      LYS  87  84.951  12.362 -10.808
  694    HB3  LYS  87           HB3      LYS  87  84.389  13.936 -10.250
  695    HG2  LYS  87           HG2      LYS  87  87.097  13.748 -11.532
  696    HG3  LYS  87           HG3      LYS  87  85.669  13.706 -12.565
  697    HD2  LYS  87           HD2      LYS  87  85.857  15.833 -10.452
  698    HD3  LYS  87           HD3      LYS  87  86.793  16.021 -11.935
  699    HE2  LYS  87           HE2      LYS  87  83.826  15.418 -11.930
  700    HE3  LYS  87           HE3      LYS  87  84.474  17.056 -11.989
  701    HZ1  LYS  87           HZ1      LYS  87  85.887  15.758 -13.899
  702    HZ2  LYS  87           HZ2      LYS  87  84.534  16.746 -14.178
  703    HZ3  LYS  87           HZ3      LYS  87  84.347  15.063 -14.051
  704    H    LYS  88           H        LYS  88  84.552  14.689  -7.922
  705    HA   LYS  88           HA       LYS  88  84.205  13.040  -5.617
  706    HB2  LYS  88           HB2      LYS  88  83.934  15.557  -5.699
  707    HB3  LYS  88           HB3      LYS  88  82.398  15.288  -6.522
  708    HG2  LYS  88           HG2      LYS  88  81.909  13.674  -4.500
  709    HG3  LYS  88           HG3      LYS  88  83.177  14.600  -3.698
  710    HD2  LYS  88           HD2      LYS  88  81.324  15.869  -3.117
  711    HD3  LYS  88           HD3      LYS  88  81.787  16.672  -4.617
  712    HE2  LYS  88           HE2      LYS  88  80.170  15.273  -5.860
  713    HE3  LYS  88           HE3      LYS  88  79.701  14.485  -4.354
  714    HZ1  LYS  88           HZ1      LYS  88  79.597  17.417  -4.564
  715    HZ2  LYS  88           HZ2      LYS  88  78.696  16.378  -3.568
  716    HZ3  LYS  88           HZ3      LYS  88  78.343  16.486  -5.226
  717    H    THR  89           H        THR  89  82.025  13.892  -8.322
  718    HA   THR  89           HA       THR  89  79.842  12.345  -7.599
  719    HB   THR  89           HB       THR  89  79.345  12.215 -10.046
  720    HG1  THR  89           HG1      THR  89  80.921  12.508 -11.379
  721   HG21  THR  89          HG21      THR  89  80.247  14.901  -8.967
  722   HG22  THR  89          HG22      THR  89  78.664  14.165  -8.724
  723   HG23  THR  89          HG23      THR  89  79.161  14.673 -10.338
  724    H    GLU  90           H        GLU  90  82.929  11.353  -8.854
  725    HA   GLU  90           HA       GLU  90  82.144   8.754  -9.732
  726    HB2  GLU  90           HB2      GLU  90  84.792   9.975  -8.961
  727    HB3  GLU  90           HB3      GLU  90  84.648   8.272  -9.392
  728    HG2  GLU  90           HG2      GLU  90  83.863   8.796 -11.583
  729    HG3  GLU  90           HG3      GLU  90  83.606  10.488 -11.163
  730    H    ARG  91           H        ARG  91  83.260  10.136  -6.693
  731    HA   ARG  91           HA       ARG  91  83.372   7.609  -5.310
  732    HB2  ARG  91           HB2      ARG  91  83.348  10.459  -4.270
  733    HB3  ARG  91           HB3      ARG  91  83.665   9.025  -3.295
  734    HG2  ARG  91           HG2      ARG  91  85.525   8.488  -4.969
  735    HG3  ARG  91           HG3      ARG  91  85.321  10.132  -5.565
  736    HD2  ARG  91           HD2      ARG  91  85.515  10.072  -2.652
  737    HD3  ARG  91           HD3      ARG  91  86.922   9.339  -3.411
  738    HE   ARG  91           HE       ARG  91  87.485  11.423  -4.311
  739   HH11  ARG  91          HH21      ARG  91  84.339  11.455  -2.855
  740   HH12  ARG  91          HH22      ARG  91  84.201  13.180  -2.877
  741   HH21  ARG  91          HH11      ARG  91  87.299  13.682  -4.345
  742   HH22  ARG  91          HH12      ARG  91  85.872  14.440  -3.723
  743    H    GLU  92           H        GLU  92  81.174  10.420  -5.296
  744    HA   GLU  92           HA       GLU  92  79.304   9.419  -3.462
  745    HB2  GLU  92           HB2      GLU  92  79.454  11.774  -4.466
  746    HB3  GLU  92           HB3      GLU  92  78.572  11.121  -5.846
  747    HG2  GLU  92           HG2      GLU  92  76.759  10.384  -4.343
  748    HG3  GLU  92           HG3      GLU  92  77.637  11.042  -2.963
  749    H    ASP  93           H        ASP  93  79.242   9.294  -7.037
  750    HA   ASP  93           HA       ASP  93  76.930   7.719  -7.282
  751    HB2  ASP  93           HB2      ASP  93  79.358   7.836  -9.090
  752    HB3  ASP  93           HB1      ASP  93  77.797   7.146  -9.528
  753    H    LEU  94           H        LEU  94  80.358   6.779  -7.133
  754    HA   LEU  94           HA       LEU  94  80.011   4.006  -7.372
  755    HB2  LEU  94           HB2      LEU  94  82.219   5.029  -7.532
  756    HB3  LEU  94           HB3      LEU  94  82.109   5.568  -5.858
  757    HG   LEU  94           HG       LEU  94  82.070   3.274  -5.062
  758   HD11  LEU  94          HD11      LEU  94  81.847   2.698  -8.003
  759   HD12  LEU  94          HD12      LEU  94  80.919   2.024  -6.663
  760   HD13  LEU  94          HD13      LEU  94  82.583   1.506  -6.931
  761   HD21  LEU  94          HD21      LEU  94  84.327   2.620  -5.683
  762   HD22  LEU  94          HD22      LEU  94  84.265   4.376  -5.552
  763   HD23  LEU  94          HD23      LEU  94  84.253   3.609  -7.140
  764    H    ILE  95           H        ILE  95  79.852   6.155  -4.596
  765    HA   ILE  95           HA       ILE  95  79.639   4.043  -2.690
  766    HB   ILE  95           HB       ILE  95  79.332   7.021  -2.585
  767   HG12  ILE  95          HG12      ILE  95  81.032   5.437  -0.721
  768   HG13  ILE  95          HG13      ILE  95  81.492   5.378  -2.416
  769   HG21  ILE  95          HG21      ILE  95  77.665   6.546  -1.027
  770   HG22  ILE  95          HG22      ILE  95  79.096   6.491   0.002
  771   HG23  ILE  95          HG23      ILE  95  78.375   4.994  -0.588
  772   HD11  ILE  95          HD11      ILE  95  80.866   8.082  -1.386
  773   HD12  ILE  95          HD12      ILE  95  82.174   7.547  -2.437
  774   HD13  ILE  95          HD13      ILE  95  82.300   7.325  -0.698
  775    H    ALA  96           H        ALA  96  77.422   5.853  -4.653
  776    HA   ALA  96           HA       ALA  96  75.043   5.304  -3.208
  777    HB1  ALA  96           HB1      ALA  96  75.343   6.976  -5.109
  778    HB2  ALA  96           HB2      ALA  96  73.882   5.990  -5.174
  779    HB3  ALA  96           HB3      ALA  96  75.257   5.598  -6.207
  780    H    TYR  97           H        TYR  97  76.937   3.547  -5.582
  781    HA   TYR  97           HA       TYR  97  75.009   1.434  -5.920
  782    HB2  TYR  97           HB2      TYR  97  76.506   1.839  -7.752
  783    HB3  TYR  97           HB3      TYR  97  77.918   1.699  -6.704
  784    HD1  TYR  97           HD1      TYR  97  75.018  -0.211  -8.074
  785    HD2  TYR  97           HD2      TYR  97  78.900  -0.414  -6.248
  786    HE1  TYR  97           HE1      TYR  97  75.076  -2.657  -8.469
  787    HE2  TYR  97           HE2      TYR  97  78.957  -2.860  -6.643
  788    HH   TYR  97           HH       TYR  97  77.873  -4.617  -7.435
  789    H    LEU  98           H        LEU  98  78.064   1.855  -4.135
  790    HA   LEU  98           HA       LEU  98  78.274  -0.726  -3.086
  791    HB2  LEU  98           HB2      LEU  98  79.212   1.971  -2.153
  792    HB3  LEU  98           HB3      LEU  98  79.461   0.554  -1.140
  793    HG   LEU  98           HG       LEU  98  80.249   0.425  -4.039
  794   HD11  LEU  98          HD11      LEU  98  81.233   2.532  -3.029
  795   HD12  LEU  98          HD12      LEU  98  82.409   1.357  -3.605
  796   HD13  LEU  98          HD13      LEU  98  82.074   1.493  -1.879
  797   HD21  LEU  98          HD21      LEU  98  80.285  -1.579  -2.539
  798   HD22  LEU  98          HD22      LEU  98  81.443  -0.740  -1.509
  799   HD23  LEU  98          HD23      LEU  98  81.881  -1.163  -3.164
  800    H    LYS  99           H        LYS  99  76.114   1.867  -2.300
  801    HA   LYS  99           HA       LYS  99  75.405   0.873   0.318
  802    HB2  LYS  99           HB2      LYS  99  74.383   3.047  -1.485
  803    HB3  LYS  99           HB3      LYS  99  73.427   2.537  -0.094
  804    HG2  LYS  99           HG2      LYS  99  75.512   2.882   1.323
  805    HG3  LYS  99           HG3      LYS  99  76.243   3.650  -0.085
  806    HD2  LYS  99           HD2      LYS  99  73.594   4.529   1.091
  807    HD3  LYS  99           HD3      LYS  99  75.139   5.245   1.549
  808    HE2  LYS  99           HE2      LYS  99  75.515   5.650  -0.958
  809    HE3  LYS  99           HE3      LYS  99  73.804   5.275  -1.161
  810    HZ1  LYS  99           HZ1      LYS  99  74.020   7.054   0.965
  811    HZ2  LYS  99           HZ2      LYS  99  73.343   7.339  -0.567
  812    HZ3  LYS  99           HZ3      LYS  99  74.985   7.673  -0.286
  813    H    LYS 100           H        LYS 100  73.688   1.061  -2.810
  814    HA   LYS 100           HA       LYS 100  71.552  -0.630  -1.894
  815    HB2  LYS 100           HB2      LYS 100  72.305   0.168  -4.716
  816    HB3  LYS 100           HB3      LYS 100  70.766  -0.526  -4.204
  817    HG2  LYS 100           HG2      LYS 100  70.227   1.404  -2.890
  818    HG3  LYS 100           HG3      LYS 100  71.861   2.048  -3.053
  819    HD2  LYS 100           HD2      LYS 100  70.386   3.242  -4.582
  820    HD3  LYS 100           HD3      LYS 100  71.498   2.241  -5.517
  821    HE2  LYS 100           HE2      LYS 100  68.811   1.149  -4.711
  822    HE3  LYS 100           HE3      LYS 100  68.952   2.202  -6.118
  823    HZ1  LYS 100           HZ1      LYS 100  71.011   0.306  -6.211
  824    HZ2  LYS 100           HZ2      LYS 100  69.708   0.501  -7.284
  825    HZ3  LYS 100           HZ3      LYS 100  69.555  -0.519  -5.933
  826    H    ALA 101           H        ALA 101  74.683  -1.168  -3.126
  827    HA   ALA 101           HA       ALA 101  74.116  -3.814  -4.197
  828    HB1  ALA 101           HB1      ALA 101  75.824  -2.404  -5.267
  829    HB2  ALA 101           HB2      ALA 101  76.531  -3.893  -4.641
  830    HB3  ALA 101           HB3      ALA 101  76.746  -2.378  -3.763
  831    H    THR 102           H        THR 102  75.354  -2.343  -1.276
  832    HA   THR 102           HA       THR 102  76.212  -4.919  -0.182
  833    HB   THR 102           HB       THR 102  76.861  -3.546   1.796
  834    HG1  THR 102           HG1      THR 102  75.672  -1.561   0.191
  835   HG21  THR 102          HG21      THR 102  78.516  -2.065   0.412
  836   HG22  THR 102          HG22      THR 102  77.820  -2.896  -0.979
  837   HG23  THR 102          HG23      THR 102  78.626  -3.820   0.289
  838    H    ASN 103           H        ASN 103  73.392  -3.208  -0.507
  839    HA   ASN 103           HA       ASN 103  72.226  -3.972   2.062
  840    HB2  ASN 103           HB2      ASN 103  71.318  -2.340  -0.293
  841    HB3  ASN 103           HB1      ASN 103  70.159  -2.905   0.903
  842   HD21  ASN 103          HD21      ASN 103  73.460  -2.148   1.857
  843   HD22  ASN 103          HD22      ASN 103  73.076  -0.739   2.718
  844    H    GLU 104           H        GLU 104  72.354  -5.022  -1.246
  845    HA   GLU 104           HA       GLU 104  70.958  -7.472  -0.560
  846    HB2  GLU 104           HB2      GLU 104  69.251  -7.284  -2.281
  847    HB3  GLU 104           HB3      GLU 104  69.109  -5.923  -1.168
  848    HG2  GLU 104           HG2      GLU 104  70.523  -4.578  -2.773
  849    HG3  GLU 104           HG3      GLU 104  70.387  -5.914  -3.913
  850    HHA  HEC 201           HA       HEC 105  89.238  -3.420   3.300
  851    HHB  HEC 201           HB       HEC 105  85.513   0.087  -0.414
  852    HHC  HEC 201           HC       HEC 105  88.824  -1.781  -5.470
  853    HHD  HEC 201           HD       HEC 105  92.112  -5.770  -1.822
  854   HMA1  HEC 201          HMA1      HEC 105  84.970  -0.425   3.261
  855   HMA2  HEC 201          HMA2      HEC 105  84.556  -0.117   1.578
  856   HMA3  HEC 201          HMA3      HEC 105  85.691   0.943   2.413
  857   HAA1  HEC 201          HAA1      HEC 105  86.704  -0.902   4.539
  858   HAA2  HEC 201          HAA2      HEC 105  88.279  -1.671   4.530
  859   HBA1  HEC 201          HBA1      HEC 105  87.332  -3.847   4.525
  860   HBA2  HEC 201          HBA2      HEC 105  85.726  -3.230   4.151
  861   HMB1  HEC 201          HMB1      HEC 105  84.814   1.192  -3.962
  862   HMB2  HEC 201          HMB2      HEC 105  85.145   1.602  -2.283
  863   HMB3  HEC 201          HMB3      HEC 105  84.127   0.217  -2.668
  864    HAB  HEC 201           HAB      HEC 105  87.373  -0.538  -6.152
  865   HBB1  HEC 201          HBB1      HEC 105  86.709   2.020  -4.752
  866   HBB2  HEC 201          HBB2      HEC 105  87.994   1.678  -5.903
  867   HBB3  HEC 201          HBB3      HEC 105  86.336   1.882  -6.467
  868   HMC1  HEC 201          HMC1      HEC 105  89.785  -3.282  -6.777
  869   HMC2  HEC 201          HMC2      HEC 105  91.137  -4.406  -6.799
  870   HMC3  HEC 201          HMC3      HEC 105  91.425  -2.688  -6.538
  871    HAC  HEC 201           HAC      HEC 105  92.576  -6.223  -3.736
  872   HBC1  HEC 201          HBC1      HEC 105  93.869  -5.810  -5.969
  873   HBC2  HEC 201          HBC2      HEC 105  94.216  -4.784  -4.577
  874   HBC3  HEC 201          HBC3      HEC 105  93.177  -4.193  -5.871
  875   HMD1  HEC 201          HMD1      HEC 105  93.200  -6.441   1.688
  876   HMD2  HEC 201          HMD2      HEC 105  93.288  -6.313  -0.064
  877   HMD3  HEC 201          HMD3      HEC 105  92.184  -7.468   0.679
  878   HAD1  HEC 201          HAD1      HEC 105  91.791  -6.205   3.349
  879   HAD2  HEC 201          HAD2      HEC 105  90.268  -5.474   3.812
  880   HBD1  HEC 201          HBD1      HEC 105  91.459  -3.256   3.924
  881   HBD2  HEC 201          HBD2      HEC 105  92.970  -4.131   3.692
  882    H1   HOH 301           H2       HOH 200  80.542   2.296  -0.442
  883    H2   HOH 301           H1       HOH 200  81.704   3.248  -0.624
  884    H1   HOH 302           H2       HOH 201  86.273   4.553   6.118
  885    H2   HOH 302           H1       HOH 201  86.002   5.678   5.144
  886    H1   HOH 303           H2       HOH 202  83.153  -6.896   5.505
  887    H2   HOH 303           H1       HOH 202  82.996  -5.789   6.528
  888    H1   HOH 304           H2       HOH 203  81.562 -11.286  -0.476
  889    H2   HOH 304           H1       HOH 203  82.093  -9.894  -0.212
  Start of MODEL   29
    1    H1   GLY   1           H1       GLY   1  74.542  11.671  -8.892
    2    H2   GLY   1           H2       GLY   1  75.940  11.541  -7.934
    3    H3   GLY   1           H3       GLY   1  74.515  12.198  -7.279
    4    HA2  GLY   1           HA2      GLY   1  75.340   9.572  -7.159
    5    HA3  GLY   1           HA3      GLY   1  73.766  10.214  -6.688
    6    H    ASP   2           H        ASP   2  75.054   7.835  -8.419
    7    HA   ASP   2           HA       ASP   2  72.696   7.493 -10.055
    8    HB2  ASP   2           HB2      ASP   2  75.388   8.015 -11.318
    9    HB3  ASP   2           HB1      ASP   2  74.070   7.205 -12.163
   10    H    VAL   3           H        VAL   3  72.508   5.630  -8.761
   11    HA   VAL   3           HA       VAL   3  74.325   3.668  -8.204
   12    HB   VAL   3           HB       VAL   3  72.012   3.585  -7.423
   13   HG11  VAL   3          HG11      VAL   3  70.172   3.111  -8.878
   14   HG12  VAL   3          HG12      VAL   3  71.247   2.741 -10.226
   15   HG13  VAL   3          HG13      VAL   3  71.087   4.401  -9.656
   16   HG21  VAL   3          HG21      VAL   3  72.573   1.165  -9.162
   17   HG22  VAL   3          HG22      VAL   3  71.647   1.208  -7.663
   18   HG23  VAL   3          HG23      VAL   3  73.389   1.474  -7.630
   19    H    GLU   4           H        GLU   4  73.102   4.582 -11.297
   20    HA   GLU   4           HA       GLU   4  73.647   2.118 -12.657
   21    HB2  GLU   4           HB2      GLU   4  73.244   4.947 -13.643
   22    HB3  GLU   4           HB3      GLU   4  73.481   3.567 -14.716
   23    HG2  GLU   4           HG2      GLU   4  71.503   2.471 -13.839
   24    HG3  GLU   4           HG3      GLU   4  71.306   3.721 -12.613
   25    H    LYS   5           H        LYS   5  75.314   5.282 -12.744
   26    HA   LYS   5           HA       LYS   5  77.616   4.204 -14.056
   27    HB2  LYS   5           HB2      LYS   5  77.081   6.817 -12.634
   28    HB3  LYS   5           HB3      LYS   5  78.641   6.436 -13.364
   29    HG2  LYS   5           HG2      LYS   5  77.535   6.069 -15.541
   30    HG3  LYS   5           HG3      LYS   5  75.977   6.460 -14.816
   31    HD2  LYS   5           HD2      LYS   5  78.329   8.366 -14.768
   32    HD3  LYS   5           HD3      LYS   5  77.125   8.372 -16.056
   33    HE2  LYS   5           HE2      LYS   5  75.391   8.526 -14.108
   34    HE3  LYS   5           HE3      LYS   5  76.772   9.049 -13.143
   35    HZ1  LYS   5           HZ1      LYS   5  75.448  10.846 -14.285
   36    HZ2  LYS   5           HZ2      LYS   5  76.106  10.283 -15.748
   37    HZ3  LYS   5           HZ3      LYS   5  77.126  10.884 -14.530
   38    H    GLY   6           H        GLY   6  76.529   4.324 -10.811
   39    HA2  GLY   6           HA2      GLY   6  79.066   4.190  -9.501
   40    HA3  GLY   6           HA3      GLY   6  77.510   3.729  -8.805
   41    H    LYS   7           H        LYS   7  76.790   1.883 -10.852
   42    HA   LYS   7           HA       LYS   7  78.069  -0.474  -9.881
   43    HB2  LYS   7           HB2      LYS   7  75.694  -0.326 -10.726
   44    HB3  LYS   7           HB3      LYS   7  76.352  -0.200 -12.357
   45    HG2  LYS   7           HG2      LYS   7  77.678  -2.370 -11.708
   46    HG3  LYS   7           HG3      LYS   7  76.451  -2.530 -10.455
   47    HD2  LYS   7           HD2      LYS   7  75.421  -3.694 -12.178
   48    HD3  LYS   7           HD3      LYS   7  74.795  -2.075 -12.486
   49    HE2  LYS   7           HE2      LYS   7  75.615  -3.014 -14.578
   50    HE3  LYS   7           HE3      LYS   7  76.683  -1.700 -14.086
   51    HZ1  LYS   7           HZ1      LYS   7  78.380  -3.096 -13.800
   52    HZ2  LYS   7           HZ2      LYS   7  77.474  -4.209 -14.710
   53    HZ3  LYS   7           HZ3      LYS   7  77.431  -4.259 -13.012
   54    H    LYS   8           H        LYS   8  78.257   1.407 -12.889
   55    HA   LYS   8           HA       LYS   8  79.949  -0.309 -14.330
   56    HB2  LYS   8           HB2      LYS   8  78.824   1.545 -15.408
   57    HB3  LYS   8           HB3      LYS   8  79.694   2.703 -14.404
   58    HG2  LYS   8           HG2      LYS   8  81.462   0.831 -15.848
   59    HG3  LYS   8           HG3      LYS   8  80.505   1.858 -16.913
   60    HD2  LYS   8           HD2      LYS   8  81.972   3.049 -14.562
   61    HD3  LYS   8           HD3      LYS   8  82.813   2.741 -16.080
   62    HE2  LYS   8           HE2      LYS   8  81.090   4.083 -17.277
   63    HE3  LYS   8           HE3      LYS   8  80.336   4.455 -15.727
   64    HZ1  LYS   8           HZ1      LYS   8  82.051   6.081 -16.727
   65    HZ2  LYS   8           HZ2      LYS   8  83.202   4.983 -16.131
   66    HZ3  LYS   8           HZ3      LYS   8  82.111   5.734 -15.068
   67    H    ILE   9           H        ILE   9  80.753   2.451 -12.227
   68    HA   ILE   9           HA       ILE   9  83.562   2.202 -12.502
   69    HB   ILE   9           HB       ILE   9  81.920   3.424 -10.272
   70   HG12  ILE   9          HG12      ILE   9  83.340   4.790 -12.573
   71   HG13  ILE   9          HG13      ILE   9  81.641   4.321 -12.648
   72   HG21  ILE   9          HG21      ILE   9  84.071   4.736  -9.920
   73   HG22  ILE   9          HG22      ILE   9  84.862   3.562 -10.971
   74   HG23  ILE   9          HG23      ILE   9  84.141   3.038  -9.450
   75   HD11  ILE   9          HD11      ILE   9  82.017   6.703 -11.905
   76   HD12  ILE   9          HD12      ILE   9  82.804   6.067 -10.461
   77   HD13  ILE   9          HD13      ILE   9  81.099   5.727 -10.758
   78    H    PHE  10           H        PHE  10  81.218   0.529 -10.563
   79    HA   PHE  10           HA       PHE  10  83.101  -0.426  -8.606
   80    HB2  PHE  10           HB2      PHE  10  80.955  -0.397  -7.738
   81    HB3  PHE  10           HB1      PHE  10  80.226  -0.951  -9.244
   82    HD1  PHE  10           HD1      PHE  10  80.249  -3.319  -9.869
   83    HD2  PHE  10           HD2      PHE  10  81.960  -1.971  -6.169
   84    HE1  PHE  10           HE1      PHE  10  80.333  -5.661  -9.058
   85    HE2  PHE  10           HE2      PHE  10  82.047  -4.312  -5.357
   86    HZ   PHE  10           HZ       PHE  10  81.234  -6.158  -6.803
   87    H    VAL  11           H        VAL  11  81.367  -1.994 -11.312
   88    HA   VAL  11           HA       VAL  11  82.469  -4.529 -11.071
   89    HB   VAL  11           HB       VAL  11  81.991  -4.791 -13.495
   90   HG11  VAL  11          HG11      VAL  11  79.777  -3.256 -12.135
   91   HG12  VAL  11          HG12      VAL  11  80.244  -4.875 -11.618
   92   HG13  VAL  11          HG13      VAL  11  79.636  -4.611 -13.253
   93   HG21  VAL  11          HG21      VAL  11  82.668  -2.456 -14.115
   94   HG22  VAL  11          HG22      VAL  11  81.207  -1.873 -13.321
   95   HG23  VAL  11          HG23      VAL  11  81.082  -2.909 -14.741
   96    H    GLN  12           H        GLN  12  83.845  -1.627 -12.443
   97    HA   GLN  12           HA       GLN  12  86.124  -3.151 -13.490
   98    HB2  GLN  12           HB2      GLN  12  86.825  -1.015 -14.491
   99    HB3  GLN  12           HB1      GLN  12  85.189  -1.472 -14.954
  100    HG2  GLN  12           HG2      GLN  12  84.556  -0.009 -12.807
  101    HG3  GLN  12           HG1      GLN  12  86.107   0.744 -13.166
  102   HE21  GLN  12          HE21      GLN  12  83.591  -0.549 -15.392
  103   HE22  GLN  12          HE22      GLN  12  83.390   0.907 -16.232
  104    H    LYS  13           H        LYS  13  85.372  -1.058 -10.772
  105    HA   LYS  13           HA       LYS  13  88.249  -0.772 -10.203
  106    HB2  LYS  13           HB2      LYS  13  85.846   0.611  -9.019
  107    HB3  LYS  13           HB3      LYS  13  87.493   0.838  -8.447
  108    HG2  LYS  13           HG2      LYS  13  87.981   1.298 -11.021
  109    HG3  LYS  13           HG3      LYS  13  86.264   1.686 -11.050
  110    HD2  LYS  13           HD2      LYS  13  87.159   3.762 -10.514
  111    HD3  LYS  13           HD3      LYS  13  86.865   3.111  -8.902
  112    HE2  LYS  13           HE2      LYS  13  89.255   2.200  -8.990
  113    HE3  LYS  13           HE3      LYS  13  89.482   3.216 -10.412
  114    HZ1  LYS  13           HZ1      LYS  13  89.900   4.044  -7.914
  115    HZ2  LYS  13           HZ2      LYS  13  88.282   4.522  -8.120
  116    HZ3  LYS  13           HZ3      LYS  13  89.479   5.082  -9.188
  117    H    CYS  14           H        CYS  14  85.357  -1.427  -8.162
  118    HA   CYS  14           HA       CYS  14  87.095  -2.662  -6.197
  119    HB2  CYS  14           HB2      CYS  14  84.126  -2.622  -5.936
  120    HB3  CYS  14           HB1      CYS  14  85.358  -2.447  -4.690
  121    H    ALA  15           H        ALA  15  84.613  -3.842  -8.439
  122    HA   ALA  15           HA       ALA  15  84.120  -6.330  -7.377
  123    HB1  ALA  15           HB1      ALA  15  84.069  -7.090  -9.865
  124    HB2  ALA  15           HB2      ALA  15  84.386  -5.391 -10.214
  125    HB3  ALA  15           HB3      ALA  15  82.933  -5.853  -9.327
  126    H    GLN  16           H        GLN  16  87.067  -5.167  -8.818
  127    HA   GLN  16           HA       GLN  16  88.386  -7.451  -9.575
  128    HB2  GLN  16           HB2      GLN  16  89.235  -4.848  -8.421
  129    HB3  GLN  16           HB1      GLN  16  90.433  -6.141  -8.416
  130    HG2  GLN  16           HG2      GLN  16  90.032  -6.480 -10.851
  131    HG3  GLN  16           HG1      GLN  16  88.909  -5.122 -10.832
  132   HE21  GLN  16          HE21      GLN  16  90.864  -3.872  -8.700
  133   HE22  GLN  16          HE22      GLN  16  92.080  -3.194  -9.671
  134    H    CYS  17           H        CYS  17  88.433  -6.087  -6.251
  135    HA   CYS  17           HA       CYS  17  88.896  -8.839  -5.261
  136    HB2  CYS  17           HB2      CYS  17  90.108  -6.677  -3.656
  137    HB3  CYS  17           HB1      CYS  17  90.745  -8.260  -4.080
  138    H    HIS  18           H        HSD  18  86.347  -8.048  -5.313
  139    HA   HIS  18           HA       HSD  18  85.692  -7.868  -2.499
  140    HB2  HIS  18           HB2      HSD  18  85.170  -5.577  -4.366
  141    HB3  HIS  18           HB1      HSD  18  84.045  -5.910  -3.053
  142    HD1  HIS  18           HD1      HSD  18  84.980  -5.717  -0.597
  143    HD2  HIS  18           HD2      HSD  18  87.641  -4.495  -3.559
  144    HE1  HIS  18           HE1      HSD  18  86.821  -4.431   0.580
  145    H    THR  19           H        THR  19  83.105  -7.518  -2.425
  146    HA   THR  19           HA       THR  19  81.841  -9.124  -4.542
  147    HB   THR  19           HB       THR  19  80.878  -9.858  -1.883
  148    HG1  THR  19           HG1      THR  19  83.027 -11.214  -1.877
  149   HG21  THR  19          HG21      THR  19  80.500 -11.018  -4.105
  150   HG22  THR  19          HG22      THR  19  81.030 -12.070  -2.793
  151   HG23  THR  19          HG23      THR  19  82.179 -11.548  -4.025
  152    H    VAL  20           H        VAL  20  81.514  -7.050  -1.716
  153    HA   VAL  20           HA       VAL  20  79.787  -5.725  -0.965
  154    HB   VAL  20           HB       VAL  20  79.112  -4.056  -2.572
  155   HG11  VAL  20          HG11      VAL  20  81.324  -3.358  -3.348
  156   HG12  VAL  20          HG12      VAL  20  81.938  -4.997  -3.139
  157   HG13  VAL  20          HG13      VAL  20  81.454  -4.053  -1.732
  158   HG21  VAL  20          HG21      VAL  20  79.423  -4.295  -4.926
  159   HG22  VAL  20          HG22      VAL  20  78.646  -5.786  -4.404
  160   HG23  VAL  20          HG23      VAL  20  80.376  -5.761  -4.723
  161    H    GLU  21           H        GLU  21  78.906  -8.437  -1.524
  162    HA   GLU  21           HA       GLU  21  76.055  -7.826  -1.938
  163    HB2  GLU  21           HB2      GLU  21  75.737  -9.772  -3.354
  164    HB3  GLU  21           HB3      GLU  21  76.945  -8.713  -4.080
  165    HG2  GLU  21           HG2      GLU  21  78.682 -10.169  -2.832
  166    HG3  GLU  21           HG3      GLU  21  77.366 -11.326  -2.637
  167    H    LYS  22           H        LYS  22  74.945  -8.504  -0.249
  168    HA   LYS  22           HA       LYS  22  75.806  -9.739   1.991
  169    HB2  LYS  22           HB2      LYS  22  73.412  -8.884   1.277
  170    HB3  LYS  22           HB3      LYS  22  73.124 -10.591   0.954
  171    HG2  LYS  22           HG2      LYS  22  72.490 -10.436   3.196
  172    HG3  LYS  22           HG3      LYS  22  74.173 -10.935   3.344
  173    HD2  LYS  22           HD2      LYS  22  74.255  -9.132   4.771
  174    HD3  LYS  22           HD3      LYS  22  74.534  -8.259   3.265
  175    HE2  LYS  22           HE2      LYS  22  71.847  -8.653   4.619
  176    HE3  LYS  22           HE3      LYS  22  72.776  -7.154   4.575
  177    HZ1  LYS  22           HZ1      LYS  22  71.136  -7.064   2.872
  178    HZ2  LYS  22           HZ2      LYS  22  71.580  -8.590   2.269
  179    HZ3  LYS  22           HZ3      LYS  22  72.640  -7.271   2.116
  180    H    GLY  23           H        GLY  23  76.376 -11.733   2.674
  181    HA2  GLY  23           HA2      GLY  23  76.948 -13.961   2.597
  182    HA3  GLY  23           HA3      GLY  23  75.559 -14.177   1.534
  183    H    GLY  24           H        GLY  24  78.130 -11.965   0.739
  184    HA2  GLY  24           HA2      GLY  24  78.739 -13.525  -1.654
  185    HA3  GLY  24           HA3      GLY  24  79.218 -11.865  -1.343
  186    H    LYS  25           H        LYS  25  80.180 -15.034  -1.378
  187    HA   LYS  25           HA       LYS  25  82.071 -15.390   0.579
  188    HB2  LYS  25           HB2      LYS  25  83.380 -16.601  -1.359
  189    HB3  LYS  25           HB3      LYS  25  81.827 -17.233  -0.814
  190    HG2  LYS  25           HG2      LYS  25  80.678 -16.405  -2.676
  191    HG3  LYS  25           HG3      LYS  25  81.912 -15.196  -3.026
  192    HD2  LYS  25           HD2      LYS  25  82.574 -18.133  -3.187
  193    HD3  LYS  25           HD3      LYS  25  81.772 -17.329  -4.535
  194    HE2  LYS  25           HE2      LYS  25  83.657 -15.562  -4.352
  195    HE3  LYS  25           HE3      LYS  25  84.499 -16.762  -3.371
  196    HZ1  LYS  25           HZ1      LYS  25  83.378 -17.440  -6.018
  197    HZ2  LYS  25           HZ2      LYS  25  84.574 -18.260  -5.132
  198    HZ3  LYS  25           HZ3      LYS  25  84.927 -16.767  -5.862
  199    H    HIS  26           H        HIS  26  83.550 -13.970   1.257
  200    HA   HIS  26           HA       HIS  26  84.624 -11.874  -0.298
  201    HB2  HIS  26           HB2      HIS  26  86.413 -11.941   1.624
  202    HB3  HIS  26           HB1      HIS  26  84.752 -11.477   1.990
  203    HD1  HIS  26           HD1      HIS  26  87.134 -14.397   2.270
  204    HD2  HIS  26           HD2      HIS  26  83.355 -13.286   3.636
  205    HE1  HIS  26           HE1      HIS  26  86.461 -16.122   3.999
  206    HE2  HIS  26           HE2      HIS  26  84.159 -15.458   4.842
  207    H    LYS  27           H        LYS  27  86.178 -11.858  -1.768
  208    HA   LYS  27           HA       LYS  27  88.158 -14.059  -1.797
  209    HB2  LYS  27           HB2      LYS  27  88.048 -14.124  -4.216
  210    HB3  LYS  27           HB3      LYS  27  86.421 -14.351  -3.573
  211    HG2  LYS  27           HG2      LYS  27  86.119 -11.824  -3.835
  212    HG3  LYS  27           HG3      LYS  27  87.602 -11.848  -4.789
  213    HD2  LYS  27           HD2      LYS  27  86.613 -13.439  -6.357
  214    HD3  LYS  27           HD3      LYS  27  85.148 -13.527  -5.378
  215    HE2  LYS  27           HE2      LYS  27  84.906 -11.991  -7.332
  216    HE3  LYS  27           HE3      LYS  27  84.682 -11.168  -5.788
  217    HZ1  LYS  27           HZ1      LYS  27  86.197 -10.085  -7.511
  218    HZ2  LYS  27           HZ2      LYS  27  87.329 -11.280  -7.092
  219    HZ3  LYS  27           HZ3      LYS  27  86.768 -10.187  -5.918
  220    H    THR  28           H        THR  28  90.232 -13.424  -1.981
  221    HA   THR  28           HA       THR  28  92.009 -11.952  -1.857
  222    HB   THR  28           HB       THR  28  90.767 -10.568  -4.221
  223    HG1  THR  28           HG1      THR  28  91.336 -12.299  -5.475
  224   HG21  THR  28          HG21      THR  28  93.003 -10.277  -4.918
  225   HG22  THR  28          HG22      THR  28  93.590 -11.564  -3.863
  226   HG23  THR  28          HG23      THR  28  93.075 -10.025  -3.173
  227    H    GLY  29           H        GLY  29  89.522 -11.191  -0.428
  228    HA2  GLY  29           HA2      GLY  29  90.205  -8.866   0.782
  229    HA3  GLY  29           HA3      GLY  29  89.309  -8.315  -0.631
  230    HA   PRO  30           HA       PRO  30  86.461  -9.920   2.879
  231    HB2  PRO  30           HB2      PRO  30  85.978  -7.640   4.300
  232    HB3  PRO  30           HB1      PRO  30  87.307  -8.751   4.684
  233    HG2  PRO  30           HG2      PRO  30  87.374  -6.169   3.194
  234    HG3  PRO  30           HG1      PRO  30  88.512  -6.810   4.392
  235    HD2  PRO  30           HD2      PRO  30  88.978  -6.912   1.693
  236    HD3  PRO  30           HD1      PRO  30  89.629  -8.107   2.837
  237    H    ASN  31           H        ASN  31  84.192  -8.924   3.410
  238    HA   ASN  31           HA       ASN  31  83.099  -7.869   0.886
  239    HB2  ASN  31           HB2      ASN  31  80.980  -8.694   1.630
  240    HB3  ASN  31           HB1      ASN  31  82.156  -9.964   1.962
  241   HD21  ASN  31          HD21      ASN  31  82.829 -10.268   4.235
  242   HD22  ASN  31          HD22      ASN  31  81.866  -9.673   5.501
  243    H    LEU  32           H        LEU  32  81.397  -6.226   1.032
  244    HA   LEU  32           HA       LEU  32  81.915  -4.321   3.241
  245    HB2  LEU  32           HB2      LEU  32  80.891  -3.605   0.490
  246    HB3  LEU  32           HB3      LEU  32  81.477  -2.513   1.739
  247    HG   LEU  32           HG       LEU  32  83.089  -4.478   0.092
  248   HD11  LEU  32          HD11      LEU  32  83.043  -1.470   0.441
  249   HD12  LEU  32          HD12      LEU  32  82.801  -2.395  -1.039
  250   HD13  LEU  32          HD13      LEU  32  84.399  -2.312  -0.306
  251   HD21  LEU  32          HD21      LEU  32  83.715  -3.141   2.708
  252   HD22  LEU  32          HD22      LEU  32  85.003  -3.334   1.526
  253   HD23  LEU  32          HD23      LEU  32  84.160  -4.748   2.146
  254    H    HIS  33           H        HIS  33  80.000  -6.441   3.419
  255    HA   HIS  33           HA       HIS  33  77.371  -5.567   2.801
  256    HB2  HIS  33           HB2      HIS  33  78.214  -7.436   5.027
  257    HB3  HIS  33           HB1      HIS  33  76.624  -7.339   4.270
  258    HD1  HIS  33           HD1      HIS  33  78.599  -9.882   4.249
  259    HD2  HIS  33           HD2      HIS  33  77.974  -7.211   1.110
  260    HE1  HIS  33           HE1      HIS  33  79.236 -11.109   2.127
  261    HE2  HIS  33           HE2      HIS  33  78.859  -9.493   0.204
  262    H    GLY  34           H        GLY  34  75.847  -4.476   4.032
  263    HA2  GLY  34           HA2      GLY  34  75.281  -2.667   5.400
  264    HA3  GLY  34           HA3      GLY  34  75.685  -3.847   6.646
  265    H    LEU  35           H        LEU  35  78.054  -2.652   4.410
  266    HA   LEU  35           HA       LEU  35  80.038  -2.041   6.183
  267    HB2  LEU  35           HB2      LEU  35  80.408  -2.096   3.788
  268    HB3  LEU  35           HB3      LEU  35  79.366  -0.696   3.559
  269    HG   LEU  35           HG       LEU  35  81.107   0.390   5.297
  270   HD11  LEU  35          HD11      LEU  35  82.911  -1.416   3.714
  271   HD12  LEU  35          HD12      LEU  35  82.310  -1.914   5.293
  272   HD13  LEU  35          HD13      LEU  35  83.293  -0.457   5.140
  273   HD21  LEU  35          HD21      LEU  35  81.800   0.034   2.371
  274   HD22  LEU  35          HD22      LEU  35  82.222   1.396   3.409
  275   HD23  LEU  35          HD23      LEU  35  80.540   1.126   2.949
  276    H    PHE  36           H        PHE  36  77.820   0.354   4.772
  277    HA   PHE  36           HA       PHE  36  78.649   2.563   6.228
  278    HB2  PHE  36           HB2      PHE  36  75.793   2.041   5.384
  279    HB3  PHE  36           HB1      PHE  36  76.584   3.604   5.594
  280    HD1  PHE  36           HD2      PHE  36  76.570   0.497   3.535
  281    HD2  PHE  36           HD1      PHE  36  77.915   4.568   3.853
  282    HE1  PHE  36           HE2      PHE  36  77.358   0.424   1.188
  283    HE2  PHE  36           HE1      PHE  36  78.691   4.493   1.509
  284    HZ   PHE  36           HZ       PHE  36  78.415   2.423   0.170
  285    H    GLY  37           H        GLY  37  79.042   2.121   8.407
  286    HA2  GLY  37           HA2      GLY  37  77.607   2.834  10.416
  287    HA3  GLY  37           HA3      GLY  37  76.696   1.382  10.046
  288    H    ARG  38           H        ARG  38  79.199  -0.102   9.302
  289    HA   ARG  38           HA       ARG  38  79.847  -0.939  12.015
  290    HB2  ARG  38           HB2      ARG  38  80.120  -2.074   9.302
  291    HB3  ARG  38           HB3      ARG  38  81.417  -2.491  10.420
  292    HG2  ARG  38           HG2      ARG  38  79.600  -3.143  12.091
  293    HG3  ARG  38           HG3      ARG  38  78.453  -3.000  10.759
  294    HD2  ARG  38           HD2      ARG  38  80.894  -4.625  10.239
  295    HD3  ARG  38           HD3      ARG  38  79.717  -5.312  11.350
  296    HE   ARG  38           HE       ARG  38  78.098  -4.670   9.361
  297   HH11  ARG  38          HH21      ARG  38  81.301  -6.011   9.241
  298   HH12  ARG  38          HH22      ARG  38  81.030  -6.857   7.756
  299   HH21  ARG  38          HH11      ARG  38  77.750  -5.796   7.427
  300   HH22  ARG  38          HH12      ARG  38  79.024  -6.742   6.736
  301    H    LYS  39           H        LYS  39  81.828  -0.880  12.998
  302    HA   LYS  39           HA       LYS  39  83.552   1.279  12.390
  303    HB2  LYS  39           HB2      LYS  39  83.668  -1.036  14.295
  304    HB3  LYS  39           HB3      LYS  39  85.070   0.012  14.090
  305    HG2  LYS  39           HG2      LYS  39  82.439   1.362  14.488
  306    HG3  LYS  39           HG3      LYS  39  83.130   0.540  15.886
  307    HD2  LYS  39           HD2      LYS  39  85.237   1.803  15.590
  308    HD3  LYS  39           HD3      LYS  39  84.539   2.635  14.201
  309    HE2  LYS  39           HE2      LYS  39  84.188   4.140  15.985
  310    HE3  LYS  39           HE3      LYS  39  82.636   3.320  15.822
  311    HZ1  LYS  39           HZ1      LYS  39  83.025   3.147  18.060
  312    HZ2  LYS  39           HZ2      LYS  39  84.707   2.990  17.881
  313    HZ3  LYS  39           HZ3      LYS  39  83.685   1.683  17.515
  314    H    THR  40           H        THR  40  86.023   0.883  12.258
  315    HA   THR  40           HA       THR  40  86.566  -0.396   9.778
  316    HB   THR  40           HB       THR  40  88.986   0.114  10.448
  317    HG1  THR  40           HG1      THR  40  87.975   1.821  12.363
  318   HG21  THR  40          HG21      THR  40  87.619   1.587   9.018
  319   HG22  THR  40          HG22      THR  40  88.661   2.522  10.089
  320   HG23  THR  40          HG23      THR  40  86.945   2.352  10.456
  321    H    GLY  41           H        GLY  41  87.803  -2.205   9.309
  322    HA2  GLY  41           HA2      GLY  41  88.309  -4.439   9.565
  323    HA3  GLY  41           HA3      GLY  41  89.256  -3.852  10.928
  324    H    GLN  42           H        GLN  42  85.755  -4.153  10.331
  325    HA   GLN  42           HA       GLN  42  85.535  -5.619  12.894
  326    HB2  GLN  42           HB2      GLN  42  84.370  -3.332  12.565
  327    HB3  GLN  42           HB1      GLN  42  83.250  -4.214  11.528
  328    HG2  GLN  42           HG2      GLN  42  82.877  -5.828  13.420
  329    HG3  GLN  42           HG1      GLN  42  83.854  -4.776  14.443
  330   HE21  GLN  42          HE21      GLN  42  82.377  -2.666  12.386
  331   HE22  GLN  42          HE22      GLN  42  80.975  -2.322  13.279
  332    H    ALA  43           H        ALA  43  85.194  -5.868   9.509
  333    HA   ALA  43           HA       ALA  43  83.096  -7.784   9.404
  334    HB1  ALA  43           HB1      ALA  43  84.575  -8.293   7.166
  335    HB2  ALA  43           HB2      ALA  43  85.075  -6.646   7.549
  336    HB3  ALA  43           HB3      ALA  43  83.371  -7.012   7.296
  337    HA   PRO  44           HA       PRO  44  85.713 -11.123  10.927
  338    HB2  PRO  44           HB2      PRO  44  83.773 -12.975  11.263
  339    HB3  PRO  44           HB1      PRO  44  83.935 -11.583  12.354
  340    HG2  PRO  44           HG2      PRO  44  82.034 -12.004  10.096
  341    HG3  PRO  44           HG1      PRO  44  81.751 -11.280  11.688
  342    HD2  PRO  44           HD2      PRO  44  82.166  -9.820   9.374
  343    HD3  PRO  44           HD1      PRO  44  82.476  -9.204  11.014
  344    H    GLY  45           H        GLY  45  86.988 -12.203   9.524
  345    HA2  GLY  45           HA2      GLY  45  86.444 -14.398   8.053
  346    HA3  GLY  45           HA3      GLY  45  85.980 -13.101   6.954
  347    H    PHE  46           H        PHE  46  87.594 -11.576   6.285
  348    HA   PHE  46           HA       PHE  46  90.127 -12.790   5.756
  349    HB2  PHE  46           HB2      PHE  46  88.912 -11.142   4.261
  350    HB3  PHE  46           HB1      PHE  46  89.401  -9.878   5.390
  351    HD1  PHE  46           HD1      PHE  46  90.778 -12.663   3.304
  352    HD2  PHE  46           HD2      PHE  46  91.531  -8.892   5.218
  353    HE1  PHE  46           HE1      PHE  46  93.005 -12.557   2.219
  354    HE2  PHE  46           HE2      PHE  46  93.759  -8.786   4.133
  355    HZ   PHE  46           HZ       PHE  46  94.495 -10.618   2.633
  356    H    THR  47           H        THR  47  92.195 -12.089   6.437
  357    HA   THR  47           HA       THR  47  92.337 -11.376   9.206
  358    HB   THR  47           HB       THR  47  94.641 -11.396   7.259
  359    HG1  THR  47           HG1      THR  47  93.077 -13.460   8.287
  360   HG21  THR  47          HG21      THR  47  94.377 -12.012  10.214
  361   HG22  THR  47          HG22      THR  47  95.118 -10.571   9.516
  362   HG23  THR  47          HG23      THR  47  95.866 -12.151   9.279
  363    H    TYR  48           H        TYR  48  91.238  -9.317   9.165
  364    HA   TYR  48           HA       TYR  48  92.035  -7.080   7.684
  365    HB2  TYR  48           HB2      TYR  48  90.555  -7.521  10.231
  366    HB3  TYR  48           HB3      TYR  48  91.146  -5.892   9.922
  367    HD1  TYR  48           HD1      TYR  48  90.453  -4.669   7.891
  368    HD2  TYR  48           HD2      TYR  48  88.761  -8.474   8.924
  369    HE1  TYR  48           HE1      TYR  48  88.586  -4.259   6.322
  370    HE2  TYR  48           HE2      TYR  48  86.887  -8.066   7.352
  371    HH   TYR  48           HH       TYR  48  86.342  -4.966   5.933
  372    H    THR  49           H        THR  49  93.311  -5.263   8.256
  373    HA   THR  49           HA       THR  49  95.771  -5.987   9.604
  374    HB   THR  49           HB       THR  49  96.525  -3.745   8.891
  375    HG1  THR  49           HG1      THR  49  94.573  -2.648   9.084
  376   HG21  THR  49          HG21      THR  49  96.022  -4.121   6.374
  377   HG22  THR  49          HG22      THR  49  95.154  -5.558   6.911
  378   HG23  THR  49          HG23      THR  49  96.879  -5.394   7.244
  379    H    ASP  50           H        ASP  50  96.738  -4.627  11.269
  380    HA   ASP  50           HA       ASP  50  95.105  -4.296  13.520
  381    HB2  ASP  50           HB2      ASP  50  97.069  -2.902  14.376
  382    HB3  ASP  50           HB1      ASP  50  97.427  -4.560  13.894
  383    H    ALA  51           H        ALA  51  96.409  -1.863  11.279
  384    HA   ALA  51           HA       ALA  51  95.433   0.439  12.455
  385    HB1  ALA  51           HB1      ALA  51  95.572   1.469  10.279
  386    HB2  ALA  51           HB2      ALA  51  95.491  -0.103   9.482
  387    HB3  ALA  51           HB3      ALA  51  96.907   0.328  10.441
  388    H    ASN  52           H        ASN  52  93.733  -1.818  10.310
  389    HA   ASN  52           HA       ASN  52  91.308  -0.236  10.349
  390    HB2  ASN  52           HB2      ASN  52  92.356  -2.222   8.686
  391    HB3  ASN  52           HB1      ASN  52  91.000  -3.011   9.483
  392   HD21  ASN  52          HD21      ASN  52  90.123  -2.916   7.139
  393   HD22  ASN  52          HD22      ASN  52  89.288  -1.510   6.684
  394    H    LYS  53           H        LYS  53  92.678  -2.899  12.111
  395    HA   LYS  53           HA       LYS  53  90.173  -3.586  13.416
  396    HB2  LYS  53           HB2      LYS  53  91.407  -5.519  13.195
  397    HB3  LYS  53           HB3      LYS  53  92.945  -4.677  13.320
  398    HG2  LYS  53           HG2      LYS  53  92.710  -4.455  15.714
  399    HG3  LYS  53           HG3      LYS  53  91.059  -5.075  15.652
  400    HD2  LYS  53           HD2      LYS  53  91.991  -7.219  14.699
  401    HD3  LYS  53           HD3      LYS  53  93.606  -6.591  15.031
  402    HE2  LYS  53           HE2      LYS  53  93.058  -7.908  16.934
  403    HE3  LYS  53           HE3      LYS  53  92.799  -6.239  17.444
  404    HZ1  LYS  53           HZ1      LYS  53  90.903  -8.372  17.128
  405    HZ2  LYS  53           HZ2      LYS  53  90.418  -6.936  16.358
  406    HZ3  LYS  53           HZ3      LYS  53  90.777  -6.935  18.019
  407    H    ASN  54           H        ASN  54  92.437  -1.195  13.668
  408    HA   ASN  54           HA       ASN  54  92.732  -0.988  16.504
  409    HB2  ASN  54           HB2      ASN  54  93.904   0.946  16.067
  410    HB3  ASN  54           HB1      ASN  54  94.084   0.118  14.526
  411   HD21  ASN  54          HD21      ASN  54  91.383   0.625  13.549
  412   HD22  ASN  54          HD22      ASN  54  91.261   2.289  13.246
  413    H    LYS  55           H        LYS  55  90.253  -0.266  14.284
  414    HA   LYS  55           HA       LYS  55  88.173   0.712  14.497
  415    HB2  LYS  55           HB2      LYS  55  88.828  -0.071  17.321
  416    HB3  LYS  55           HB3      LYS  55  87.396   0.902  17.008
  417    HG2  LYS  55           HG2      LYS  55  86.611  -1.325  16.914
  418    HG3  LYS  55           HG3      LYS  55  86.803  -0.868  15.225
  419    HD2  LYS  55           HD2      LYS  55  88.926  -2.014  15.087
  420    HD3  LYS  55           HD3      LYS  55  88.919  -2.329  16.823
  421    HE2  LYS  55           HE2      LYS  55  86.731  -3.595  16.441
  422    HE3  LYS  55           HE3      LYS  55  87.091  -3.498  14.717
  423    HZ1  LYS  55           HZ1      LYS  55  87.998  -5.403  16.438
  424    HZ2  LYS  55           HZ2      LYS  55  89.334  -4.367  16.266
  425    HZ3  LYS  55           HZ3      LYS  55  88.624  -5.079  14.895
  426    H    GLY  56           H        GLY  56  89.667   2.616  13.771
  427    HA2  GLY  56           HA2      GLY  56  89.842   4.723  15.805
  428    HA3  GLY  56           HA3      GLY  56  90.543   4.777  14.191
  429    H    ILE  57           H        ILE  57  88.099   3.920  12.855
  430    HA   ILE  57           HA       ILE  57  86.177   6.053  13.450
  431    HB   ILE  57           HB       ILE  57  86.186   6.904  11.176
  432   HG12  ILE  57          HG12      ILE  57  88.370   6.045   9.842
  433   HG13  ILE  57          HG13      ILE  57  88.031   4.584  10.764
  434   HG21  ILE  57          HG21      ILE  57  87.809   7.778  12.922
  435   HG22  ILE  57          HG22      ILE  57  88.268   8.089  11.248
  436   HG23  ILE  57          HG23      ILE  57  89.049   6.789  12.148
  437   HD11  ILE  57          HD11      ILE  57  86.923   4.815   8.438
  438   HD12  ILE  57          HD12      ILE  57  85.855   5.987   9.204
  439   HD13  ILE  57          HD13      ILE  57  85.890   4.320   9.775
  440    H    THR  58           H        THR  58  84.392   5.873  11.565
  441    HA   THR  58           HA       THR  58  83.798   2.996  11.227
  442    HB   THR  58           HB       THR  58  81.960   5.224  12.102
  443    HG1  THR  58           HG1      THR  58  81.583   3.286  13.621
  444   HG21  THR  58          HG21      THR  58  81.354   2.494  10.972
  445   HG22  THR  58          HG22      THR  58  80.669   4.046  10.499
  446   HG23  THR  58          HG23      THR  58  80.227   3.320  12.044
  447    H    TRP  59           H        TRP  59  82.940   2.347   9.318
  448    HA   TRP  59           HA       TRP  59  83.326   3.964   7.024
  449    HB2  TRP  59           HB2      TRP  59  81.479   1.588   7.108
  450    HB3  TRP  59           HB1      TRP  59  82.483   2.156   5.774
  451    HD1  TRP  59           HD1      TRP  59  85.251   2.431   7.177
  452    HE1  TRP  59           HE1      TRP  59  86.523   0.328   7.981
  453    HE3  TRP  59           HE3      TRP  59  81.386  -0.882   7.535
  454    HZ2  TRP  59           HZ2      TRP  59  85.962  -2.374   8.713
  455    HZ3  TRP  59           HZ3      TRP  59  81.783  -3.211   8.277
  456    HH2  TRP  59           HH2      TRP  59  84.067  -3.959   8.867
  457    H    LYS  60           H        LYS  60  81.942   5.205   5.861
  458    HA   LYS  60           HA       LYS  60  79.087   5.191   6.381
  459    HB2  LYS  60           HB2      LYS  60  80.825   7.566   7.090
  460    HB3  LYS  60           HB3      LYS  60  79.077   7.660   6.892
  461    HG2  LYS  60           HG2      LYS  60  78.938   5.757   8.613
  462    HG3  LYS  60           HG3      LYS  60  80.633   6.095   8.957
  463    HD2  LYS  60           HD2      LYS  60  78.515   8.254   9.018
  464    HD3  LYS  60           HD3      LYS  60  78.924   7.292  10.437
  465    HE2  LYS  60           HE2      LYS  60  81.327   7.980  10.123
  466    HE3  LYS  60           HE3      LYS  60  80.788   9.078   8.853
  467    HZ1  LYS  60           HZ1      LYS  60  79.384   9.228  11.399
  468    HZ2  LYS  60           HZ2      LYS  60  79.828  10.468  10.325
  469    HZ3  LYS  60           HZ3      LYS  60  80.980   9.802  11.382
  470    H    GLU  61           H        GLU  61  78.451   7.616   5.168
  471    HA   GLU  61           HA       GLU  61  78.945   6.958   2.415
  472    HB2  GLU  61           HB2      GLU  61  76.788   7.892   3.211
  473    HB3  GLU  61           HB3      GLU  61  77.609   9.406   3.592
  474    HG2  GLU  61           HG2      GLU  61  78.196   9.753   1.274
  475    HG3  GLU  61           HG3      GLU  61  77.607   8.150   0.836
  476    H    GLU  62           H        GLU  62  79.607   9.901   4.337
  477    HA   GLU  62           HA       GLU  62  81.318  11.034   2.361
  478    HB2  GLU  62           HB2      GLU  62  81.065  11.657   5.314
  479    HB3  GLU  62           HB3      GLU  62  81.903  12.658   4.128
  480    HG2  GLU  62           HG2      GLU  62  79.854  13.051   2.910
  481    HG3  GLU  62           HG3      GLU  62  78.984  11.883   3.903
  482    H    THR  63           H        THR  63  81.911   9.165   5.316
  483    HA   THR  63           HA       THR  63  84.694   9.432   5.431
  484    HB   THR  63           HB       THR  63  84.677   7.325   6.693
  485    HG1  THR  63           HG1      THR  63  82.472   6.403   6.903
  486   HG21  THR  63          HG21      THR  63  82.432   9.275   7.197
  487   HG22  THR  63          HG22      THR  63  84.017   9.216   7.967
  488   HG23  THR  63          HG23      THR  63  82.816   7.974   8.322
  489    H    LEU  64           H        LEU  64  82.642   7.309   3.518
  490    HA   LEU  64           HA       LEU  64  84.747   5.688   2.495
  491    HB2  LEU  64           HB2      LEU  64  81.877   6.002   2.051
  492    HB3  LEU  64           HB3      LEU  64  82.752   5.663   0.566
  493    HG   LEU  64           HG       LEU  64  83.193   4.029   3.067
  494   HD11  LEU  64          HD11      LEU  64  80.907   4.045   1.209
  495   HD12  LEU  64          HD12      LEU  64  81.050   3.327   2.810
  496   HD13  LEU  64          HD13      LEU  64  81.657   2.461   1.399
  497   HD21  LEU  64          HD21      LEU  64  83.479   3.173   0.185
  498   HD22  LEU  64          HD22      LEU  64  84.261   2.502   1.615
  499   HD23  LEU  64          HD23      LEU  64  84.773   4.065   0.982
  500    H    MET  65           H        MET  65  83.240   8.716   1.480
  501    HA   MET  65           HA       MET  65  84.289   8.872  -1.117
  502    HB2  MET  65           HB2      MET  65  83.679  11.097   0.838
  503    HB3  MET  65           HB1      MET  65  83.993  11.328  -0.882
  504    HG2  MET  65           HG2      MET  65  82.061  10.046  -1.494
  505    HG3  MET  65           HG1      MET  65  81.827   9.499   0.165
  506    HE1  MET  65           HE1      MET  65  80.206  13.125  -1.863
  507    HE2  MET  65           HE2      MET  65  80.330  11.436  -2.348
  508    HE3  MET  65           HE3      MET  65  81.774  12.445  -2.320
  509    H    GLU  66           H        GLU  66  85.595  10.409   1.836
  510    HA   GLU  66           HA       GLU  66  87.985  11.302   0.638
  511    HB2  GLU  66           HB2      GLU  66  87.479  10.556   3.531
  512    HB3  GLU  66           HB3      GLU  66  88.823  11.531   2.938
  513    HG2  GLU  66           HG2      GLU  66  86.002  12.343   2.280
  514    HG3  GLU  66           HG3      GLU  66  86.667  12.719   3.868
  515    H    TYR  67           H        TYR  67  87.005   8.267   2.025
  516    HA   TYR  67           HA       TYR  67  89.647   7.106   2.087
  517    HB2  TYR  67           HB2      TYR  67  88.103   6.272   3.686
  518    HB3  TYR  67           HB3      TYR  67  86.857   6.038   2.469
  519    HD1  TYR  67           HD2      TYR  67  87.093   4.225   0.758
  520    HD2  TYR  67           HD1      TYR  67  89.796   4.618   4.073
  521    HE1  TYR  67           HE2      TYR  67  87.873   1.899   0.399
  522    HE2  TYR  67           HE1      TYR  67  90.573   2.290   3.716
  523    HH   TYR  67           HH       TYR  67  90.084   0.595   0.954
  524    H    LEU  68           H        LEU  68  87.097   7.439  -0.233
  525    HA   LEU  68           HA       LEU  68  87.933   5.236  -1.891
  526    HB2  LEU  68           HB2      LEU  68  85.798   7.280  -1.927
  527    HB3  LEU  68           HB3      LEU  68  86.351   6.763  -3.514
  528    HG   LEU  68           HG       LEU  68  85.498   4.869  -1.304
  529   HD11  LEU  68          HD11      LEU  68  83.548   4.509  -2.984
  530   HD12  LEU  68          HD12      LEU  68  84.010   6.087  -3.626
  531   HD13  LEU  68          HD13      LEU  68  83.511   5.927  -1.944
  532   HD21  LEU  68          HD21      LEU  68  86.726   3.483  -2.644
  533   HD22  LEU  68          HD22      LEU  68  86.607   4.543  -4.043
  534   HD23  LEU  68          HD23      LEU  68  85.261   3.492  -3.619
  535    H    GLU  69           H        GLU  69  88.886   8.532  -1.530
  536    HA   GLU  69           HA       GLU  69  90.187   8.534  -4.177
  537    HB2  GLU  69           HB2      GLU  69  90.692  10.939  -3.591
  538    HB3  GLU  69           HB3      GLU  69  88.982  10.552  -3.775
  539    HG2  GLU  69           HG2      GLU  69  88.605  10.578  -1.451
  540    HG3  GLU  69           HG3      GLU  69  90.318  10.427  -1.080
  541    H    ASN  70           H        ASN  70  90.830   7.706  -1.029
  542    HA   ASN  70           HA       ASN  70  93.624   7.365  -1.523
  543    HB2  ASN  70           HB2      ASN  70  94.505   8.842   0.194
  544    HB3  ASN  70           HB1      ASN  70  93.612   9.782  -0.996
  545   HD21  ASN  70          HD21      ASN  70  93.443   8.481   2.322
  546   HD22  ASN  70          HD22      ASN  70  92.197   9.514   2.832
  547    HA   PRO  71           HA       PRO  71  91.117   4.593   1.454
  548    HB2  PRO  71           HB2      PRO  71  92.889   2.745  -0.104
  549    HB3  PRO  71           HB1      PRO  71  91.216   2.511   0.438
  550    HG2  PRO  71           HG2      PRO  71  91.821   3.142  -2.097
  551    HG3  PRO  71           HG1      PRO  71  90.340   3.707  -1.306
  552    HD2  PRO  71           HD2      PRO  71  92.753   5.246  -2.066
  553    HD3  PRO  71           HD1      PRO  71  91.101   5.817  -1.756
  554    H    LYS  72           H        LYS  72  94.547   4.527   0.487
  555    HA   LYS  72           HA       LYS  72  95.424   3.297   2.924
  556    HB2  LYS  72           HB2      LYS  72  96.615   3.087   0.752
  557    HB3  LYS  72           HB3      LYS  72  97.053   4.790   0.865
  558    HG2  LYS  72           HG2      LYS  72  98.805   4.270   2.188
  559    HG3  LYS  72           HG3      LYS  72  97.713   3.549   3.366
  560    HD2  LYS  72           HD2      LYS  72  98.632   2.059   0.898
  561    HD3  LYS  72           HD3      LYS  72  99.524   2.011   2.417
  562    HE2  LYS  72           HE2      LYS  72  96.611   1.231   2.086
  563    HE3  LYS  72           HE3      LYS  72  97.957   0.100   2.219
  564    HZ1  LYS  72           HZ1      LYS  72  96.889   1.947   4.260
  565    HZ2  LYS  72           HZ2      LYS  72  98.476   1.348   4.370
  566    HZ3  LYS  72           HZ3      LYS  72  97.158   0.277   4.375
  567    H    LYS  73           H        LYS  73  95.656   6.620   1.640
  568    HA   LYS  73           HA       LYS  73  97.080   7.677   3.817
  569    HB2  LYS  73           HB2      LYS  73  96.471   8.668   1.438
  570    HB3  LYS  73           HB3      LYS  73  95.148   9.409   2.336
  571    HG2  LYS  73           HG2      LYS  73  96.927  10.173   4.023
  572    HG3  LYS  73           HG3      LYS  73  98.117   9.721   2.803
  573    HD2  LYS  73           HD2      LYS  73  97.793  11.945   2.234
  574    HD3  LYS  73           HD3      LYS  73  96.561  11.192   1.223
  575    HE2  LYS  73           HE2      LYS  73  95.407  12.949   2.302
  576    HE3  LYS  73           HE3      LYS  73  94.983  11.527   3.252
  577    HZ1  LYS  73           HZ1      LYS  73  96.988  13.608   3.894
  578    HZ2  LYS  73           HZ2      LYS  73  96.923  12.118   4.707
  579    HZ3  LYS  73           HZ3      LYS  73  95.604  13.187   4.779
  580    H    TYR  74           H        TYR  74  93.856   6.598   3.728
  581    HA   TYR  74           HA       TYR  74  92.924   8.463   5.765
  582    HB2  TYR  74           HB2      TYR  74  91.567   7.237   3.814
  583    HB3  TYR  74           HB3      TYR  74  91.345   6.031   5.077
  584    HD1  TYR  74           HD1      TYR  74  90.798   9.578   4.158
  585    HD2  TYR  74           HD2      TYR  74  89.972   6.485   7.020
  586    HE1  TYR  74           HE1      TYR  74  89.064  11.008   5.206
  587    HE2  TYR  74           HE2      TYR  74  88.239   7.913   8.066
  588    HH   TYR  74           HH       TYR  74  87.975  11.194   7.498
  589    H    ILE  75           H        ILE  75  93.293   4.906   5.558
  590    HA   ILE  75           HA       ILE  75  93.831   4.898   8.474
  591    HB   ILE  75           HB       ILE  75  92.601   2.585   6.976
  592   HG12  ILE  75          HG12      ILE  75  91.153   4.758   8.526
  593   HG13  ILE  75          HG13      ILE  75  91.157   4.611   6.772
  594   HG21  ILE  75          HG21      ILE  75  91.886   1.968   9.277
  595   HG22  ILE  75          HG22      ILE  75  92.717   3.392   9.900
  596   HG23  ILE  75          HG23      ILE  75  93.640   2.093   9.145
  597   HD11  ILE  75          HD11      ILE  75  90.297   2.295   8.489
  598   HD12  ILE  75          HD12      ILE  75  89.912   2.621   6.801
  599   HD13  ILE  75          HD13      ILE  75  89.163   3.581   8.076
  600    HA   PRO  76           HA       PRO  76  97.636   3.579   6.044
  601    HB2  PRO  76           HB2      PRO  76  98.619   4.299   8.786
  602    HB3  PRO  76           HB1      PRO  76  99.362   4.616   7.205
  603    HG2  PRO  76           HG2      PRO  76  98.075   6.529   8.542
  604    HG3  PRO  76           HG1      PRO  76  98.001   6.418   6.776
  605    HD2  PRO  76           HD2      PRO  76  95.892   5.802   8.778
  606    HD3  PRO  76           HD1      PRO  76  95.726   6.286   7.077
  607    H    GLY  77           H        GLY  77  98.097   1.464   5.934
  608    HA2  GLY  77           HA2      GLY  77  99.078  -0.468   7.125
  609    HA3  GLY  77           HA3      GLY  77  97.891  -0.182   8.394
  610    H    THR  78           H        THR  78  95.757   0.450   6.463
  611    HA   THR  78           HA       THR  78  94.559  -2.055   6.210
  612    HB   THR  78           HB       THR  78  93.399   0.171   6.069
  613    HG1  THR  78           HG1      THR  78  91.973  -1.197   5.381
  614   HG21  THR  78          HG21      THR  78  93.423   1.405   4.041
  615   HG22  THR  78          HG22      THR  78  94.233   0.102   3.171
  616   HG23  THR  78          HG23      THR  78  95.114   1.037   4.379
  617    H    LYS  79           H        LYS  79  94.636  -3.658   4.719
  618    HA   LYS  79           HA       LYS  79  96.709  -3.481   2.688
  619    HB2  LYS  79           HB2      LYS  79  95.993  -5.530   4.224
  620    HB3  LYS  79           HB3      LYS  79  94.887  -5.843   2.889
  621    HG2  LYS  79           HG2      LYS  79  96.757  -7.019   2.167
  622    HG3  LYS  79           HG3      LYS  79  97.054  -5.453   1.412
  623    HD2  LYS  79           HD2      LYS  79  98.481  -4.804   3.328
  624    HD3  LYS  79           HD3      LYS  79  98.193  -6.379   4.067
  625    HE2  LYS  79           HE2      LYS  79 100.294  -6.551   2.932
  626    HE3  LYS  79           HE3      LYS  79  99.123  -7.416   1.935
  627    HZ1  LYS  79           HZ1      LYS  79  99.955  -6.117   0.324
  628    HZ2  LYS  79           HZ2      LYS  79 100.545  -4.946   1.405
  629    HZ3  LYS  79           HZ3      LYS  79  98.906  -4.945   0.959
  630    H    MET  80           H        MET  80  95.944  -2.015   1.176
  631    HA   MET  80           HA       MET  80  94.321  -3.086  -0.898
  632    HB2  MET  80           HB2      MET  80  92.443  -2.548   0.529
  633    HB3  MET  80           HB1      MET  80  93.075  -0.928   0.821
  634    HG2  MET  80           HG2      MET  80  92.693  -0.258  -1.435
  635    HG3  MET  80           HG1      MET  80  92.435  -1.921  -1.962
  636    HE1  MET  80           HE1      MET  80  90.617   0.192  -2.874
  637    HE2  MET  80           HE2      MET  80  90.705   1.250  -1.469
  638    HE3  MET  80           HE3      MET  80  89.154   0.574  -1.954
  639    H    ILE  81           H        ILE  81  95.989  -2.486  -2.229
  640    HA   ILE  81           HA       ILE  81  96.582   0.407  -2.440
  641    HB   ILE  81           HB       ILE  81  98.208  -2.057  -3.062
  642   HG12  ILE  81          HG12      ILE  81  99.880  -0.820  -1.681
  643   HG13  ILE  81          HG13      ILE  81  98.699   0.468  -1.447
  644   HG21  ILE  81          HG21      ILE  81  98.570  -0.769  -5.018
  645   HG22  ILE  81          HG22      ILE  81  99.901  -0.319  -3.953
  646   HG23  ILE  81          HG23      ILE  81  98.511   0.752  -4.129
  647   HD11  ILE  81          HD11      ILE  81  97.794  -2.295  -0.793
  648   HD12  ILE  81          HD12      ILE  81  97.437  -0.769   0.017
  649   HD13  ILE  81          HD13      ILE  81  98.982  -1.572   0.292
  650    H    PHE  82           H        PHE  82  95.451   1.335  -4.019
  651    HA   PHE  82           HA       PHE  82  95.542   0.255  -6.702
  652    HB2  PHE  82           HB2      PHE  82  93.547  -0.841  -5.456
  653    HB3  PHE  82           HB1      PHE  82  92.793   0.748  -5.574
  654    HD1  PHE  82           HD1      PHE  82  94.650  -1.715  -7.714
  655    HD2  PHE  82           HD2      PHE  82  91.537   1.237  -7.488
  656    HE1  PHE  82           HE1      PHE  82  94.024  -2.196 -10.064
  657    HE2  PHE  82           HE2      PHE  82  90.910   0.755  -9.839
  658    HZ   PHE  82           HZ       PHE  82  92.154  -0.962 -11.127
  659    H    ALA  83           H        ALA  83  94.033   1.753  -8.136
  660    HA   ALA  83           HA       ALA  83  94.973   4.446  -7.666
  661    HB1  ALA  83           HB1      ALA  83  93.392   3.134  -9.875
  662    HB2  ALA  83           HB2      ALA  83  95.041   3.756  -9.932
  663    HB3  ALA  83           HB3      ALA  83  93.680   4.875  -9.837
  664    H    GLY  84           H        GLY  84  93.936   5.682  -6.234
  665    HA2  GLY  84           HA2      GLY  84  91.308   5.327  -5.317
  666    HA3  GLY  84           HA3      GLY  84  92.247   6.809  -5.153
  667    H    ILE  85           H        ILE  85  89.656   7.213  -5.480
  668    HA   ILE  85           HA       ILE  85  88.882   7.398  -8.259
  669    HB   ILE  85           HB       ILE  85  87.640   8.471  -5.721
  670   HG12  ILE  85          HG12      ILE  85  87.788   5.900  -6.380
  671   HG13  ILE  85          HG13      ILE  85  86.296   6.570  -5.730
  672   HG21  ILE  85          HG21      ILE  85  86.840   9.917  -7.407
  673   HG22  ILE  85          HG22      ILE  85  85.601   8.666  -7.304
  674   HG23  ILE  85          HG23      ILE  85  86.784   8.627  -8.609
  675   HD11  ILE  85          HD11      ILE  85  85.260   6.652  -7.844
  676   HD12  ILE  85          HD12      ILE  85  86.133   5.120  -7.870
  677   HD13  ILE  85          HD13      ILE  85  86.796   6.526  -8.702
  678    H    LYS  86           H        LYS  86  88.319   9.446  -9.303
  679    HA   LYS  86           HA       LYS  86  90.293  11.530  -8.649
  680    HB2  LYS  86           HB2      LYS  86  88.880  10.684 -11.155
  681    HB3  LYS  86           HB3      LYS  86  89.497  12.329 -11.025
  682    HG2  LYS  86           HG2      LYS  86  91.309  10.062 -10.265
  683    HG3  LYS  86           HG3      LYS  86  91.031  10.380 -11.976
  684    HD2  LYS  86           HD2      LYS  86  91.720  12.728 -11.659
  685    HD3  LYS  86           HD3      LYS  86  92.004  12.414  -9.947
  686    HE2  LYS  86           HE2      LYS  86  93.793  10.897 -10.427
  687    HE3  LYS  86           HE3      LYS  86  93.381  10.852 -12.141
  688    HZ1  LYS  86           HZ1      LYS  86  93.949  13.471 -11.009
  689    HZ2  LYS  86           HZ2      LYS  86  94.359  12.830 -12.528
  690    HZ3  LYS  86           HZ3      LYS  86  95.270  12.417 -11.154
  691    H    LYS  87           H        LYS  87  87.071  11.640 -10.191
  692    HA   LYS  87           HA       LYS  87  86.564  14.233  -9.013
  693    HB2  LYS  87           HB2      LYS  87  84.670  12.491 -10.599
  694    HB3  LYS  87           HB3      LYS  87  84.548  14.229 -10.327
  695    HG2  LYS  87           HG2      LYS  87  86.596  14.618 -11.589
  696    HG3  LYS  87           HG3      LYS  87  86.845  12.882 -11.776
  697    HD2  LYS  87           HD2      LYS  87  84.635  12.764 -12.975
  698    HD3  LYS  87           HD3      LYS  87  84.572  14.525 -12.922
  699    HE2  LYS  87           HE2      LYS  87  86.902  13.004 -14.114
  700    HE3  LYS  87           HE3      LYS  87  85.519  13.540 -15.068
  701    HZ1  LYS  87           HZ1      LYS  87  85.975  15.787 -14.544
  702    HZ2  LYS  87           HZ2      LYS  87  87.450  15.098 -15.031
  703    HZ3  LYS  87           HZ3      LYS  87  87.135  15.365 -13.382
  704    H    LYS  88           H        LYS  88  84.536  14.714  -7.871
  705    HA   LYS  88           HA       LYS  88  84.212  13.006  -5.601
  706    HB2  LYS  88           HB2      LYS  88  83.954  15.521  -5.599
  707    HB3  LYS  88           HB3      LYS  88  82.415  15.291  -6.430
  708    HG2  LYS  88           HG2      LYS  88  81.753  13.731  -4.528
  709    HG3  LYS  88           HG3      LYS  88  83.190  14.296  -3.677
  710    HD2  LYS  88           HD2      LYS  88  81.740  15.876  -2.863
  711    HD3  LYS  88           HD3      LYS  88  82.115  16.687  -4.383
  712    HE2  LYS  88           HE2      LYS  88  79.769  14.819  -3.917
  713    HE3  LYS  88           HE3      LYS  88  79.676  16.577  -4.015
  714    HZ1  LYS  88           HZ1      LYS  88  79.124  15.711  -6.135
  715    HZ2  LYS  88           HZ2      LYS  88  80.481  14.691  -6.157
  716    HZ3  LYS  88           HZ3      LYS  88  80.679  16.375  -6.271
  717    H    THR  89           H        THR  89  82.050  13.925  -8.293
  718    HA   THR  89           HA       THR  89  79.847  12.385  -7.615
  719    HB   THR  89           HB       THR  89  79.344  12.313 -10.045
  720    HG1  THR  89           HG1      THR  89  81.870  12.349 -10.322
  721   HG21  THR  89          HG21      THR  89  79.315  14.790 -10.355
  722   HG22  THR  89          HG22      THR  89  80.370  14.947  -8.949
  723   HG23  THR  89          HG23      THR  89  78.741  14.296  -8.762
  724    H    GLU  90           H        GLU  90  82.935  11.393  -8.898
  725    HA   GLU  90           HA       GLU  90  82.146   8.804  -9.789
  726    HB2  GLU  90           HB2      GLU  90  84.789  10.017  -8.994
  727    HB3  GLU  90           HB3      GLU  90  84.651   8.310  -9.409
  728    HG2  GLU  90           HG2      GLU  90  83.914   8.804 -11.616
  729    HG3  GLU  90           HG3      GLU  90  83.614  10.494 -11.217
  730    H    ARG  91           H        ARG  91  83.224  10.169  -6.737
  731    HA   ARG  91           HA       ARG  91  83.330   7.640  -5.355
  732    HB2  ARG  91           HB2      ARG  91  83.211  10.465  -4.256
  733    HB3  ARG  91           HB3      ARG  91  83.638   9.015  -3.348
  734    HG2  ARG  91           HG2      ARG  91  85.530   8.649  -4.960
  735    HG3  ARG  91           HG3      ARG  91  85.159  10.218  -5.672
  736    HD2  ARG  91           HD2      ARG  91  85.311  10.539  -2.824
  737    HD3  ARG  91           HD3      ARG  91  86.750   9.678  -3.363
  738    HE   ARG  91           HE       ARG  91  86.493  11.745  -5.149
  739   HH11  ARG  91          HH21      ARG  91  86.641  11.427  -1.705
  740   HH12  ARG  91          HH22      ARG  91  87.390  12.968  -1.457
  741   HH21  ARG  91          HH11      ARG  91  87.475  13.767  -4.831
  742   HH22  ARG  91          HH12      ARG  91  87.863  14.293  -3.227
  743    H    GLU  92           H        GLU  92  81.111  10.435  -5.367
  744    HA   GLU  92           HA       GLU  92  79.226   9.432  -3.554
  745    HB2  GLU  92           HB2      GLU  92  79.364  11.781  -4.554
  746    HB3  GLU  92           HB3      GLU  92  78.526  11.120  -5.959
  747    HG2  GLU  92           HG2      GLU  92  76.698  10.335  -4.468
  748    HG3  GLU  92           HG3      GLU  92  77.520  11.083  -3.100
  749    H    ASP  93           H        ASP  93  79.185   9.286  -7.130
  750    HA   ASP  93           HA       ASP  93  76.882   7.694  -7.364
  751    HB2  ASP  93           HB2      ASP  93  79.305   7.903  -9.165
  752    HB3  ASP  93           HB1      ASP  93  77.811   7.077  -9.604
  753    H    LEU  94           H        LEU  94  80.313   6.800  -7.147
  754    HA   LEU  94           HA       LEU  94  79.986   4.014  -7.394
  755    HB2  LEU  94           HB2      LEU  94  82.191   5.050  -7.563
  756    HB3  LEU  94           HB3      LEU  94  82.081   5.591  -5.890
  757    HG   LEU  94           HG       LEU  94  82.037   3.293  -5.096
  758   HD11  LEU  94          HD11      LEU  94  81.834   2.726  -8.039
  759   HD12  LEU  94          HD12      LEU  94  80.907   2.038  -6.705
  760   HD13  LEU  94          HD13      LEU  94  82.575   1.533  -6.972
  761   HD21  LEU  94          HD21      LEU  94  84.231   4.462  -5.668
  762   HD22  LEU  94          HD22      LEU  94  84.244   3.513  -7.154
  763   HD23  LEU  94          HD23      LEU  94  84.298   2.703  -5.590
  764    H    ILE  95           H        ILE  95  79.774   6.196  -4.654
  765    HA   ILE  95           HA       ILE  95  79.584   4.097  -2.723
  766    HB   ILE  95           HB       ILE  95  79.263   7.074  -2.634
  767   HG12  ILE  95          HG12      ILE  95  80.988   5.501  -0.781
  768   HG13  ILE  95          HG13      ILE  95  81.441   5.461  -2.479
  769   HG21  ILE  95          HG21      ILE  95  78.323   5.047  -0.634
  770   HG22  ILE  95          HG22      ILE  95  77.616   6.603  -1.059
  771   HG23  ILE  95          HG23      ILE  95  79.054   6.538  -0.040
  772   HD11  ILE  95          HD11      ILE  95  80.783   8.144  -1.411
  773   HD12  ILE  95          HD12      ILE  95  82.078   7.643  -2.494
  774   HD13  ILE  95          HD13      ILE  95  82.241   7.402  -0.760
  775    H    ALA  96           H        ALA  96  77.367   5.904  -4.691
  776    HA   ALA  96           HA       ALA  96  74.986   5.356  -3.251
  777    HB1  ALA  96           HB1      ALA  96  75.159   7.044  -5.073
  778    HB2  ALA  96           HB2      ALA  96  73.835   5.906  -5.329
  779    HB3  ALA  96           HB3      ALA  96  75.337   5.730  -6.237
  780    H    TYR  97           H        TYR  97  76.887   3.595  -5.616
  781    HA   TYR  97           HA       TYR  97  74.970   1.470  -5.940
  782    HB2  TYR  97           HB2      TYR  97  76.468   1.884  -7.774
  783    HB3  TYR  97           HB3      TYR  97  77.879   1.741  -6.724
  784    HD1  TYR  97           HD1      TYR  97  74.959  -0.165  -8.062
  785    HD2  TYR  97           HD2      TYR  97  78.871  -0.367  -6.301
  786    HE1  TYR  97           HE1      TYR  97  75.010  -2.611  -8.458
  787    HE2  TYR  97           HE2      TYR  97  78.922  -2.815  -6.698
  788    HH   TYR  97           HH       TYR  97  76.165  -4.485  -8.229
  789    H    LEU  98           H        LEU  98  78.044   1.900  -4.183
  790    HA   LEU  98           HA       LEU  98  78.274  -0.663  -3.112
  791    HB2  LEU  98           HB2      LEU  98  79.165   2.050  -2.181
  792    HB3  LEU  98           HB3      LEU  98  79.425   0.642  -1.159
  793    HG   LEU  98           HG       LEU  98  80.250   0.521  -4.051
  794   HD11  LEU  98          HD11      LEU  98  82.412   1.456  -3.555
  795   HD12  LEU  98          HD12      LEU  98  82.008   1.626  -1.848
  796   HD13  LEU  98          HD13      LEU  98  81.205   2.633  -3.050
  797   HD21  LEU  98          HD21      LEU  98  81.864  -1.067  -3.177
  798   HD22  LEU  98          HD22      LEU  98  80.281  -1.476  -2.518
  799   HD23  LEU  98          HD23      LEU  98  81.457  -0.624  -1.520
  800    H    LYS  99           H        LYS  99  76.072   1.899  -2.355
  801    HA   LYS  99           HA       LYS  99  75.356   0.900   0.262
  802    HB2  LYS  99           HB2      LYS  99  74.346   3.079  -1.540
  803    HB3  LYS  99           HB3      LYS  99  73.380   2.566  -0.158
  804    HG2  LYS  99           HG2      LYS  99  75.464   2.902   1.272
  805    HG3  LYS  99           HG3      LYS  99  76.191   3.690  -0.127
  806    HD2  LYS  99           HD2      LYS  99  73.538   4.535   1.066
  807    HD3  LYS  99           HD3      LYS  99  75.079   5.266   1.513
  808    HE2  LYS  99           HE2      LYS  99  75.431   5.696  -0.989
  809    HE3  LYS  99           HE3      LYS  99  73.727   5.287  -1.191
  810    HZ1  LYS  99           HZ1      LYS  99  74.938   7.642  -0.033
  811    HZ2  LYS  99           HZ2      LYS  99  73.635   7.010   0.854
  812    HZ3  LYS  99           HZ3      LYS  99  73.424   7.452  -0.772
  813    H    LYS 100           H        LYS 100  73.702   1.051  -2.900
  814    HA   LYS 100           HA       LYS 100  71.528  -0.603  -1.999
  815    HB2  LYS 100           HB2      LYS 100  72.365   0.240  -4.783
  816    HB3  LYS 100           HB3      LYS 100  70.854  -0.581  -4.386
  817    HG2  LYS 100           HG2      LYS 100  70.112   1.263  -3.035
  818    HG3  LYS 100           HG3      LYS 100  71.694   2.038  -3.120
  819    HD2  LYS 100           HD2      LYS 100  71.418   2.286  -5.576
  820    HD3  LYS 100           HD3      LYS 100  69.809   1.575  -5.451
  821    HE2  LYS 100           HE2      LYS 100  69.092   3.398  -3.976
  822    HE3  LYS 100           HE3      LYS 100  70.710   4.095  -4.025
  823    HZ1  LYS 100           HZ1      LYS 100  69.888   5.258  -5.733
  824    HZ2  LYS 100           HZ2      LYS 100  68.600   4.182  -5.997
  825    HZ3  LYS 100           HZ3      LYS 100  70.139   3.842  -6.631
  826    H    ALA 101           H        ALA 101  74.671  -1.184  -3.195
  827    HA   ALA 101           HA       ALA 101  74.094  -3.843  -4.225
  828    HB1  ALA 101           HB1      ALA 101  76.729  -2.419  -3.796
  829    HB2  ALA 101           HB2      ALA 101  75.814  -2.453  -5.303
  830    HB3  ALA 101           HB3      ALA 101  76.508  -3.942  -4.658
  831    H    THR 102           H        THR 102  75.392  -2.339  -1.335
  832    HA   THR 102           HA       THR 102  76.188  -4.921  -0.207
  833    HB   THR 102           HB       THR 102  76.959  -3.557   1.709
  834    HG1  THR 102           HG1      THR 102  76.705  -1.361   1.645
  835   HG21  THR 102          HG21      THR 102  78.628  -3.839   0.082
  836   HG22  THR 102          HG22      THR 102  78.575  -2.089   0.294
  837   HG23  THR 102          HG23      THR 102  77.784  -2.834  -1.095
  838    H    ASN 103           H        ASN 103  73.452  -2.981  -0.414
  839    HA   ASN 103           HA       ASN 103  72.327  -3.658   2.174
  840    HB2  ASN 103           HB2      ASN 103  71.421  -2.123  -0.234
  841    HB3  ASN 103           HB1      ASN 103  70.233  -2.651   0.950
  842   HD21  ASN 103          HD21      ASN 103  73.493  -1.919   2.013
  843   HD22  ASN 103          HD22      ASN 103  73.107  -0.468   2.803
  844    H    GLU 104           H        GLU 104  72.315  -4.910  -1.069
  845    HA   GLU 104           HA       GLU 104  70.571  -7.119  -0.172
  846    HB2  GLU 104           HB2      GLU 104  69.342  -7.110  -2.220
  847    HB3  GLU 104           HB3      GLU 104  69.327  -5.452  -1.621
  848    HG2  GLU 104           HG2      GLU 104  71.429  -5.108  -3.086
  849    HG3  GLU 104           HG3      GLU 104  70.964  -6.615  -3.873
  850    HHA  HEC 201           HA       HEC 105  89.258  -3.558   3.263
  851    HHB  HEC 201           HB       HEC 105  85.558   0.065  -0.366
  852    HHC  HEC 201           HC       HEC 105  88.855  -1.704  -5.467
  853    HHD  HEC 201           HD       HEC 105  92.178  -5.740  -1.907
  854   HMA1  HEC 201          HMA1      HEC 105  85.032  -0.509   3.310
  855   HMA2  HEC 201          HMA2      HEC 105  84.592  -0.194   1.635
  856   HMA3  HEC 201          HMA3      HEC 105  85.745   0.859   2.454
  857   HAA1  HEC 201          HAA1      HEC 105  86.792  -1.017   4.562
  858   HAA2  HEC 201          HAA2      HEC 105  88.315  -1.885   4.530
  859   HBA1  HEC 201          HBA1      HEC 105  87.228  -3.995   4.489
  860   HBA2  HEC 201          HBA2      HEC 105  85.665  -3.268   4.129
  861   HMB1  HEC 201          HMB1      HEC 105  85.213   1.647  -2.229
  862   HMB2  HEC 201          HMB2      HEC 105  84.171   0.273  -2.593
  863   HMB3  HEC 201          HMB3      HEC 105  84.846   1.236  -3.902
  864    HAB  HEC 201           HAB      HEC 105  87.365  -0.498  -6.129
  865   HBB1  HEC 201          HBB1      HEC 105  86.716   2.060  -4.723
  866   HBB2  HEC 201          HBB2      HEC 105  87.955   1.726  -5.930
  867   HBB3  HEC 201          HBB3      HEC 105  86.273   1.911  -6.423
  868   HMC1  HEC 201          HMC1      HEC 105  91.326  -2.483  -6.560
  869   HMC2  HEC 201          HMC2      HEC 105  89.799  -3.324  -6.818
  870   HMC3  HEC 201          HMC3      HEC 105  91.311  -4.226  -6.821
  871    HAC  HEC 201           HAC      HEC 105  92.641  -6.140  -3.836
  872   HBC1  HEC 201          HBC1      HEC 105  93.286  -3.944  -5.681
  873   HBC2  HEC 201          HBC2      HEC 105  93.589  -5.538  -6.370
  874   HBC3  HEC 201          HBC3      HEC 105  94.363  -5.071  -4.858
  875   HMD1  HEC 201          HMD1      HEC 105  93.118  -6.656   1.631
  876   HMD2  HEC 201          HMD2      HEC 105  93.423  -6.256  -0.057
  877   HMD3  HEC 201          HMD3      HEC 105  92.238  -7.496   0.355
  878   HAD1  HEC 201          HAD1      HEC 105  91.601  -6.467   3.245
  879   HAD2  HEC 201          HAD2      HEC 105  90.311  -5.417   3.785
  880   HBD1  HEC 201          HBD1      HEC 105  92.560  -3.743   3.278
  881   HBD2  HEC 201          HBD2      HEC 105  93.146  -5.134   4.184
  882    H1   HOH 301           H2       HOH 200  81.617   3.403  -0.850
  883    H2   HOH 301           H1       HOH 200  80.604   2.303  -0.612
  884    H1   HOH 302           H2       HOH 201  86.608   6.936   7.436
  885    H2   HOH 302           H1       HOH 201  86.404   6.702   5.953
  886    H1   HOH 303           H2       HOH 202  81.715  -6.524   5.996
  887    H2   HOH 303           H1       HOH 202  83.054  -6.384   5.299
  888    H1   HOH 304           H2       HOH 203  84.541 -10.013   0.397
  889    H2   HOH 304           H1       HOH 203  83.211 -10.737   0.469
  Start of MODEL   30
    1    H1   GLY   1           H1       GLY   1  74.050  11.803  -7.033
    2    H2   GLY   1           H2       GLY   1  73.071  11.179  -5.793
    3    H3   GLY   1           H3       GLY   1  72.578  11.052  -7.414
    4    HA2  GLY   1           HA2      GLY   1  75.151   9.892  -7.025
    5    HA3  GLY   1           HA3      GLY   1  73.938   9.161  -5.973
    6    H    ASP   2           H        ASP   2  75.379   8.463  -8.662
    7    HA   ASP   2           HA       ASP   2  72.938   7.641 -10.132
    8    HB2  ASP   2           HB2      ASP   2  75.724   8.233 -11.145
    9    HB3  ASP   2           HB1      ASP   2  74.454   7.494 -12.120
   10    H    VAL   3           H        VAL   3  72.764   5.754  -8.809
   11    HA   VAL   3           HA       VAL   3  74.690   3.856  -8.282
   12    HB   VAL   3           HB       VAL   3  72.478   3.640  -7.352
   13   HG11  VAL   3          HG11      VAL   3  71.083   4.590  -9.032
   14   HG12  VAL   3          HG12      VAL   3  70.601   2.896  -8.938
   15   HG13  VAL   3          HG13      VAL   3  71.641   3.445 -10.252
   16   HG21  VAL   3          HG21      VAL   3  73.878   1.555  -8.002
   17   HG22  VAL   3          HG22      VAL   3  72.692   1.331  -9.288
   18   HG23  VAL   3          HG23      VAL   3  72.182   1.307  -7.601
   19    H    GLU   4           H        GLU   4  73.425   4.800 -11.320
   20    HA   GLU   4           HA       GLU   4  73.912   2.338 -12.715
   21    HB2  GLU   4           HB2      GLU   4  73.591   5.162 -13.758
   22    HB3  GLU   4           HB3      GLU   4  73.588   3.702 -14.748
   23    HG2  GLU   4           HG2      GLU   4  71.653   2.858 -13.392
   24    HG3  GLU   4           HG3      GLU   4  71.608   4.416 -12.569
   25    H    LYS   5           H        LYS   5  75.575   5.504 -12.811
   26    HA   LYS   5           HA       LYS   5  77.855   4.409 -14.168
   27    HB2  LYS   5           HB2      LYS   5  77.311   7.055 -12.814
   28    HB3  LYS   5           HB3      LYS   5  78.881   6.666 -13.516
   29    HG2  LYS   5           HG2      LYS   5  77.950   6.413 -15.702
   30    HG3  LYS   5           HG3      LYS   5  76.302   6.427 -15.077
   31    HD2  LYS   5           HD2      LYS   5  78.186   8.776 -14.764
   32    HD3  LYS   5           HD3      LYS   5  77.102   8.605 -16.144
   33    HE2  LYS   5           HE2      LYS   5  75.281   8.233 -14.235
   34    HE3  LYS   5           HE3      LYS   5  76.442   9.146 -13.274
   35    HZ1  LYS   5           HZ1      LYS   5  74.643  10.387 -14.623
   36    HZ2  LYS   5           HZ2      LYS   5  75.678  10.112 -15.943
   37    HZ3  LYS   5           HZ3      LYS   5  76.228  10.992 -14.598
   38    H    GLY   6           H        GLY   6  76.816   4.583 -10.915
   39    HA2  GLY   6           HA2      GLY   6  79.401   4.455  -9.667
   40    HA3  GLY   6           HA3      GLY   6  77.854   4.078  -8.905
   41    H    LYS   7           H        LYS   7  77.024   2.207 -10.904
   42    HA   LYS   7           HA       LYS   7  78.194  -0.175  -9.870
   43    HB2  LYS   7           HB2      LYS   7  75.838  -0.001 -10.683
   44    HB3  LYS   7           HB3      LYS   7  76.456   0.160 -12.326
   45    HG2  LYS   7           HG2      LYS   7  77.630  -2.035 -12.046
   46    HG3  LYS   7           HG3      LYS   7  76.862  -2.203 -10.471
   47    HD2  LYS   7           HD2      LYS   7  75.367  -3.374 -11.821
   48    HD3  LYS   7           HD3      LYS   7  74.642  -1.767 -11.828
   49    HE2  LYS   7           HE2      LYS   7  75.691  -1.256 -13.970
   50    HE3  LYS   7           HE3      LYS   7  76.559  -2.791 -13.946
   51    HZ1  LYS   7           HZ1      LYS   7  74.663  -3.978 -14.358
   52    HZ2  LYS   7           HZ2      LYS   7  74.336  -2.564 -15.242
   53    HZ3  LYS   7           HZ3      LYS   7  73.632  -2.796 -13.713
   54    H    LYS   8           H        LYS   8  78.467   1.602 -12.938
   55    HA   LYS   8           HA       LYS   8  80.084  -0.236 -14.313
   56    HB2  LYS   8           HB2      LYS   8  79.050   1.645 -15.447
   57    HB3  LYS   8           HB3      LYS   8  79.998   2.783 -14.491
   58    HG2  LYS   8           HG2      LYS   8  81.599   0.730 -15.906
   59    HG3  LYS   8           HG3      LYS   8  80.746   1.851 -16.964
   60    HD2  LYS   8           HD2      LYS   8  82.304   2.912 -14.615
   61    HD3  LYS   8           HD3      LYS   8  83.145   2.475 -16.101
   62    HE2  LYS   8           HE2      LYS   8  80.718   4.272 -16.135
   63    HE3  LYS   8           HE3      LYS   8  82.341   4.915 -15.886
   64    HZ1  LYS   8           HZ1      LYS   8  81.133   4.259 -18.295
   65    HZ2  LYS   8           HZ2      LYS   8  82.358   3.108 -18.048
   66    HZ3  LYS   8           HZ3      LYS   8  82.732   4.766 -18.044
   67    H    ILE   9           H        ILE   9  80.976   2.496 -12.224
   68    HA   ILE   9           HA       ILE   9  83.782   2.156 -12.490
   69    HB   ILE   9           HB       ILE   9  82.194   3.454 -10.265
   70   HG12  ILE   9          HG12      ILE   9  83.584   4.812 -12.581
   71   HG13  ILE   9          HG13      ILE   9  81.907   4.280 -12.701
   72   HG21  ILE   9          HG21      ILE   9  84.353   4.730  -9.966
   73   HG22  ILE   9          HG22      ILE   9  85.112   3.585 -11.072
   74   HG23  ILE   9          HG23      ILE   9  84.454   3.022  -9.536
   75   HD11  ILE   9          HD11      ILE   9  82.964   6.105 -10.523
   76   HD12  ILE   9          HD12      ILE   9  81.281   5.656 -10.795
   77   HD13  ILE   9          HD13      ILE   9  82.125   6.665 -11.970
   78    H    PHE  10           H        PHE  10  81.374   0.571 -10.583
   79    HA   PHE  10           HA       PHE  10  83.221  -0.436  -8.599
   80    HB2  PHE  10           HB2      PHE  10  81.097  -0.261  -7.696
   81    HB3  PHE  10           HB1      PHE  10  80.308  -0.773  -9.187
   82    HD1  PHE  10           HD1      PHE  10  80.207  -3.154  -9.809
   83    HD2  PHE  10           HD2      PHE  10  81.948  -1.881  -6.101
   84    HE1  PHE  10           HE1      PHE  10  80.138  -5.487  -8.984
   85    HE2  PHE  10           HE2      PHE  10  81.884  -4.217  -5.270
   86    HZ   PHE  10           HZ       PHE  10  80.978  -6.023  -6.716
   87    H    VAL  11           H        VAL  11  81.343  -1.935 -11.249
   88    HA   VAL  11           HA       VAL  11  82.287  -4.532 -10.997
   89    HB   VAL  11           HB       VAL  11  81.747  -4.788 -13.409
   90   HG11  VAL  11          HG11      VAL  11  80.025  -4.734 -11.513
   91   HG12  VAL  11          HG12      VAL  11  79.413  -4.436 -13.139
   92   HG13  VAL  11          HG13      VAL  11  79.668  -3.089 -12.033
   93   HG21  VAL  11          HG21      VAL  11  82.560  -2.580 -14.151
   94   HG22  VAL  11          HG22      VAL  11  81.277  -1.802 -13.225
   95   HG23  VAL  11          HG23      VAL  11  80.872  -2.812 -14.611
   96    H    GLN  12           H        GLN  12  83.800  -1.743 -12.471
   97    HA   GLN  12           HA       GLN  12  85.963  -3.414 -13.535
   98    HB2  GLN  12           HB2      GLN  12  86.690  -1.456 -14.705
   99    HB3  GLN  12           HB1      GLN  12  84.941  -1.594 -14.894
  100    HG2  GLN  12           HG2      GLN  12  84.703  -0.021 -12.920
  101    HG3  GLN  12           HG1      GLN  12  86.445   0.245 -13.019
  102   HE21  GLN  12          HE21      GLN  12  85.647  -0.316 -16.145
  103   HE22  GLN  12          HE22      GLN  12  85.304   1.262 -16.655
  104    H    LYS  13           H        LYS  13  85.371  -1.213 -10.870
  105    HA   LYS  13           HA       LYS  13  88.261  -1.091 -10.331
  106    HB2  LYS  13           HB2      LYS  13  86.713   0.967 -10.368
  107    HB3  LYS  13           HB3      LYS  13  86.185   0.418  -8.778
  108    HG2  LYS  13           HG2      LYS  13  88.430   0.546  -7.909
  109    HG3  LYS  13           HG3      LYS  13  89.097   0.829  -9.515
  110    HD2  LYS  13           HD2      LYS  13  87.014   2.731  -8.504
  111    HD3  LYS  13           HD3      LYS  13  88.645   2.856  -7.846
  112    HE2  LYS  13           HE2      LYS  13  89.577   3.121 -10.080
  113    HE3  LYS  13           HE3      LYS  13  87.992   2.858 -10.807
  114    HZ1  LYS  13           HZ1      LYS  13  88.642   5.230 -10.599
  115    HZ2  LYS  13           HZ2      LYS  13  88.593   5.058  -8.910
  116    HZ3  LYS  13           HZ3      LYS  13  87.180   4.850  -9.830
  117    H    CYS  14           H        CYS  14  85.370  -1.433  -8.205
  118    HA   CYS  14           HA       CYS  14  87.025  -2.686  -6.196
  119    HB2  CYS  14           HB2      CYS  14  84.050  -2.558  -6.006
  120    HB3  CYS  14           HB1      CYS  14  85.248  -2.419  -4.727
  121    H    ALA  15           H        ALA  15  84.504  -3.866  -8.393
  122    HA   ALA  15           HA       ALA  15  83.963  -6.317  -7.277
  123    HB1  ALA  15           HB1      ALA  15  82.757  -5.840  -9.216
  124    HB2  ALA  15           HB2      ALA  15  83.846  -7.119  -9.749
  125    HB3  ALA  15           HB3      ALA  15  84.207  -5.436 -10.134
  126    H    GLN  16           H        GLN  16  86.918  -5.257  -8.768
  127    HA   GLN  16           HA       GLN  16  88.177  -7.563  -9.533
  128    HB2  GLN  16           HB2      GLN  16  89.351  -5.236  -8.008
  129    HB3  GLN  16           HB1      GLN  16  90.302  -6.471  -8.829
  130    HG2  GLN  16           HG2      GLN  16  88.991  -5.891 -10.939
  131    HG3  GLN  16           HG1      GLN  16  88.389  -4.483 -10.067
  132   HE21  GLN  16          HE21      GLN  16  89.644  -2.639 -10.341
  133   HE22  GLN  16          HE22      GLN  16  91.297  -2.636 -10.730
  134    H    CYS  17           H        CYS  17  88.557  -6.201  -6.231
  135    HA   CYS  17           HA       CYS  17  88.942  -8.978  -5.264
  136    HB2  CYS  17           HB2      CYS  17  90.081  -6.785  -3.639
  137    HB3  CYS  17           HB1      CYS  17  90.759  -8.356  -4.047
  138    H    HIS  18           H        HSD  18  86.348  -8.085  -5.332
  139    HA   HIS  18           HA       HSD  18  85.702  -8.085  -2.504
  140    HB2  HIS  18           HB2      HSD  18  85.113  -5.707  -4.257
  141    HB3  HIS  18           HB1      HSD  18  84.118  -6.081  -2.850
  142    HD1  HIS  18           HD1      HSD  18  86.534  -7.138  -1.053
  143    HD2  HIS  18           HD2      HSD  18  86.431  -3.508  -3.098
  144    HE1  HIS  18           HE1      HSD  18  88.169  -5.601   0.127
  145    H    THR  19           H        THR  19  83.131  -7.725  -2.376
  146    HA   THR  19           HA       THR  19  81.830  -9.195  -4.575
  147    HB   THR  19           HB       THR  19  80.728 -10.135  -2.119
  148    HG1  THR  19           HG1      THR  19  83.048 -11.215  -1.800
  149   HG21  THR  19          HG21      THR  19  82.460 -11.413  -4.247
  150   HG22  THR  19          HG22      THR  19  80.699 -11.421  -4.161
  151   HG23  THR  19          HG23      THR  19  81.643 -12.317  -2.973
  152    H    VAL  20           H        VAL  20  81.542  -7.262  -1.646
  153    HA   VAL  20           HA       VAL  20  79.831  -5.962  -0.819
  154    HB   VAL  20           HB       VAL  20  79.140  -4.217  -2.343
  155   HG11  VAL  20          HG11      VAL  20  81.486  -4.221  -1.529
  156   HG12  VAL  20          HG12      VAL  20  81.344  -3.483  -3.122
  157   HG13  VAL  20          HG13      VAL  20  81.968  -5.123  -2.964
  158   HG21  VAL  20          HG21      VAL  20  79.443  -4.344  -4.708
  159   HG22  VAL  20          HG22      VAL  20  78.656  -5.851  -4.247
  160   HG23  VAL  20          HG23      VAL  20  80.386  -5.823  -4.576
  161    H    GLU  21           H        GLU  21  78.964  -8.651  -1.543
  162    HA   GLU  21           HA       GLU  21  76.110  -8.039  -1.999
  163    HB2  GLU  21           HB2      GLU  21  75.822  -9.841  -3.488
  164    HB3  GLU  21           HB3      GLU  21  77.309  -9.064  -4.030
  165    HG2  GLU  21           HG2      GLU  21  78.509 -10.746  -2.460
  166    HG3  GLU  21           HG3      GLU  21  76.984 -11.630  -2.488
  167    H    LYS  22           H        LYS  22  74.940  -8.653  -0.327
  168    HA   LYS  22           HA       LYS  22  75.846  -9.963   1.929
  169    HB2  LYS  22           HB2      LYS  22  73.654  -8.675   1.570
  170    HB3  LYS  22           HB3      LYS  22  72.998 -10.194   0.963
  171    HG2  LYS  22           HG2      LYS  22  72.453 -10.410   3.203
  172    HG3  LYS  22           HG3      LYS  22  74.053 -11.149   3.219
  173    HD2  LYS  22           HD2      LYS  22  74.996  -8.864   3.780
  174    HD3  LYS  22           HD3      LYS  22  73.336  -8.308   3.989
  175    HE2  LYS  22           HE2      LYS  22  74.879 -10.301   5.627
  176    HE3  LYS  22           HE3      LYS  22  73.913  -8.929   6.170
  177    HZ1  LYS  22           HZ1      LYS  22  72.660 -10.854   6.623
  178    HZ2  LYS  22           HZ2      LYS  22  72.952 -11.513   5.084
  179    HZ3  LYS  22           HZ3      LYS  22  71.944 -10.156   5.253
  180    H    GLY  23           H        GLY  23  75.764 -12.061   2.702
  181    HA2  GLY  23           HA2      GLY  23  76.007 -14.345   2.565
  182    HA3  GLY  23           HA3      GLY  23  74.561 -14.284   1.563
  183    H    GLY  24           H        GLY  24  77.538 -12.675   0.651
  184    HA2  GLY  24           HA2      GLY  24  77.668 -14.309  -1.768
  185    HA3  GLY  24           HA3      GLY  24  78.577 -12.837  -1.448
  186    H    LYS  25           H        LYS  25  80.606 -13.544  -1.853
  187    HA   LYS  25           HA       LYS  25  81.805 -15.305   0.135
  188    HB2  LYS  25           HB2      LYS  25  82.994 -16.501  -1.883
  189    HB3  LYS  25           HB3      LYS  25  81.397 -17.040  -1.360
  190    HG2  LYS  25           HG2      LYS  25  80.310 -15.853  -3.125
  191    HG3  LYS  25           HG3      LYS  25  81.778 -14.957  -3.519
  192    HD2  LYS  25           HD2      LYS  25  82.836 -16.878  -4.432
  193    HD3  LYS  25           HD3      LYS  25  81.659 -17.970  -3.703
  194    HE2  LYS  25           HE2      LYS  25  80.842 -15.879  -5.725
  195    HE3  LYS  25           HE3      LYS  25  81.389 -17.481  -6.216
  196    HZ1  LYS  25           HZ1      LYS  25  79.399 -17.429  -4.110
  197    HZ2  LYS  25           HZ2      LYS  25  79.527 -18.450  -5.462
  198    HZ3  LYS  25           HZ3      LYS  25  78.859 -16.896  -5.627
  199    H    HIS  26           H        HIS  26  83.245 -13.851   0.870
  200    HA   HIS  26           HA       HIS  26  84.454 -11.789  -0.559
  201    HB2  HIS  26           HB2      HIS  26  86.351 -12.549   1.370
  202    HB3  HIS  26           HB1      HIS  26  85.079 -11.346   1.558
  203    HD1  HIS  26           HD1      HIS  26  85.431 -15.142   1.849
  204    HD2  HIS  26           HD2      HIS  26  83.304 -11.991   3.561
  205    HE1  HIS  26           HE1      HIS  26  84.049 -16.143   3.720
  206    HE2  HIS  26           HE2      HIS  26  82.748 -14.235   4.775
  207    H    LYS  27           H        LYS  27  85.896 -11.759  -2.135
  208    HA   LYS  27           HA       LYS  27  87.701 -14.086  -2.474
  209    HB2  LYS  27           HB2      LYS  27  86.059 -14.067  -4.261
  210    HB3  LYS  27           HB3      LYS  27  86.383 -12.364  -4.588
  211    HG2  LYS  27           HG2      LYS  27  88.588 -12.832  -5.375
  212    HG3  LYS  27           HG3      LYS  27  88.538 -14.479  -4.745
  213    HD2  LYS  27           HD2      LYS  27  88.179 -14.350  -7.227
  214    HD3  LYS  27           HD3      LYS  27  86.841 -15.107  -6.363
  215    HE2  LYS  27           HE2      LYS  27  85.463 -13.209  -6.584
  216    HE3  LYS  27           HE3      LYS  27  86.826 -12.146  -6.932
  217    HZ1  LYS  27           HZ1      LYS  27  85.212 -13.485  -8.751
  218    HZ2  LYS  27           HZ2      LYS  27  86.739 -14.226  -8.830
  219    HZ3  LYS  27           HZ3      LYS  27  86.590 -12.553  -9.080
  220    H    THR  28           H        THR  28  89.746 -13.550  -2.080
  221    HA   THR  28           HA       THR  28  91.670 -12.311  -1.847
  222    HB   THR  28           HB       THR  28  90.723 -10.662  -4.182
  223    HG1  THR  28           HG1      THR  28  91.294 -12.341  -5.509
  224   HG21  THR  28          HG21      THR  28  93.446 -11.864  -3.815
  225   HG22  THR  28          HG22      THR  28  93.004 -10.452  -2.857
  226   HG23  THR  28          HG23      THR  28  92.989 -10.362  -4.618
  227    H    GLY  29           H        GLY  29  89.179 -11.402  -0.516
  228    HA2  GLY  29           HA2      GLY  29  90.067  -9.173   0.820
  229    HA3  GLY  29           HA3      GLY  29  89.151  -8.534  -0.542
  230    HA   PRO  30           HA       PRO  30  86.347 -10.063   3.019
  231    HB2  PRO  30           HB2      PRO  30  85.965  -7.755   4.426
  232    HB3  PRO  30           HB1      PRO  30  87.279  -8.894   4.783
  233    HG2  PRO  30           HG2      PRO  30  87.361  -6.332   3.259
  234    HG3  PRO  30           HG1      PRO  30  88.519  -6.986   4.431
  235    HD2  PRO  30           HD2      PRO  30  88.901  -7.133   1.720
  236    HD3  PRO  30           HD1      PRO  30  89.559  -8.327   2.861
  237    H    ASN  31           H        ASN  31  84.085  -9.242   3.453
  238    HA   ASN  31           HA       ASN  31  82.975  -8.116   0.992
  239    HB2  ASN  31           HB2      ASN  31  80.883  -8.934   1.743
  240    HB3  ASN  31           HB1      ASN  31  82.047 -10.169   2.218
  241   HD21  ASN  31          HD21      ASN  31  81.939 -10.800   4.375
  242   HD22  ASN  31          HD22      ASN  31  81.237  -9.886   5.619
  243    H    LEU  32           H        LEU  32  81.160  -6.494   1.255
  244    HA   LEU  32           HA       LEU  32  81.831  -4.525   3.368
  245    HB2  LEU  32           HB2      LEU  32  80.710  -3.846   0.648
  246    HB3  LEU  32           HB3      LEU  32  81.360  -2.740   1.850
  247    HG   LEU  32           HG       LEU  32  82.889  -4.767   0.197
  248   HD11  LEU  32          HD11      LEU  32  82.158  -2.300  -0.522
  249   HD12  LEU  32          HD12      LEU  32  83.745  -2.940  -0.941
  250   HD13  LEU  32          HD13      LEU  32  83.566  -1.859   0.441
  251   HD21  LEU  32          HD21      LEU  32  84.839  -3.458   1.492
  252   HD22  LEU  32          HD22      LEU  32  84.123  -4.925   2.146
  253   HD23  LEU  32          HD23      LEU  32  83.599  -3.353   2.736
  254    H    HIS  33           H        HIS  33  79.893  -6.607   3.668
  255    HA   HIS  33           HA       HIS  33  77.258  -5.762   3.087
  256    HB2  HIS  33           HB2      HIS  33  78.225  -7.502   5.370
  257    HB3  HIS  33           HB1      HIS  33  76.566  -7.393   4.782
  258    HD1  HIS  33           HD1      HIS  33  78.251 -10.057   4.686
  259    HD2  HIS  33           HD2      HIS  33  77.781  -7.412   1.498
  260    HE1  HIS  33           HE1      HIS  33  78.680 -11.392   2.578
  261    HE2  HIS  33           HE2      HIS  33  78.397  -9.795   0.625
  262    H    GLY  34           H        GLY  34  75.777  -4.554   4.239
  263    HA2  GLY  34           HA2      GLY  34  75.258  -2.640   5.479
  264    HA3  GLY  34           HA3      GLY  34  75.624  -3.749   6.799
  265    H    LEU  35           H        LEU  35  78.010  -2.690   4.491
  266    HA   LEU  35           HA       LEU  35  80.026  -2.058   6.210
  267    HB2  LEU  35           HB2      LEU  35  80.329  -2.144   3.800
  268    HB3  LEU  35           HB3      LEU  35  79.322  -0.716   3.592
  269    HG   LEU  35           HG       LEU  35  81.113   0.352   5.267
  270   HD11  LEU  35          HD11      LEU  35  83.265  -0.580   5.158
  271   HD12  LEU  35          HD12      LEU  35  82.866  -1.563   3.754
  272   HD13  LEU  35          HD13      LEU  35  82.233  -1.997   5.340
  273   HD21  LEU  35          HD21      LEU  35  80.567   0.987   2.864
  274   HD22  LEU  35          HD22      LEU  35  81.846  -0.121   2.371
  275   HD23  LEU  35          HD23      LEU  35  82.232   1.284   3.364
  276    H    PHE  36           H        PHE  36  77.804   0.346   4.807
  277    HA   PHE  36           HA       PHE  36  78.693   2.542   6.274
  278    HB2  PHE  36           HB2      PHE  36  75.832   2.112   5.394
  279    HB3  PHE  36           HB1      PHE  36  76.679   3.645   5.604
  280    HD1  PHE  36           HD2      PHE  36  76.593   0.520   3.570
  281    HD2  PHE  36           HD1      PHE  36  78.036   4.560   3.858
  282    HE1  PHE  36           HE2      PHE  36  77.403   0.401   1.233
  283    HE2  PHE  36           HE1      PHE  36  78.833   4.440   1.523
  284    HZ   PHE  36           HZ       PHE  36  78.521   2.362   0.206
  285    H    GLY  37           H        GLY  37  79.057   1.980   8.443
  286    HA2  GLY  37           HA2      GLY  37  77.571   2.729  10.440
  287    HA3  GLY  37           HA3      GLY  37  76.695   1.258  10.051
  288    H    ARG  38           H        ARG  38  79.272  -0.124   9.309
  289    HA   ARG  38           HA       ARG  38  79.916  -0.983  12.023
  290    HB2  ARG  38           HB2      ARG  38  80.227  -2.088   9.294
  291    HB3  ARG  38           HB3      ARG  38  81.502  -2.511  10.435
  292    HG2  ARG  38           HG2      ARG  38  79.610  -3.154  12.060
  293    HG3  ARG  38           HG3      ARG  38  78.540  -3.069  10.660
  294    HD2  ARG  38           HD2      ARG  38  81.067  -4.661  10.419
  295    HD3  ARG  38           HD3      ARG  38  79.733  -5.349  11.336
  296    HE   ARG  38           HE       ARG  38  78.464  -4.646   9.097
  297   HH11  ARG  38          HH21      ARG  38  81.549  -6.170   9.570
  298   HH12  ARG  38          HH22      ARG  38  81.484  -7.057   8.086
  299   HH21  ARG  38          HH11      ARG  38  78.382  -5.826   7.164
  300   HH22  ARG  38          HH12      ARG  38  79.695  -6.870   6.732
  301    H    LYS  39           H        LYS  39  81.934  -0.948  12.973
  302    HA   LYS  39           HA       LYS  39  83.614   1.258  12.352
  303    HB2  LYS  39           HB2      LYS  39  83.566  -0.916  14.367
  304    HB3  LYS  39           HB3      LYS  39  85.141  -0.190  14.050
  305    HG2  LYS  39           HG2      LYS  39  82.749   1.583  14.500
  306    HG3  LYS  39           HG3      LYS  39  83.576   0.866  15.881
  307    HD2  LYS  39           HD2      LYS  39  85.730   1.823  15.037
  308    HD3  LYS  39           HD3      LYS  39  84.829   2.628  13.754
  309    HE2  LYS  39           HE2      LYS  39  83.608   3.962  15.319
  310    HE3  LYS  39           HE3      LYS  39  84.172   2.996  16.682
  311    HZ1  LYS  39           HZ1      LYS  39  86.184   3.994  16.682
  312    HZ2  LYS  39           HZ2      LYS  39  85.304   5.272  15.987
  313    HZ3  LYS  39           HZ3      LYS  39  86.210   4.225  15.002
  314    H    THR  40           H        THR  40  86.072   0.928  12.186
  315    HA   THR  40           HA       THR  40  86.622  -0.404   9.740
  316    HB   THR  40           HB       THR  40  89.039   0.169  10.374
  317    HG1  THR  40           HG1      THR  40  87.697   1.630  12.389
  318   HG21  THR  40          HG21      THR  40  88.426   2.714  10.255
  319   HG22  THR  40          HG22      THR  40  86.778   2.119  10.049
  320   HG23  THR  40          HG23      THR  40  88.029   1.667   8.891
  321    H    GLY  41           H        GLY  41  87.852  -2.212   9.297
  322    HA2  GLY  41           HA2      GLY  41  88.384  -4.433   9.593
  323    HA3  GLY  41           HA3      GLY  41  89.348  -3.811  10.930
  324    H    GLN  42           H        GLN  42  85.840  -4.145  10.399
  325    HA   GLN  42           HA       GLN  42  85.653  -5.448  13.047
  326    HB2  GLN  42           HB2      GLN  42  84.296  -3.407  12.744
  327    HB3  GLN  42           HB1      GLN  42  83.475  -4.166  11.378
  328    HG2  GLN  42           HG2      GLN  42  82.458  -5.805  12.753
  329    HG3  GLN  42           HG1      GLN  42  83.556  -5.483  14.093
  330   HE21  GLN  42          HE21      GLN  42  82.140  -2.806  12.285
  331   HE22  GLN  42          HE22      GLN  42  81.090  -2.296  13.519
  332    H    ALA  43           H        ALA  43  85.356  -5.985   9.674
  333    HA   ALA  43           HA       ALA  43  83.591  -8.252   9.854
  334    HB1  ALA  43           HB1      ALA  43  84.787  -8.514   7.428
  335    HB2  ALA  43           HB2      ALA  43  85.050  -6.797   7.734
  336    HB3  ALA  43           HB3      ALA  43  83.413  -7.450   7.731
  337    HA   PRO  44           HA       PRO  44  87.018 -10.923  11.029
  338    HB2  PRO  44           HB2      PRO  44  85.605 -13.203  11.407
  339    HB3  PRO  44           HB1      PRO  44  85.526 -11.845  12.547
  340    HG2  PRO  44           HG2      PRO  44  83.600 -12.637  10.413
  341    HG3  PRO  44           HG1      PRO  44  83.286 -12.050  12.056
  342    HD2  PRO  44           HD2      PRO  44  83.144 -10.457   9.803
  343    HD3  PRO  44           HD1      PRO  44  83.466  -9.838  11.439
  344    H    GLY  45           H        GLY  45  85.151 -11.026   8.226
  345    HA2  GLY  45           HA2      GLY  45  85.682 -13.425   6.978
  346    HA3  GLY  45           HA3      GLY  45  85.569 -11.888   6.129
  347    H    PHE  46           H        PHE  46  87.603 -10.508   6.262
  348    HA   PHE  46           HA       PHE  46  89.905 -12.230   5.646
  349    HB2  PHE  46           HB2      PHE  46  89.048 -10.444   4.042
  350    HB3  PHE  46           HB1      PHE  46  89.673  -9.256   5.184
  351    HD1  PHE  46           HD2      PHE  46  90.586 -12.044   2.921
  352    HD2  PHE  46           HD1      PHE  46  92.040  -8.884   5.444
  353    HE1  PHE  46           HE2      PHE  46  92.862 -12.341   1.982
  354    HE2  PHE  46           HE1      PHE  46  94.316  -9.182   4.503
  355    HZ   PHE  46           HZ       PHE  46  94.727 -10.910   2.772
  356    H    THR  47           H        THR  47  92.008 -11.730   6.445
  357    HA   THR  47           HA       THR  47  92.050 -11.040   9.223
  358    HB   THR  47           HB       THR  47  94.449 -11.295   7.408
  359    HG1  THR  47           HG1      THR  47  92.679 -13.210   8.439
  360   HG21  THR  47          HG21      THR  47  95.605 -11.902   9.400
  361   HG22  THR  47          HG22      THR  47  94.100 -12.111  10.295
  362   HG23  THR  47          HG23      THR  47  94.632 -10.495   9.831
  363    H    TYR  48           H        TYR  48  91.222  -8.904   9.235
  364    HA   TYR  48           HA       TYR  48  92.266  -6.743   7.780
  365    HB2  TYR  48           HB2      TYR  48  90.702  -7.009  10.320
  366    HB3  TYR  48           HB3      TYR  48  91.336  -5.430   9.862
  367    HD1  TYR  48           HD2      TYR  48  90.637  -4.341   7.779
  368    HD2  TYR  48           HD1      TYR  48  88.951  -8.085   9.029
  369    HE1  TYR  48           HE2      TYR  48  88.790  -4.047   6.158
  370    HE2  TYR  48           HE1      TYR  48  87.101  -7.795   7.403
  371    HH   TYR  48           HH       TYR  48  86.430  -4.857   5.912
  372    H    THR  49           H        THR  49  93.650  -5.046   8.388
  373    HA   THR  49           HA       THR  49  95.973  -5.938   9.879
  374    HB   THR  49           HB       THR  49  96.989  -3.857   9.117
  375    HG1  THR  49           HG1      THR  49  95.501  -2.330   9.160
  376   HG21  THR  49          HG21      THR  49  95.329  -4.815   6.797
  377   HG22  THR  49          HG22      THR  49  96.516  -5.884   7.545
  378   HG23  THR  49          HG23      THR  49  97.032  -4.360   6.825
  379    H    ASP  50           H        ASP  50  96.963  -4.603  11.565
  380    HA   ASP  50           HA       ASP  50  95.293  -4.133  13.739
  381    HB2  ASP  50           HB2      ASP  50  97.904  -2.689  13.292
  382    HB3  ASP  50           HB1      ASP  50  97.176  -3.168  14.825
  383    H    ALA  51           H        ALA  51  96.497  -1.878  11.291
  384    HA   ALA  51           HA       ALA  51  95.606   0.525  12.395
  385    HB1  ALA  51           HB1      ALA  51  95.886  -0.362   9.522
  386    HB2  ALA  51           HB2      ALA  51  97.024   0.588  10.477
  387    HB3  ALA  51           HB3      ALA  51  95.484   1.292   9.984
  388    H    ASN  52           H        ASN  52  93.872  -1.837  10.398
  389    HA   ASN  52           HA       ASN  52  91.448  -0.250  10.368
  390    HB2  ASN  52           HB2      ASN  52  92.345  -2.859   9.238
  391    HB3  ASN  52           HB1      ASN  52  90.616  -2.655   9.503
  392   HD21  ASN  52          HD21      ASN  52  90.186  -2.549   7.187
  393   HD22  ASN  52          HD22      ASN  52  90.615  -1.180   6.277
  394    H    LYS  53           H        LYS  53  92.866  -2.747  12.303
  395    HA   LYS  53           HA       LYS  53  90.379  -3.427  13.650
  396    HB2  LYS  53           HB2      LYS  53  91.594  -5.335  13.818
  397    HB3  LYS  53           HB3      LYS  53  93.104  -4.498  13.492
  398    HG2  LYS  53           HG2      LYS  53  93.232  -3.765  15.834
  399    HG3  LYS  53           HG3      LYS  53  91.679  -4.533  16.171
  400    HD2  LYS  53           HD2      LYS  53  92.629  -6.727  15.579
  401    HD3  LYS  53           HD3      LYS  53  94.179  -5.963  15.225
  402    HE2  LYS  53           HE2      LYS  53  92.839  -5.686  17.920
  403    HE3  LYS  53           HE3      LYS  53  93.934  -7.019  17.551
  404    HZ1  LYS  53           HZ1      LYS  53  95.713  -5.586  17.259
  405    HZ2  LYS  53           HZ2      LYS  53  94.902  -4.912  18.591
  406    HZ3  LYS  53           HZ3      LYS  53  94.727  -4.222  17.048
  407    H    ASN  54           H        ASN  54  92.721  -1.024  13.807
  408    HA   ASN  54           HA       ASN  54  92.885  -0.550  16.594
  409    HB2  ASN  54           HB2      ASN  54  94.032   1.358  16.017
  410    HB3  ASN  54           HB1      ASN  54  94.232   0.427  14.539
  411   HD21  ASN  54          HD21      ASN  54  91.555   0.809  13.488
  412   HD22  ASN  54          HD22      ASN  54  91.392   2.448  13.082
  413    H    LYS  55           H        LYS  55  90.429  -0.055  14.287
  414    HA   LYS  55           HA       LYS  55  88.326   0.882  14.400
  415    HB2  LYS  55           HB2      LYS  55  88.565   1.061  17.387
  416    HB3  LYS  55           HB3      LYS  55  87.167   0.632  16.403
  417    HG2  LYS  55           HG2      LYS  55  88.656  -1.420  15.687
  418    HG3  LYS  55           HG3      LYS  55  89.531  -1.054  17.173
  419    HD2  LYS  55           HD2      LYS  55  87.930  -2.520  17.993
  420    HD3  LYS  55           HD3      LYS  55  87.089  -0.986  18.214
  421    HE2  LYS  55           HE2      LYS  55  86.127  -1.366  15.858
  422    HE3  LYS  55           HE3      LYS  55  86.707  -3.023  16.015
  423    HZ1  LYS  55           HZ1      LYS  55  84.943  -1.701  17.999
  424    HZ2  LYS  55           HZ2      LYS  55  85.371  -3.344  17.935
  425    HZ3  LYS  55           HZ3      LYS  55  84.370  -2.677  16.735
  426    H    GLY  56           H        GLY  56  89.806   2.747  13.551
  427    HA2  GLY  56           HA2      GLY  56  90.057   4.993  15.382
  428    HA3  GLY  56           HA3      GLY  56  90.551   4.960  13.692
  429    H    ILE  57           H        ILE  57  88.167   4.172  12.485
  430    HA   ILE  57           HA       ILE  57  86.138   6.120  13.319
  431    HB   ILE  57           HB       ILE  57  86.013   7.154  11.137
  432   HG12  ILE  57          HG12      ILE  57  87.975   6.538   9.515
  433   HG13  ILE  57          HG13      ILE  57  88.058   5.041  10.440
  434   HG21  ILE  57          HG21      ILE  57  88.925   7.040  11.960
  435   HG22  ILE  57          HG22      ILE  57  87.703   7.967  12.829
  436   HG23  ILE  57          HG23      ILE  57  88.094   8.372  11.157
  437   HD11  ILE  57          HD11      ILE  57  85.318   5.770   9.624
  438   HD12  ILE  57          HD12      ILE  57  86.160   4.228   9.498
  439   HD13  ILE  57          HD13      ILE  57  86.410   5.467   8.276
  440    H    THR  58           H        THR  58  84.167   5.914  11.818
  441    HA   THR  58           HA       THR  58  83.723   3.038  11.302
  442    HB   THR  58           HB       THR  58  81.832   5.235  12.145
  443    HG1  THR  58           HG1      THR  58  81.679   4.029  13.958
  444   HG21  THR  58          HG21      THR  58  80.565   4.000  10.569
  445   HG22  THR  58          HG22      THR  58  80.146   3.289  12.127
  446   HG23  THR  58          HG23      THR  58  81.289   2.472  11.064
  447    H    TRP  59           H        TRP  59  82.877   2.348   9.392
  448    HA   TRP  59           HA       TRP  59  83.245   3.947   7.088
  449    HB2  TRP  59           HB2      TRP  59  81.420   1.550   7.198
  450    HB3  TRP  59           HB1      TRP  59  82.389   2.133   5.845
  451    HD1  TRP  59           HD1      TRP  59  85.168   2.476   7.234
  452    HE1  TRP  59           HE1      TRP  59  86.502   0.394   7.992
  453    HE3  TRP  59           HE3      TRP  59  81.393  -0.939   7.573
  454    HZ2  TRP  59           HZ2      TRP  59  86.016  -2.335   8.684
  455    HZ3  TRP  59           HZ3      TRP  59  81.854  -3.268   8.274
  456    HH2  TRP  59           HH2      TRP  59  84.162  -3.968   8.830
  457    H    LYS  60           H        LYS  60  81.871   5.188   5.927
  458    HA   LYS  60           HA       LYS  60  79.010   5.177   6.439
  459    HB2  LYS  60           HB2      LYS  60  80.750   7.568   7.098
  460    HB3  LYS  60           HB3      LYS  60  78.997   7.641   6.933
  461    HG2  LYS  60           HG2      LYS  60  78.905   5.764   8.679
  462    HG3  LYS  60           HG3      LYS  60  80.606   6.110   8.982
  463    HD2  LYS  60           HD2      LYS  60  78.500   8.277   9.059
  464    HD3  LYS  60           HD3      LYS  60  78.908   7.318  10.480
  465    HE2  LYS  60           HE2      LYS  60  81.306   7.982  10.172
  466    HE3  LYS  60           HE3      LYS  60  80.796   9.054   8.869
  467    HZ1  LYS  60           HZ1      LYS  60  80.144   9.219  11.744
  468    HZ2  LYS  60           HZ2      LYS  60  79.201  10.016  10.578
  469    HZ3  LYS  60           HZ3      LYS  60  80.847  10.400  10.751
  470    H    GLU  61           H        GLU  61  78.451   7.656   5.207
  471    HA   GLU  61           HA       GLU  61  78.894   6.931   2.458
  472    HB2  GLU  61           HB2      GLU  61  76.791   8.009   3.371
  473    HB3  GLU  61           HB3      GLU  61  77.710   9.509   3.497
  474    HG2  GLU  61           HG2      GLU  61  78.178   9.469   1.102
  475    HG3  GLU  61           HG3      GLU  61  77.374   7.909   0.945
  476    H    GLU  62           H        GLU  62  79.673   9.875   4.334
  477    HA   GLU  62           HA       GLU  62  81.417  10.918   2.336
  478    HB2  GLU  62           HB2      GLU  62  81.270  11.591   5.286
  479    HB3  GLU  62           HB3      GLU  62  82.040  12.566   4.033
  480    HG2  GLU  62           HG2      GLU  62  79.799  12.649   2.857
  481    HG3  GLU  62           HG3      GLU  62  79.097  11.910   4.294
  482    H    THR  63           H        THR  63  81.982   9.172   5.384
  483    HA   THR  63           HA       THR  63  84.748   9.279   5.492
  484    HB   THR  63           HB       THR  63  84.632   7.121   6.689
  485    HG1  THR  63           HG1      THR  63  82.692   6.636   5.115
  486   HG21  THR  63          HG21      THR  63  82.501   9.177   7.265
  487   HG22  THR  63          HG22      THR  63  84.094   9.025   8.007
  488   HG23  THR  63          HG23      THR  63  82.842   7.833   8.356
  489    H    LEU  64           H        LEU  64  82.642   7.223   3.565
  490    HA   LEU  64           HA       LEU  64  84.709   5.582   2.499
  491    HB2  LEU  64           HB2      LEU  64  81.835   5.920   2.131
  492    HB3  LEU  64           HB3      LEU  64  82.661   5.588   0.617
  493    HG   LEU  64           HG       LEU  64  83.038   3.936   3.129
  494   HD11  LEU  64          HD11      LEU  64  80.964   3.892   1.024
  495   HD12  LEU  64          HD12      LEU  64  80.932   3.216   2.649
  496   HD13  LEU  64          HD13      LEU  64  81.717   2.330   1.342
  497   HD21  LEU  64          HD21      LEU  64  83.734   2.327   1.081
  498   HD22  LEU  64          HD22      LEU  64  84.891   3.403   1.857
  499   HD23  LEU  64          HD23      LEU  64  84.126   3.880   0.343
  500    H    MET  65           H        MET  65  83.240   8.648   1.523
  501    HA   MET  65           HA       MET  65  84.287   8.798  -1.084
  502    HB2  MET  65           HB2      MET  65  83.743  11.049   0.864
  503    HB3  MET  65           HB1      MET  65  84.010  11.244  -0.866
  504    HG2  MET  65           HG2      MET  65  82.036   9.960  -1.387
  505    HG3  MET  65           HG1      MET  65  81.826   9.513   0.303
  506    HE1  MET  65           HE1      MET  65  81.828  12.292  -2.338
  507    HE2  MET  65           HE2      MET  65  80.340  13.120  -1.886
  508    HE3  MET  65           HE3      MET  65  80.301  11.402  -2.273
  509    H    GLU  66           H        GLU  66  85.599  10.286   1.890
  510    HA   GLU  66           HA       GLU  66  88.010  11.156   0.714
  511    HB2  GLU  66           HB2      GLU  66  87.498  10.402   3.603
  512    HB3  GLU  66           HB3      GLU  66  88.823  11.404   3.009
  513    HG2  GLU  66           HG2      GLU  66  85.874  12.053   2.728
  514    HG3  GLU  66           HG3      GLU  66  86.970  12.786   3.897
  515    H    TYR  67           H        TYR  67  86.977   8.101   2.010
  516    HA   TYR  67           HA       TYR  67  89.614   6.933   2.126
  517    HB2  TYR  67           HB2      TYR  67  88.039   6.013   3.634
  518    HB3  TYR  67           HB3      TYR  67  86.812   5.866   2.385
  519    HD1  TYR  67           HD2      TYR  67  87.047   4.149   0.584
  520    HD2  TYR  67           HD1      TYR  67  89.709   4.317   3.952
  521    HE1  TYR  67           HE2      TYR  67  87.798   1.833   0.107
  522    HE2  TYR  67           HE1      TYR  67  90.458   2.001   3.476
  523    HH   TYR  67           HH       TYR  67  89.233   0.221   0.643
  524    H    LEU  68           H        LEU  68  87.086   7.300  -0.226
  525    HA   LEU  68           HA       LEU  68  88.049   5.236  -1.996
  526    HB2  LEU  68           HB2      LEU  68  85.906   7.329  -2.093
  527    HB3  LEU  68           HB3      LEU  68  86.447   6.608  -3.605
  528    HG   LEU  68           HG       LEU  68  85.455   5.058  -1.194
  529   HD11  LEU  68          HD11      LEU  68  83.444   4.685  -2.402
  530   HD12  LEU  68          HD12      LEU  68  84.120   5.347  -3.889
  531   HD13  LEU  68          HD13      LEU  68  83.751   6.416  -2.538
  532   HD21  LEU  68          HD21      LEU  68  85.324   3.404  -3.372
  533   HD22  LEU  68          HD22      LEU  68  86.637   3.409  -2.200
  534   HD23  LEU  68          HD23      LEU  68  86.799   4.302  -3.709
  535    H    GLU  69           H        GLU  69  88.757   8.557  -1.402
  536    HA   GLU  69           HA       GLU  69  90.069   8.928  -3.987
  537    HB2  GLU  69           HB2      GLU  69  89.009  10.908  -3.418
  538    HB3  GLU  69           HB3      GLU  69  89.284  10.683  -1.692
  539    HG2  GLU  69           HG2      GLU  69  91.565  11.334  -1.868
  540    HG3  GLU  69           HG3      GLU  69  91.542  11.206  -3.627
  541    H    ASN  70           H        ASN  70  90.760   7.784  -0.885
  542    HA   ASN  70           HA       ASN  70  93.518   7.358  -1.482
  543    HB2  ASN  70           HB2      ASN  70  94.457   8.721   0.356
  544    HB3  ASN  70           HB1      ASN  70  93.714   9.715  -0.894
  545   HD21  ASN  70          HD21      ASN  70  93.331   8.552   2.438
  546   HD22  ASN  70          HD22      ASN  70  92.089   9.635   2.851
  547    HA   PRO  71           HA       PRO  71  91.141   4.517   1.453
  548    HB2  PRO  71           HB2      PRO  71  92.902   2.682  -0.125
  549    HB3  PRO  71           HB1      PRO  71  91.216   2.466   0.382
  550    HG2  PRO  71           HG2      PRO  71  91.850   3.107  -2.128
  551    HG3  PRO  71           HG1      PRO  71  90.391   3.736  -1.343
  552    HD2  PRO  71           HD2      PRO  71  92.928   5.149  -2.001
  553    HD3  PRO  71           HD1      PRO  71  91.281   5.798  -1.842
  554    H    LYS  72           H        LYS  72  94.558   4.606   0.485
  555    HA   LYS  72           HA       LYS  72  95.487   3.292   2.866
  556    HB2  LYS  72           HB2      LYS  72  96.673   3.204   0.678
  557    HB3  LYS  72           HB3      LYS  72  97.057   4.913   0.858
  558    HG2  LYS  72           HG2      LYS  72  98.853   4.369   2.111
  559    HG3  LYS  72           HG3      LYS  72  97.782   3.649   3.310
  560    HD2  LYS  72           HD2      LYS  72  98.686   2.164   0.830
  561    HD3  LYS  72           HD3      LYS  72  99.566   2.099   2.355
  562    HE2  LYS  72           HE2      LYS  72  96.670   1.295   1.940
  563    HE3  LYS  72           HE3      LYS  72  98.025   0.197   2.196
  564    HZ1  LYS  72           HZ1      LYS  72  98.388   1.556   4.321
  565    HZ2  LYS  72           HZ2      LYS  72  97.115   0.431   4.294
  566    HZ3  LYS  72           HZ3      LYS  72  96.794   2.088   4.096
  567    H    LYS  73           H        LYS  73  95.605   6.664   1.694
  568    HA   LYS  73           HA       LYS  73  96.965   7.675   3.951
  569    HB2  LYS  73           HB2      LYS  73  96.432   8.734   1.580
  570    HB3  LYS  73           HB3      LYS  73  95.062   9.421   2.449
  571    HG2  LYS  73           HG2      LYS  73  96.781  10.145   4.229
  572    HG3  LYS  73           HG3      LYS  73  98.006   9.783   3.014
  573    HD2  LYS  73           HD2      LYS  73  97.627  12.024   2.547
  574    HD3  LYS  73           HD3      LYS  73  96.445  11.282   1.470
  575    HE2  LYS  73           HE2      LYS  73  94.688  11.587   3.168
  576    HE3  LYS  73           HE3      LYS  73  95.866  12.299   4.270
  577    HZ1  LYS  73           HZ1      LYS  73  96.219  14.095   2.757
  578    HZ2  LYS  73           HZ2      LYS  73  94.547  13.951   3.023
  579    HZ3  LYS  73           HZ3      LYS  73  95.234  13.377   1.579
  580    H    TYR  74           H        TYR  74  93.697   6.692   3.555
  581    HA   TYR  74           HA       TYR  74  92.586   8.412   5.575
  582    HB2  TYR  74           HB2      TYR  74  91.438   7.017   3.603
  583    HB3  TYR  74           HB3      TYR  74  91.271   5.823   4.889
  584    HD1  TYR  74           HD1      TYR  74  90.898   9.541   4.457
  585    HD2  TYR  74           HD2      TYR  74  89.304   5.923   6.139
  586    HE1  TYR  74           HE1      TYR  74  88.986  10.815   5.387
  587    HE2  TYR  74           HE2      TYR  74  87.392   7.199   7.067
  588    HH   TYR  74           HH       TYR  74  87.139   9.892   7.751
  589    H    ILE  75           H        ILE  75  93.246   4.905   5.481
  590    HA   ILE  75           HA       ILE  75  93.735   5.007   8.400
  591    HB   ILE  75           HB       ILE  75  92.371   2.764   6.886
  592   HG12  ILE  75          HG12      ILE  75  91.140   4.545   8.995
  593   HG13  ILE  75          HG13      ILE  75  91.093   4.989   7.289
  594   HG21  ILE  75          HG21      ILE  75  91.892   2.053   9.317
  595   HG22  ILE  75          HG22      ILE  75  93.162   3.188   9.774
  596   HG23  ILE  75          HG23      ILE  75  93.538   1.817   8.731
  597   HD11  ILE  75          HD11      ILE  75  89.817   3.079   6.709
  598   HD12  ILE  75          HD12      ILE  75  89.087   3.657   8.207
  599   HD13  ILE  75          HD13      ILE  75  90.179   2.272   8.235
  600    HA   PRO  76           HA       PRO  76  97.522   3.684   5.935
  601    HB2  PRO  76           HB2      PRO  76  98.513   4.537   8.639
  602    HB3  PRO  76           HB1      PRO  76  99.245   4.791   7.041
  603    HG2  PRO  76           HG2      PRO  76  97.927   6.744   8.283
  604    HG3  PRO  76           HG1      PRO  76  97.840   6.538   6.525
  605    HD2  PRO  76           HD2      PRO  76  95.760   5.994   8.576
  606    HD3  PRO  76           HD1      PRO  76  95.570   6.370   6.849
  607    H    GLY  77           H        GLY  77  98.060   1.588   5.893
  608    HA2  GLY  77           HA2      GLY  77  99.102  -0.277   7.134
  609    HA3  GLY  77           HA3      GLY  77  97.912   0.011   8.401
  610    H    THR  78           H        THR  78  95.766   0.537   6.448
  611    HA   THR  78           HA       THR  78  94.616  -1.995   6.280
  612    HB   THR  78           HB       THR  78  93.421   0.203   6.067
  613    HG1  THR  78           HG1      THR  78  91.984  -1.151   5.393
  614   HG21  THR  78          HG21      THR  78  94.257   0.054   3.171
  615   HG22  THR  78          HG22      THR  78  95.120   1.043   4.348
  616   HG23  THR  78          HG23      THR  78  93.423   1.369   3.997
  617    H    LYS  79           H        LYS  79  94.501  -3.562   4.699
  618    HA   LYS  79           HA       LYS  79  96.657  -3.494   2.728
  619    HB2  LYS  79           HB2      LYS  79  95.915  -5.491   4.292
  620    HB3  LYS  79           HB3      LYS  79  94.767  -5.802   2.992
  621    HG2  LYS  79           HG2      LYS  79  97.782  -5.607   2.724
  622    HG3  LYS  79           HG3      LYS  79  96.807  -7.069   2.572
  623    HD2  LYS  79           HD2      LYS  79  95.566  -5.839   0.682
  624    HD3  LYS  79           HD3      LYS  79  96.901  -4.687   0.718
  625    HE2  LYS  79           HE2      LYS  79  98.479  -6.638   0.440
  626    HE3  LYS  79           HE3      LYS  79  97.068  -7.663   0.178
  627    HZ1  LYS  79           HZ1      LYS  79  96.810  -6.888  -1.878
  628    HZ2  LYS  79           HZ2      LYS  79  98.380  -6.255  -1.734
  629    HZ3  LYS  79           HZ3      LYS  79  97.032  -5.274  -1.407
  630    H    MET  80           H        MET  80  95.929  -2.039   1.184
  631    HA   MET  80           HA       MET  80  94.331  -3.108  -0.895
  632    HB2  MET  80           HB2      MET  80  92.435  -2.573   0.530
  633    HB3  MET  80           HB1      MET  80  93.038  -0.930   0.765
  634    HG2  MET  80           HG2      MET  80  92.706  -0.383  -1.550
  635    HG3  MET  80           HG1      MET  80  92.395  -2.067  -1.967
  636    HE1  MET  80           HE1      MET  80  89.198   0.553  -2.070
  637    HE2  MET  80           HE2      MET  80  90.341  -0.264  -3.133
  638    HE3  MET  80           HE3      MET  80  90.910   0.994  -2.040
  639    H    ILE  81           H        ILE  81  96.013  -2.496  -2.204
  640    HA   ILE  81           HA       ILE  81  96.621   0.392  -2.382
  641    HB   ILE  81           HB       ILE  81  98.196  -2.084  -3.079
  642   HG12  ILE  81          HG12      ILE  81  99.908  -0.914  -1.704
  643   HG13  ILE  81          HG13      ILE  81  98.777   0.414  -1.452
  644   HG21  ILE  81          HG21      ILE  81  98.529   0.739  -4.107
  645   HG22  ILE  81          HG22      ILE  81  98.535  -0.767  -5.025
  646   HG23  ILE  81          HG23      ILE  81  99.899  -0.365  -3.983
  647   HD11  ILE  81          HD11      ILE  81  98.997  -1.605   0.295
  648   HD12  ILE  81          HD12      ILE  81  97.819  -2.339  -0.793
  649   HD13  ILE  81          HD13      ILE  81  97.458  -0.802  -0.005
  650    H    PHE  82           H        PHE  82  95.227   1.256  -3.817
  651    HA   PHE  82           HA       PHE  82  95.345   0.300  -6.569
  652    HB2  PHE  82           HB2      PHE  82  93.398  -0.861  -5.322
  653    HB3  PHE  82           HB1      PHE  82  92.625   0.724  -5.344
  654    HD1  PHE  82           HD1      PHE  82  92.036   1.812  -7.487
  655    HD2  PHE  82           HD2      PHE  82  93.698  -2.146  -7.350
  656    HE1  PHE  82           HE1      PHE  82  91.330   1.434  -9.834
  657    HE2  PHE  82           HE2      PHE  82  92.992  -2.525  -9.696
  658    HZ   PHE  82           HZ       PHE  82  91.807  -0.735 -10.938
  659    H    ALA  83           H        ALA  83  94.266   1.839  -8.065
  660    HA   ALA  83           HA       ALA  83  95.024   4.513  -7.458
  661    HB1  ALA  83           HB1      ALA  83  93.392   3.352  -9.725
  662    HB2  ALA  83           HB2      ALA  83  95.110   3.748  -9.743
  663    HB3  ALA  83           HB3      ALA  83  93.909   5.036  -9.644
  664    H    GLY  84           H        GLY  84  93.955   5.767  -6.070
  665    HA2  GLY  84           HA2      GLY  84  91.329   5.405  -5.166
  666    HA3  GLY  84           HA3      GLY  84  92.240   6.908  -5.041
  667    H    ILE  85           H        ILE  85  89.755   7.458  -5.375
  668    HA   ILE  85           HA       ILE  85  88.998   7.514  -8.199
  669    HB   ILE  85           HB       ILE  85  87.628   8.497  -5.690
  670   HG12  ILE  85          HG12      ILE  85  87.897   5.947  -6.396
  671   HG13  ILE  85          HG13      ILE  85  86.362   6.547  -5.782
  672   HG21  ILE  85          HG21      ILE  85  85.641   8.654  -7.333
  673   HG22  ILE  85          HG22      ILE  85  86.863   8.671  -8.602
  674   HG23  ILE  85          HG23      ILE  85  86.841   9.946  -7.384
  675   HD11  ILE  85          HD11      ILE  85  85.392   6.642  -7.926
  676   HD12  ILE  85          HD12      ILE  85  86.314   5.140  -7.952
  677   HD13  ILE  85          HD13      ILE  85  86.958   6.583  -8.735
  678    H    LYS  86           H        LYS  86  88.374   9.563  -9.232
  679    HA   LYS  86           HA       LYS  86  90.260  11.699  -8.489
  680    HB2  LYS  86           HB2      LYS  86  88.781  11.195 -11.080
  681    HB3  LYS  86           HB3      LYS  86  89.940  12.494 -10.798
  682    HG2  LYS  86           HG2      LYS  86  91.599  10.654 -10.122
  683    HG3  LYS  86           HG3      LYS  86  90.455   9.518 -10.833
  684    HD2  LYS  86           HD2      LYS  86  91.782   9.949 -12.684
  685    HD3  LYS  86           HD3      LYS  86  90.565  11.208 -12.885
  686    HE2  LYS  86           HE2      LYS  86  92.627  12.346 -13.133
  687    HE3  LYS  86           HE3      LYS  86  92.138  12.695 -11.475
  688    HZ1  LYS  86           HZ1      LYS  86  93.527  10.808 -10.759
  689    HZ2  LYS  86           HZ2      LYS  86  94.427  12.043 -11.502
  690    HZ3  LYS  86           HZ3      LYS  86  94.069  10.619 -12.356
  691    H    LYS  87           H        LYS  87  87.078  11.719 -10.132
  692    HA   LYS  87           HA       LYS  87  86.475  14.307  -9.001
  693    HB2  LYS  87           HB2      LYS  87  84.771  12.428 -10.649
  694    HB3  LYS  87           HB3      LYS  87  84.360  14.096 -10.253
  695    HG2  LYS  87           HG2      LYS  87  86.919  13.334 -11.681
  696    HG3  LYS  87           HG3      LYS  87  85.433  13.741 -12.538
  697    HD2  LYS  87           HD2      LYS  87  85.462  15.901 -11.056
  698    HD3  LYS  87           HD3      LYS  87  87.167  15.510 -10.826
  699    HE2  LYS  87           HE2      LYS  87  85.721  16.231 -13.361
  700    HE3  LYS  87           HE3      LYS  87  87.230  16.881 -12.721
  701    HZ1  LYS  87           HZ1      LYS  87  87.842  15.470 -14.468
  702    HZ2  LYS  87           HZ2      LYS  87  86.764  14.248 -13.989
  703    HZ3  LYS  87           HZ3      LYS  87  88.152  14.571 -13.064
  704    H    LYS  88           H        LYS  88  84.466  14.770  -7.847
  705    HA   LYS  88           HA       LYS  88  84.169  13.076  -5.562
  706    HB2  LYS  88           HB2      LYS  88  83.888  15.595  -5.589
  707    HB3  LYS  88           HB3      LYS  88  82.334  15.333  -6.381
  708    HG2  LYS  88           HG2      LYS  88  81.733  13.789  -4.453
  709    HG3  LYS  88           HG3      LYS  88  83.188  14.364  -3.640
  710    HD2  LYS  88           HD2      LYS  88  81.650  15.873  -2.790
  711    HD3  LYS  88           HD3      LYS  88  82.159  16.751  -4.233
  712    HE2  LYS  88           HE2      LYS  88  80.225  15.513  -5.428
  713    HE3  LYS  88           HE3      LYS  88  79.642  15.140  -3.806
  714    HZ1  LYS  88           HZ1      LYS  88  78.920  17.208  -3.540
  715    HZ2  LYS  88           HZ2      LYS  88  79.183  17.444  -5.201
  716    HZ3  LYS  88           HZ3      LYS  88  80.380  17.883  -4.078
  717    H    THR  89           H        THR  89  82.092  13.854  -8.353
  718    HA   THR  89           HA       THR  89  79.871  12.321  -7.595
  719    HB   THR  89           HB       THR  89  79.347  12.240 -10.029
  720    HG1  THR  89           HG1      THR  89  81.040  13.780 -11.102
  721   HG21  THR  89          HG21      THR  89  80.261  14.870  -8.840
  722   HG22  THR  89          HG22      THR  89  78.640  14.176  -8.779
  723   HG23  THR  89          HG23      THR  89  79.299  14.748 -10.313
  724    H    GLU  90           H        GLU  90  82.971  11.382  -8.857
  725    HA   GLU  90           HA       GLU  90  82.219   8.784  -9.776
  726    HB2  GLU  90           HB2      GLU  90  84.847  10.035  -8.983
  727    HB3  GLU  90           HB3      GLU  90  84.733   8.330  -9.414
  728    HG2  GLU  90           HG2      GLU  90  84.027   8.817 -11.616
  729    HG3  GLU  90           HG3      GLU  90  83.617  10.481 -11.209
  730    H    ARG  91           H        ARG  91  83.272  10.157  -6.720
  731    HA   ARG  91           HA       ARG  91  83.432   7.622  -5.347
  732    HB2  ARG  91           HB2      ARG  91  83.346  10.481  -4.334
  733    HB3  ARG  91           HB3      ARG  91  83.589   9.069  -3.307
  734    HG2  ARG  91           HG2      ARG  91  85.577   8.468  -4.718
  735    HG3  ARG  91           HG3      ARG  91  85.377  10.002  -5.563
  736    HD2  ARG  91           HD2      ARG  91  85.415  10.224  -2.614
  737    HD3  ARG  91           HD3      ARG  91  86.927   9.676  -3.330
  738    HE   ARG  91           HE       ARG  91  86.160  11.843  -4.854
  739   HH11  ARG  91          HH21      ARG  91  86.760  11.184  -1.509
  740   HH12  ARG  91          HH22      ARG  91  87.313  12.785  -1.151
  741   HH21  ARG  91          HH11      ARG  91  86.886  13.944  -4.390
  742   HH22  ARG  91          HH12      ARG  91  87.385  14.347  -2.781
  743    H    GLU  92           H        GLU  92  81.181  10.389  -5.313
  744    HA   GLU  92           HA       GLU  92  79.311   9.334  -3.520
  745    HB2  GLU  92           HB2      GLU  92  79.508  11.700  -4.690
  746    HB3  GLU  92           HB3      GLU  92  78.387  10.983  -5.847
  747    HG2  GLU  92           HG2      GLU  92  77.988  11.267  -2.856
  748    HG3  GLU  92           HG3      GLU  92  77.084  12.084  -4.131
  749    H    ASP  93           H        ASP  93  79.284   9.246  -7.094
  750    HA   ASP  93           HA       ASP  93  77.003   7.640  -7.387
  751    HB2  ASP  93           HB2      ASP  93  79.467   7.796  -9.143
  752    HB3  ASP  93           HB1      ASP  93  77.925   7.085  -9.618
  753    H    LEU  94           H        LEU  94  80.441   6.712  -7.325
  754    HA   LEU  94           HA       LEU  94  80.135   3.946  -7.508
  755    HB2  LEU  94           HB2      LEU  94  82.331   4.993  -7.664
  756    HB3  LEU  94           HB3      LEU  94  82.202   5.559  -6.000
  757    HG   LEU  94           HG       LEU  94  82.214   3.288  -5.158
  758   HD11  LEU  94          HD11      LEU  94  81.054   1.998  -6.722
  759   HD12  LEU  94          HD12      LEU  94  82.719   1.474  -6.972
  760   HD13  LEU  94          HD13      LEU  94  81.984   2.632  -8.081
  761   HD21  LEU  94          HD21      LEU  94  84.472   2.868  -5.483
  762   HD22  LEU  94          HD22      LEU  94  84.383   4.537  -6.036
  763   HD23  LEU  94          HD23      LEU  94  84.403   3.220  -7.208
  764    H    ILE  95           H        ILE  95  79.900   6.109  -4.753
  765    HA   ILE  95           HA       ILE  95  79.714   4.000  -2.833
  766    HB   ILE  95           HB       ILE  95  79.336   6.976  -2.705
  767   HG12  ILE  95          HG12      ILE  95  81.216   5.246  -1.112
  768   HG13  ILE  95          HG13      ILE  95  81.578   5.627  -2.791
  769   HG21  ILE  95          HG21      ILE  95  77.781   6.407  -1.065
  770   HG22  ILE  95          HG22      ILE  95  79.268   6.376  -0.119
  771   HG23  ILE  95          HG23      ILE  95  78.567   4.870  -0.709
  772   HD11  ILE  95          HD11      ILE  95  80.821   7.859  -0.953
  773   HD12  ILE  95          HD12      ILE  95  81.876   7.876  -2.364
  774   HD13  ILE  95          HD13      ILE  95  82.447   7.190  -0.849
  775    H    ALA  96           H        ALA  96  77.486   5.813  -4.780
  776    HA   ALA  96           HA       ALA  96  75.120   5.274  -3.319
  777    HB1  ALA  96           HB1      ALA  96  75.437   6.935  -5.234
  778    HB2  ALA  96           HB2      ALA  96  73.951   5.985  -5.262
  779    HB3  ALA  96           HB3      ALA  96  75.294   5.553  -6.319
  780    H    TYR  97           H        TYR  97  76.961   3.494  -5.733
  781    HA   TYR  97           HA       TYR  97  75.003   1.398  -6.014
  782    HB2  TYR  97           HB2      TYR  97  76.441   1.727  -7.890
  783    HB3  TYR  97           HB3      TYR  97  77.886   1.662  -6.881
  784    HD1  TYR  97           HD1      TYR  97  75.064  -0.355  -8.227
  785    HD2  TYR  97           HD2      TYR  97  78.871  -0.425  -6.243
  786    HE1  TYR  97           HE1      TYR  97  75.175  -2.811  -8.531
  787    HE2  TYR  97           HE2      TYR  97  78.983  -2.883  -6.548
  788    HH   TYR  97           HH       TYR  97  76.447  -4.769  -7.208
  789    H    LEU  98           H        LEU  98  78.112   1.791  -4.321
  790    HA   LEU  98           HA       LEU  98  78.333  -0.766  -3.236
  791    HB2  LEU  98           HB2      LEU  98  79.247   1.944  -2.304
  792    HB3  LEU  98           HB3      LEU  98  79.539   0.518  -1.317
  793    HG   LEU  98           HG       LEU  98  80.282   0.471  -4.234
  794   HD11  LEU  98          HD11      LEU  98  82.454   1.385  -3.786
  795   HD12  LEU  98          HD12      LEU  98  82.120   1.485  -2.058
  796   HD13  LEU  98          HD13      LEU  98  81.276   2.544  -3.184
  797   HD21  LEU  98          HD21      LEU  98  80.327  -1.496  -2.468
  798   HD22  LEU  98          HD22      LEU  98  81.818  -0.715  -1.945
  799   HD23  LEU  98          HD23      LEU  98  81.665  -1.298  -3.600
  800    H    LYS  99           H        LYS  99  76.150   1.807  -2.481
  801    HA   LYS  99           HA       LYS  99  75.451   0.839   0.153
  802    HB2  LYS  99           HB2      LYS  99  74.394   2.981  -1.672
  803    HB3  LYS  99           HB3      LYS  99  73.475   2.487  -0.251
  804    HG2  LYS  99           HG2      LYS  99  75.426   2.958   1.184
  805    HG3  LYS  99           HG3      LYS  99  76.351   3.448  -0.235
  806    HD2  LYS  99           HD2      LYS  99  75.459   5.431   0.887
  807    HD3  LYS  99           HD3      LYS  99  74.685   5.235  -0.685
  808    HE2  LYS  99           HE2      LYS  99  72.651   4.595   0.243
  809    HE3  LYS  99           HE3      LYS  99  73.398   3.976   1.716
  810    HZ1  LYS  99           HZ1      LYS  99  73.448   6.852   1.042
  811    HZ2  LYS  99           HZ2      LYS  99  73.699   6.114   2.551
  812    HZ3  LYS  99           HZ3      LYS  99  72.142   6.160   1.871
  813    H    LYS 100           H        LYS 100  73.799   0.953  -3.007
  814    HA   LYS 100           HA       LYS 100  71.616  -0.683  -2.110
  815    HB2  LYS 100           HB2      LYS 100  72.499   0.064  -4.908
  816    HB3  LYS 100           HB3      LYS 100  70.964  -0.699  -4.491
  817    HG2  LYS 100           HG2      LYS 100  70.598   1.289  -2.901
  818    HG3  LYS 100           HG3      LYS 100  71.932   2.065  -3.755
  819    HD2  LYS 100           HD2      LYS 100  70.727   1.763  -5.896
  820    HD3  LYS 100           HD3      LYS 100  69.383   1.024  -5.025
  821    HE2  LYS 100           HE2      LYS 100  69.304   3.178  -3.636
  822    HE3  LYS 100           HE3      LYS 100  70.365   3.876  -4.859
  823    HZ1  LYS 100           HZ1      LYS 100  67.822   2.530  -5.550
  824    HZ2  LYS 100           HZ2      LYS 100  68.764   3.559  -6.522
  825    HZ3  LYS 100           HZ3      LYS 100  67.901   4.189  -5.200
  826    H    ALA 101           H        ALA 101  74.784  -1.310  -3.217
  827    HA   ALA 101           HA       ALA 101  74.211  -3.988  -4.199
  828    HB1  ALA 101           HB1      ALA 101  76.913  -2.745  -3.673
  829    HB2  ALA 101           HB2      ALA 101  76.007  -2.487  -5.164
  830    HB3  ALA 101           HB3      ALA 101  76.541  -4.110  -4.724
  831    H    THR 102           H        THR 102  75.444  -2.416  -1.316
  832    HA   THR 102           HA       THR 102  76.150  -4.981  -0.091
  833    HB   THR 102           HB       THR 102  76.889  -3.560   1.813
  834    HG1  THR 102           HG1      THR 102  75.620  -1.663   0.226
  835   HG21  THR 102          HG21      THR 102  77.869  -2.876  -0.964
  836   HG22  THR 102          HG22      THR 102  78.520  -4.087   0.136
  837   HG23  THR 102          HG23      THR 102  78.704  -2.371   0.505
  838    H    ASN 103           H        ASN 103  73.420  -3.183  -0.539
  839    HA   ASN 103           HA       ASN 103  72.223  -3.781   2.074
  840    HB2  ASN 103           HB2      ASN 103  71.398  -2.120  -0.296
  841    HB3  ASN 103           HB1      ASN 103  70.249  -2.548   0.963
  842   HD21  ASN 103          HD21      ASN 103  73.644  -2.043   1.747
  843   HD22  ASN 103          HD22      ASN 103  73.416  -0.583   2.579
  844    H    GLU 104           H        GLU 104  72.286  -4.883  -1.209
  845    HA   GLU 104           HA       GLU 104  70.610  -7.156  -0.503
  846    HB2  GLU 104           HB2      GLU 104  69.171  -6.806  -2.547
  847    HB3  GLU 104           HB3      GLU 104  68.886  -5.658  -1.238
  848    HG2  GLU 104           HG2      GLU 104  70.141  -3.947  -2.340
  849    HG3  GLU 104           HG3      GLU 104  70.788  -5.086  -3.519
  850    HHA  HEC 201           HA       HEC 105  89.255  -3.480   3.268
  851    HHB  HEC 201           HB       HEC 105  85.540   0.085  -0.407
  852    HHC  HEC 201           HC       HEC 105  88.823  -1.765  -5.489
  853    HHD  HEC 201           HD       HEC 105  92.093  -5.806  -1.886
  854   HMA1  HEC 201          HMA1      HEC 105  84.468  -0.564   2.186
  855   HMA2  HEC 201          HMA2      HEC 105  85.418   0.848   1.724
  856   HMA3  HEC 201          HMA3      HEC 105  85.546   0.198   3.354
  857   HAA1  HEC 201          HAA1      HEC 105  86.793  -0.916   4.542
  858   HAA2  HEC 201          HAA2      HEC 105  88.334  -1.748   4.514
  859   HBA1  HEC 201          HBA1      HEC 105  87.271  -3.888   4.452
  860   HBA2  HEC 201          HBA2      HEC 105  85.689  -3.163   4.182
  861   HMB1  HEC 201          HMB1      HEC 105  85.101   1.531  -2.201
  862   HMB2  HEC 201          HMB2      HEC 105  84.121   0.185  -2.775
  863   HMB3  HEC 201          HMB3      HEC 105  84.878   1.274  -3.929
  864    HAB  HEC 201           HAB      HEC 105  87.358  -0.535  -6.161
  865   HBB1  HEC 201          HBB1      HEC 105  88.006   1.674  -5.942
  866   HBB2  HEC 201          HBB2      HEC 105  86.336   1.904  -6.456
  867   HBB3  HEC 201          HBB3      HEC 105  86.762   2.036  -4.751
  868   HMC1  HEC 201          HMC1      HEC 105  91.334  -2.628  -6.578
  869   HMC2  HEC 201          HMC2      HEC 105  89.747  -3.352  -6.815
  870   HMC3  HEC 201          HMC3      HEC 105  91.186  -4.365  -6.828
  871    HAC  HEC 201           HAC      HEC 105  92.599  -6.199  -3.802
  872   HBC1  HEC 201          HBC1      HEC 105  93.634  -5.671  -6.272
  873   HBC2  HEC 201          HBC2      HEC 105  94.289  -5.010  -4.775
  874   HBC3  HEC 201          HBC3      HEC 105  93.186  -4.047  -5.754
  875   HMD1  HEC 201          HMD1      HEC 105  93.092  -6.630   1.640
  876   HMD2  HEC 201          HMD2      HEC 105  93.305  -6.352  -0.084
  877   HMD3  HEC 201          HMD3      HEC 105  92.126  -7.536   0.478
  878   HAD1  HEC 201          HAD1      HEC 105  91.706  -6.354   3.272
  879   HAD2  HEC 201          HAD2      HEC 105  90.234  -5.536   3.754
  880   HBD1  HEC 201          HBD1      HEC 105  91.585  -3.393   3.861
  881   HBD2  HEC 201          HBD2      HEC 105  93.025  -4.392   3.667
  882    H1   HOH 301           H2       HOH 200  80.856   2.158  -0.582
  883    H2   HOH 301           H1       HOH 200  81.700   3.286  -1.133
  884    H1   HOH 302           H2       HOH 201  86.898   4.960   5.722
  885    H2   HOH 302           H1       HOH 201  85.737   5.752   5.162
  886    H1   HOH 303           H2       HOH 202  82.922  -5.480   5.370
  887    H2   HOH 303           H1       HOH 202  81.923  -6.616   5.290
  888    H1   HOH 304           H2       HOH 203  81.464 -11.289   0.449
  889    H2   HOH 304           H1       HOH 203  82.211 -10.083  -0.075
  Start of MODEL   31
    1    H1   GLY   1           H1       GLY   1  75.627  10.928  -7.574
    2    H2   GLY   1           H2       GLY   1  74.956  11.551  -6.143
    3    H3   GLY   1           H3       GLY   1  73.974  11.306  -7.509
    4    HA2  GLY   1           HA2      GLY   1  75.402   9.074  -6.195
    5    HA3  GLY   1           HA3      GLY   1  73.801   9.594  -5.668
    6    H    ASP   2           H        ASP   2  75.536   8.875  -8.707
    7    HA   ASP   2           HA       ASP   2  73.047   7.877  -9.900
    8    HB2  ASP   2           HB2      ASP   2  75.790   8.455 -11.015
    9    HB3  ASP   2           HB1      ASP   2  74.521   7.667 -11.950
   10    H    VAL   3           H        VAL   3  72.876   5.985  -8.584
   11    HA   VAL   3           HA       VAL   3  74.724   4.009  -8.143
   12    HB   VAL   3           HB       VAL   3  72.526   3.846  -7.182
   13   HG11  VAL   3          HG11      VAL   3  71.578   3.620 -10.053
   14   HG12  VAL   3          HG12      VAL   3  71.230   4.930  -8.926
   15   HG13  VAL   3          HG13      VAL   3  70.555   3.324  -8.647
   16   HG21  VAL   3          HG21      VAL   3  72.603   1.581  -9.178
   17   HG22  VAL   3          HG22      VAL   3  72.130   1.537  -7.479
   18   HG23  VAL   3          HG23      VAL   3  73.826   1.722  -7.916
   19    H    GLU   4           H        GLU   4  73.403   5.014 -11.155
   20    HA   GLU   4           HA       GLU   4  73.808   2.563 -12.587
   21    HB2  GLU   4           HB2      GLU   4  73.436   5.428 -13.465
   22    HB3  GLU   4           HB3      GLU   4  73.659   4.103 -14.607
   23    HG2  GLU   4           HG2      GLU   4  71.534   4.055 -12.456
   24    HG3  GLU   4           HG3      GLU   4  71.238   4.706 -14.068
   25    H    LYS   5           H        LYS   5  75.584   5.668 -12.667
   26    HA   LYS   5           HA       LYS   5  77.807   4.528 -14.066
   27    HB2  LYS   5           HB2      LYS   5  77.511   7.128 -12.539
   28    HB3  LYS   5           HB3      LYS   5  78.929   6.694 -13.494
   29    HG2  LYS   5           HG2      LYS   5  77.471   6.436 -15.496
   30    HG3  LYS   5           HG3      LYS   5  76.091   6.965 -14.533
   31    HD2  LYS   5           HD2      LYS   5  78.552   8.689 -14.625
   32    HD3  LYS   5           HD3      LYS   5  77.436   8.714 -15.989
   33    HE2  LYS   5           HE2      LYS   5  76.327   8.985 -13.213
   34    HE3  LYS   5           HE3      LYS   5  77.094  10.382 -13.967
   35    HZ1  LYS   5           HZ1      LYS   5  74.561   9.188 -14.520
   36    HZ2  LYS   5           HZ2      LYS   5  75.505   9.343 -15.925
   37    HZ3  LYS   5           HZ3      LYS   5  75.159  10.708 -14.974
   38    H    GLY   6           H        GLY   6  76.808   4.651 -10.795
   39    HA2  GLY   6           HA2      GLY   6  79.379   4.396  -9.564
   40    HA3  GLY   6           HA3      GLY   6  77.824   4.013  -8.819
   41    H    LYS   7           H        LYS   7  76.989   2.238 -10.928
   42    HA   LYS   7           HA       LYS   7  78.114  -0.205  -9.977
   43    HB2  LYS   7           HB2      LYS   7  75.759   0.106 -10.848
   44    HB3  LYS   7           HB3      LYS   7  76.447   0.201 -12.468
   45    HG2  LYS   7           HG2      LYS   7  77.652  -2.068 -11.624
   46    HG3  LYS   7           HG3      LYS   7  76.183  -2.150 -10.653
   47    HD2  LYS   7           HD2      LYS   7  75.495  -3.234 -12.599
   48    HD3  LYS   7           HD3      LYS   7  74.991  -1.578 -12.938
   49    HE2  LYS   7           HE2      LYS   7  77.325  -1.292 -14.013
   50    HE3  LYS   7           HE3      LYS   7  77.408  -3.053 -13.984
   51    HZ1  LYS   7           HZ1      LYS   7  74.977  -1.832 -15.047
   52    HZ2  LYS   7           HZ2      LYS   7  75.777  -3.254 -15.523
   53    HZ3  LYS   7           HZ3      LYS   7  76.374  -1.737 -16.004
   54    H    LYS   8           H        LYS   8  78.411   1.676 -12.982
   55    HA   LYS   8           HA       LYS   8  80.039  -0.123 -14.402
   56    HB2  LYS   8           HB2      LYS   8  78.993   1.774 -15.494
   57    HB3  LYS   8           HB3      LYS   8  79.921   2.899 -14.505
   58    HG2  LYS   8           HG2      LYS   8  81.556   0.907 -15.967
   59    HG3  LYS   8           HG3      LYS   8  80.688   2.040 -16.999
   60    HD2  LYS   8           HD2      LYS   8  82.223   3.069 -14.621
   61    HD3  LYS   8           HD3      LYS   8  83.074   2.681 -16.115
   62    HE2  LYS   8           HE2      LYS   8  80.718   4.576 -15.888
   63    HE3  LYS   8           HE3      LYS   8  82.403   5.060 -16.064
   64    HZ1  LYS   8           HZ1      LYS   8  81.696   5.084 -18.225
   65    HZ2  LYS   8           HZ2      LYS   8  80.619   3.786 -18.017
   66    HZ3  LYS   8           HZ3      LYS   8  82.291   3.499 -18.121
   67    H    ILE   9           H        ILE   9  80.933   2.606 -12.306
   68    HA   ILE   9           HA       ILE   9  83.731   2.286 -12.555
   69    HB   ILE   9           HB       ILE   9  82.115   3.498 -10.299
   70   HG12  ILE   9          HG12      ILE   9  83.515   4.947 -12.552
   71   HG13  ILE   9          HG13      ILE   9  81.851   4.388 -12.719
   72   HG21  ILE   9          HG21      ILE   9  84.214   4.743  -9.837
   73   HG22  ILE   9          HG22      ILE   9  85.029   3.802 -11.085
   74   HG23  ILE   9          HG23      ILE   9  84.428   3.005  -9.631
   75   HD11  ILE   9          HD11      ILE   9  82.884   6.234 -10.545
   76   HD12  ILE   9          HD12      ILE   9  81.224   5.656 -10.689
   77   HD13  ILE   9          HD13      ILE   9  81.899   6.717 -11.926
   78    H    PHE  10           H        PHE  10  81.328   0.682 -10.624
   79    HA   PHE  10           HA       PHE  10  83.172  -0.367  -8.679
   80    HB2  PHE  10           HB2      PHE  10  81.040  -0.230  -7.797
   81    HB3  PHE  10           HB1      PHE  10  80.270  -0.724  -9.303
   82    HD1  PHE  10           HD1      PHE  10  80.189  -3.096  -9.963
   83    HD2  PHE  10           HD2      PHE  10  81.901  -1.866  -6.226
   84    HE1  PHE  10           HE1      PHE  10  80.130  -5.442  -9.170
   85    HE2  PHE  10           HE2      PHE  10  81.844  -4.215  -5.428
   86    HZ   PHE  10           HZ       PHE  10  80.958  -6.003  -6.905
   87    H    VAL  11           H        VAL  11  81.350  -1.859 -11.373
   88    HA   VAL  11           HA       VAL  11  82.311  -4.445 -11.122
   89    HB   VAL  11           HB       VAL  11  81.855  -4.677 -13.560
   90   HG11  VAL  11          HG11      VAL  11  80.085  -4.681 -11.701
   91   HG12  VAL  11          HG12      VAL  11  79.510  -4.389 -13.341
   92   HG13  VAL  11          HG13      VAL  11  79.700  -3.042 -12.222
   93   HG21  VAL  11          HG21      VAL  11  81.224  -1.723 -13.371
   94   HG22  VAL  11          HG22      VAL  11  81.047  -2.740 -14.799
   95   HG23  VAL  11          HG23      VAL  11  82.653  -2.381 -14.165
   96    H    GLN  12           H        GLN  12  83.856  -1.627 -12.488
   97    HA   GLN  12           HA       GLN  12  86.073  -3.275 -13.481
   98    HB2  GLN  12           HB2      GLN  12  86.894  -1.181 -14.493
   99    HB3  GLN  12           HB1      GLN  12  85.254  -1.584 -14.994
  100    HG2  GLN  12           HG2      GLN  12  84.653  -0.059 -12.858
  101    HG3  GLN  12           HG1      GLN  12  86.216   0.646 -13.258
  102   HE21  GLN  12          HE21      GLN  12  83.648  -0.653 -15.420
  103   HE22  GLN  12          HE22      GLN  12  83.472   0.784 -16.299
  104    H    LYS  13           H        LYS  13  85.355  -1.164 -10.787
  105    HA   LYS  13           HA       LYS  13  88.228  -0.953 -10.168
  106    HB2  LYS  13           HB2      LYS  13  85.831   0.494  -9.062
  107    HB3  LYS  13           HB3      LYS  13  87.450   0.651  -8.393
  108    HG2  LYS  13           HG2      LYS  13  87.366   0.951 -11.322
  109    HG3  LYS  13           HG3      LYS  13  86.449   2.184 -10.461
  110    HD2  LYS  13           HD2      LYS  13  89.308   1.439  -9.789
  111    HD3  LYS  13           HD3      LYS  13  88.867   2.781 -10.844
  112    HE2  LYS  13           HE2      LYS  13  87.303   2.986  -8.448
  113    HE3  LYS  13           HE3      LYS  13  88.992   2.767  -7.990
  114    HZ1  LYS  13           HZ1      LYS  13  89.367   4.516  -9.864
  115    HZ2  LYS  13           HZ2      LYS  13  88.907   5.012  -8.305
  116    HZ3  LYS  13           HZ3      LYS  13  87.750   4.921  -9.546
  117    H    CYS  14           H        CYS  14  85.299  -1.480  -8.161
  118    HA   CYS  14           HA       CYS  14  86.938  -2.794  -6.171
  119    HB2  CYS  14           HB2      CYS  14  83.972  -2.654  -5.966
  120    HB3  CYS  14           HB1      CYS  14  85.188  -2.484  -4.707
  121    H    ALA  15           H        ALA  15  84.448  -3.880  -8.455
  122    HA   ALA  15           HA       ALA  15  83.855  -6.353  -7.407
  123    HB1  ALA  15           HB1      ALA  15  83.812  -7.099  -9.903
  124    HB2  ALA  15           HB2      ALA  15  84.187  -5.409 -10.235
  125    HB3  ALA  15           HB3      ALA  15  82.710  -5.830  -9.371
  126    H    GLN  16           H        GLN  16  86.854  -5.282  -8.800
  127    HA   GLN  16           HA       GLN  16  88.113  -7.593  -9.566
  128    HB2  GLN  16           HB2      GLN  16  88.992  -5.004  -8.454
  129    HB3  GLN  16           HB1      GLN  16  90.159  -6.315  -8.294
  130    HG2  GLN  16           HG2      GLN  16  89.965  -6.774 -10.716
  131    HG3  GLN  16           HG1      GLN  16  88.815  -5.447 -10.872
  132   HE21  GLN  16          HE21      GLN  16  89.892  -3.705 -11.815
  133   HE22  GLN  16          HE22      GLN  16  91.453  -3.188 -11.394
  134    H    CYS  17           H        CYS  17  88.579  -6.243  -6.268
  135    HA   CYS  17           HA       CYS  17  88.897  -9.034  -5.317
  136    HB2  CYS  17           HB2      CYS  17  90.044  -6.883  -3.651
  137    HB3  CYS  17           HB1      CYS  17  90.726  -8.440  -4.113
  138    H    HIS  18           H        HSD  18  86.301  -8.019  -5.391
  139    HA   HIS  18           HA       HSD  18  85.670  -8.095  -2.549
  140    HB2  HIS  18           HB2      HSD  18  85.070  -5.696  -4.268
  141    HB3  HIS  18           HB1      HSD  18  84.086  -6.087  -2.862
  142    HD1  HIS  18           HD1      HSD  18  86.620  -7.193  -1.177
  143    HD2  HIS  18           HD2      HSD  18  86.283  -3.464  -3.002
  144    HE1  HIS  18           HE1      HSD  18  88.228  -5.653   0.032
  145    H    THR  19           H        THR  19  83.088  -7.748  -2.416
  146    HA   THR  19           HA       THR  19  81.825  -9.243  -4.627
  147    HB   THR  19           HB       THR  19  80.660 -10.143  -2.195
  148    HG1  THR  19           HG1      THR  19  82.903 -11.190  -1.664
  149   HG21  THR  19          HG21      THR  19  82.517 -11.455  -4.197
  150   HG22  THR  19          HG22      THR  19  80.753 -11.462  -4.230
  151   HG23  THR  19          HG23      THR  19  81.615 -12.329  -2.960
  152    H    VAL  20           H        VAL  20  81.454  -7.259  -1.738
  153    HA   VAL  20           HA       VAL  20  79.719  -5.947  -0.985
  154    HB   VAL  20           HB       VAL  20  79.056  -4.237  -2.560
  155   HG11  VAL  20          HG11      VAL  20  81.385  -4.228  -1.680
  156   HG12  VAL  20          HG12      VAL  20  81.271  -3.493  -3.279
  157   HG13  VAL  20          HG13      VAL  20  81.903  -5.129  -3.104
  158   HG21  VAL  20          HG21      VAL  20  80.377  -5.864  -4.734
  159   HG22  VAL  20          HG22      VAL  20  79.406  -4.407  -4.911
  160   HG23  VAL  20          HG23      VAL  20  78.640  -5.921  -4.444
  161    H    GLU  21           H        GLU  21  78.877  -8.651  -1.658
  162    HA   GLU  21           HA       GLU  21  76.035  -8.055  -2.194
  163    HB2  GLU  21           HB2      GLU  21  75.781  -9.926  -3.631
  164    HB3  GLU  21           HB3      GLU  21  77.219  -9.083  -4.202
  165    HG2  GLU  21           HG2      GLU  21  78.479 -10.711  -2.564
  166    HG3  GLU  21           HG3      GLU  21  77.016 -11.682  -2.711
  167    H    LYS  22           H        LYS  22  75.027  -8.441  -0.349
  168    HA   LYS  22           HA       LYS  22  75.936  -9.907   1.816
  169    HB2  LYS  22           HB2      LYS  22  73.817  -8.330   1.443
  170    HB3  LYS  22           HB3      LYS  22  72.996  -9.882   1.284
  171    HG2  LYS  22           HG2      LYS  22  74.739  -9.052   3.627
  172    HG3  LYS  22           HG3      LYS  22  72.976  -9.088   3.627
  173    HD2  LYS  22           HD2      LYS  22  73.327 -11.593   2.856
  174    HD3  LYS  22           HD3      LYS  22  74.917 -11.378   3.589
  175    HE2  LYS  22           HE2      LYS  22  73.382 -12.266   5.261
  176    HE3  LYS  22           HE3      LYS  22  73.806 -10.609   5.686
  177    HZ1  LYS  22           HZ1      LYS  22  71.750  -9.830   5.089
  178    HZ2  LYS  22           HZ2      LYS  22  71.338 -11.362   5.697
  179    HZ3  LYS  22           HZ3      LYS  22  71.439 -11.109   4.019
  180    H    GLY  23           H        GLY  23  76.183 -12.006   2.221
  181    HA2  GLY  23           HA2      GLY  23  75.713 -14.286   2.228
  182    HA3  GLY  23           HA3      GLY  23  74.411 -13.999   1.077
  183    H    GLY  24           H        GLY  24  77.513 -12.647   0.389
  184    HA2  GLY  24           HA2      GLY  24  77.790 -14.451  -1.908
  185    HA3  GLY  24           HA3      GLY  24  78.651 -12.934  -1.660
  186    H    LYS  25           H        LYS  25  80.708 -13.681  -1.913
  187    HA   LYS  25           HA       LYS  25  81.813 -15.190   0.319
  188    HB2  LYS  25           HB2      LYS  25  82.916 -16.847  -1.068
  189    HB3  LYS  25           HB3      LYS  25  81.178 -16.923  -1.355
  190    HG2  LYS  25           HG2      LYS  25  81.659 -15.253  -3.300
  191    HG3  LYS  25           HG3      LYS  25  83.332 -15.782  -3.127
  192    HD2  LYS  25           HD2      LYS  25  82.582 -17.332  -4.680
  193    HD3  LYS  25           HD3      LYS  25  82.227 -18.198  -3.187
  194    HE2  LYS  25           HE2      LYS  25  79.907 -17.171  -3.264
  195    HE3  LYS  25           HE3      LYS  25  80.300 -16.591  -4.883
  196    HZ1  LYS  25           HZ1      LYS  25  79.401 -19.122  -4.142
  197    HZ2  LYS  25           HZ2      LYS  25  81.001 -19.303  -4.686
  198    HZ3  LYS  25           HZ3      LYS  25  79.836 -18.582  -5.690
  199    H    HIS  26           H        HIS  26  83.557 -14.121   0.954
  200    HA   HIS  26           HA       HIS  26  84.670 -11.934  -0.343
  201    HB2  HIS  26           HB2      HIS  26  86.727 -12.556   1.174
  202    HB3  HIS  26           HB1      HIS  26  85.209 -12.044   1.910
  203    HD1  HIS  26           HD1      HIS  26  86.520 -15.403   0.628
  204    HD2  HIS  26           HD2      HIS  26  84.599 -13.782   3.954
  205    HE1  HIS  26           HE1      HIS  26  86.118 -17.323   2.230
  206    HE2  HIS  26           HE2      HIS  26  84.949 -16.351   4.263
  207    H    LYS  27           H        LYS  27  85.839 -11.749  -2.103
  208    HA   LYS  27           HA       LYS  27  87.477 -14.047  -3.008
  209    HB2  LYS  27           HB2      LYS  27  85.983 -11.925  -4.556
  210    HB3  LYS  27           HB3      LYS  27  87.244 -12.916  -5.290
  211    HG2  LYS  27           HG2      LYS  27  85.953 -14.953  -4.461
  212    HG3  LYS  27           HG3      LYS  27  84.634 -13.847  -4.077
  213    HD2  LYS  27           HD2      LYS  27  84.596 -13.082  -6.428
  214    HD3  LYS  27           HD3      LYS  27  85.895 -14.213  -6.809
  215    HE2  LYS  27           HE2      LYS  27  84.518 -16.103  -6.397
  216    HE3  LYS  27           HE3      LYS  27  83.301 -15.134  -5.566
  217    HZ1  LYS  27           HZ1      LYS  27  83.943 -14.482  -8.349
  218    HZ2  LYS  27           HZ2      LYS  27  82.475 -14.321  -7.510
  219    HZ3  LYS  27           HZ3      LYS  27  82.988 -15.850  -8.047
  220    H    THR  28           H        THR  28  89.410 -13.512  -2.046
  221    HA   THR  28           HA       THR  28  91.418 -12.434  -1.770
  222    HB   THR  28           HB       THR  28  90.664 -10.846  -4.231
  223    HG1  THR  28           HG1      THR  28  90.760 -12.642  -5.272
  224   HG21  THR  28          HG21      THR  28  92.680  -9.962  -3.483
  225   HG22  THR  28          HG22      THR  28  93.259 -11.273  -4.509
  226   HG23  THR  28          HG23      THR  28  93.202 -11.484  -2.761
  227    H    GLY  29           H        GLY  29  88.893 -11.369  -0.643
  228    HA2  GLY  29           HA2      GLY  29  89.842  -9.134   0.700
  229    HA3  GLY  29           HA3      GLY  29  88.933  -8.524  -0.680
  230    HA   PRO  30           HA       PRO  30  86.160 -10.034   2.958
  231    HB2  PRO  30           HB2      PRO  30  85.743  -7.654   4.265
  232    HB3  PRO  30           HB1      PRO  30  87.010  -8.811   4.713
  233    HG2  PRO  30           HG2      PRO  30  87.217  -6.307   3.110
  234    HG3  PRO  30           HG1      PRO  30  88.321  -6.958   4.334
  235    HD2  PRO  30           HD2      PRO  30  88.806  -7.191   1.661
  236    HD3  PRO  30           HD1      PRO  30  89.346  -8.406   2.840
  237    H    ASN  31           H        ASN  31  83.892  -9.200   3.392
  238    HA   ASN  31           HA       ASN  31  82.799  -8.056   0.905
  239    HB2  ASN  31           HB2      ASN  31  80.682  -8.999   1.602
  240    HB3  ASN  31           HB1      ASN  31  81.923 -10.245   1.720
  241   HD21  ASN  31          HD21      ASN  31  82.256 -11.199   3.764
  242   HD22  ASN  31          HD22      ASN  31  81.503 -10.669   5.189
  243    H    LEU  32           H        LEU  32  81.983  -6.081   0.846
  244    HA   LEU  32           HA       LEU  32  82.026  -4.418   3.207
  245    HB2  LEU  32           HB2      LEU  32  80.905  -3.620   0.527
  246    HB3  LEU  32           HB3      LEU  32  81.646  -2.598   1.757
  247    HG   LEU  32           HG       LEU  32  83.013  -4.608  -0.048
  248   HD11  LEU  32          HD11      LEU  32  83.170  -1.616   0.375
  249   HD12  LEU  32          HD12      LEU  32  82.812  -2.491  -1.113
  250   HD13  LEU  32          HD13      LEU  32  84.445  -2.510  -0.453
  251   HD21  LEU  32          HD21      LEU  32  84.045  -4.969   2.067
  252   HD22  LEU  32          HD22      LEU  32  83.981  -3.256   2.476
  253   HD23  LEU  32          HD23      LEU  32  85.099  -3.825   1.238
  254    H    HIS  33           H        HIS  33  80.137  -6.616   3.276
  255    HA   HIS  33           HA       HIS  33  77.492  -5.833   2.719
  256    HB2  HIS  33           HB2      HIS  33  78.535  -7.634   4.922
  257    HB3  HIS  33           HB1      HIS  33  76.849  -7.518   4.422
  258    HD1  HIS  33           HD1      HIS  33  78.442 -10.180   4.158
  259    HD2  HIS  33           HD2      HIS  33  77.995  -7.406   1.078
  260    HE1  HIS  33           HE1      HIS  33  78.780 -11.451   1.995
  261    HE2  HIS  33           HE2      HIS  33  78.511  -9.777   0.107
  262    H    GLY  34           H        GLY  34  75.975  -4.676   3.870
  263    HA2  GLY  34           HA2      GLY  34  75.397  -2.819   5.172
  264    HA3  GLY  34           HA3      GLY  34  75.717  -3.990   6.450
  265    H    LEU  35           H        LEU  35  78.188  -2.805   4.301
  266    HA   LEU  35           HA       LEU  35  80.115  -2.223   6.154
  267    HB2  LEU  35           HB2      LEU  35  80.553  -2.267   3.768
  268    HB3  LEU  35           HB3      LEU  35  79.543  -0.848   3.521
  269    HG   LEU  35           HG       LEU  35  81.255   0.185   5.327
  270   HD11  LEU  35          HD11      LEU  35  83.028  -1.684   3.763
  271   HD12  LEU  35          HD12      LEU  35  82.428  -2.108   5.364
  272   HD13  LEU  35          HD13      LEU  35  83.451  -0.688   5.153
  273   HD21  LEU  35          HD21      LEU  35  82.034  -0.137   2.421
  274   HD22  LEU  35          HD22      LEU  35  82.410   1.217   3.487
  275   HD23  LEU  35          HD23      LEU  35  80.749   0.943   2.962
  276    H    PHE  36           H        PHE  36  77.951   0.196   4.687
  277    HA   PHE  36           HA       PHE  36  78.726   2.392   6.185
  278    HB2  PHE  36           HB2      PHE  36  75.890   1.851   5.289
  279    HB3  PHE  36           HB1      PHE  36  76.655   3.419   5.539
  280    HD1  PHE  36           HD2      PHE  36  76.695   0.357   3.418
  281    HD2  PHE  36           HD1      PHE  36  78.017   4.427   3.843
  282    HE1  PHE  36           HE2      PHE  36  77.510   0.342   1.077
  283    HE2  PHE  36           HE1      PHE  36  78.821   4.408   1.508
  284    HZ   PHE  36           HZ       PHE  36  78.570   2.368   0.119
  285    H    GLY  37           H        GLY  37  79.089   1.896   8.371
  286    HA2  GLY  37           HA2      GLY  37  77.555   2.574  10.347
  287    HA3  GLY  37           HA3      GLY  37  76.738   1.072   9.952
  288    H    ARG  38           H        ARG  38  79.361  -0.238   9.259
  289    HA   ARG  38           HA       ARG  38  79.996  -1.037  11.993
  290    HB2  ARG  38           HB2      ARG  38  80.347  -2.184   9.293
  291    HB3  ARG  38           HB3      ARG  38  81.650  -2.534  10.427
  292    HG2  ARG  38           HG2      ARG  38  79.811  -3.222  12.087
  293    HG3  ARG  38           HG3      ARG  38  78.712  -3.192  10.708
  294    HD2  ARG  38           HD2      ARG  38  81.285  -4.702  10.439
  295    HD3  ARG  38           HD3      ARG  38  79.996  -5.420  11.393
  296    HE   ARG  38           HE       ARG  38  78.570  -5.032   9.307
  297   HH11  ARG  38          HH21      ARG  38  82.010  -5.569   9.211
  298   HH12  ARG  38          HH22      ARG  38  81.981  -6.256   7.623
  299   HH21  ARG  38          HH11      ARG  38  78.556  -5.949   7.245
  300   HH22  ARG  38          HH12      ARG  38  80.037  -6.478   6.519
  301    H    LYS  39           H        LYS  39  82.020  -0.984  12.943
  302    HA   LYS  39           HA       LYS  39  83.635   1.283  12.362
  303    HB2  LYS  39           HB2      LYS  39  83.853  -1.032  14.262
  304    HB3  LYS  39           HB3      LYS  39  85.191   0.102  14.081
  305    HG2  LYS  39           HG2      LYS  39  82.440   1.221  14.486
  306    HG3  LYS  39           HG3      LYS  39  83.267   0.524  15.877
  307    HD2  LYS  39           HD2      LYS  39  85.194   2.003  15.505
  308    HD3  LYS  39           HD3      LYS  39  84.413   2.679  14.076
  309    HE2  LYS  39           HE2      LYS  39  82.455   3.274  15.645
  310    HE3  LYS  39           HE3      LYS  39  83.582   2.956  16.964
  311    HZ1  LYS  39           HZ1      LYS  39  84.600   4.879  16.609
  312    HZ2  LYS  39           HZ2      LYS  39  83.330   5.293  15.561
  313    HZ3  LYS  39           HZ3      LYS  39  84.750   4.592  14.945
  314    H    THR  40           H        THR  40  86.076   1.079  12.135
  315    HA   THR  40           HA       THR  40  86.678  -0.237   9.703
  316    HB   THR  40           HB       THR  40  89.074   0.404  10.327
  317    HG1  THR  40           HG1      THR  40  87.772   1.871  12.350
  318   HG21  THR  40          HG21      THR  40  87.764   1.824   8.883
  319   HG22  THR  40          HG22      THR  40  88.553   2.855  10.076
  320   HG23  THR  40          HG23      THR  40  86.847   2.450  10.253
  321    H    GLY  41           H        GLY  41  87.988  -2.002   9.258
  322    HA2  GLY  41           HA2      GLY  41  88.584  -4.209   9.554
  323    HA3  GLY  41           HA3      GLY  41  89.506  -3.563  10.909
  324    H    GLN  42           H        GLN  42  86.022  -3.987  10.318
  325    HA   GLN  42           HA       GLN  42  85.860  -5.449  12.890
  326    HB2  GLN  42           HB2      GLN  42  84.670  -3.266  12.851
  327    HB3  GLN  42           HB1      GLN  42  83.684  -3.859  11.513
  328    HG2  GLN  42           HG2      GLN  42  82.644  -5.506  12.851
  329    HG3  GLN  42           HG1      GLN  42  83.883  -5.400  14.099
  330   HE21  GLN  42          HE21      GLN  42  81.786  -2.945  12.469
  331   HE22  GLN  42          HE22      GLN  42  81.235  -2.255  13.918
  332    H    ALA  43           H        ALA  43  85.624  -5.780   9.548
  333    HA   ALA  43           HA       ALA  43  83.475  -7.665   9.434
  334    HB1  ALA  43           HB1      ALA  43  85.432  -6.515   7.582
  335    HB2  ALA  43           HB2      ALA  43  83.755  -6.975   7.304
  336    HB3  ALA  43           HB3      ALA  43  85.026  -8.193   7.223
  337    HA   PRO  44           HA       PRO  44  86.075 -10.973  11.055
  338    HB2  PRO  44           HB2      PRO  44  84.126 -12.817  11.403
  339    HB3  PRO  44           HB1      PRO  44  84.286 -11.408  12.473
  340    HG2  PRO  44           HG2      PRO  44  82.403 -11.855  10.205
  341    HG3  PRO  44           HG1      PRO  44  82.109 -11.111  11.785
  342    HD2  PRO  44           HD2      PRO  44  82.540  -9.676   9.464
  343    HD3  PRO  44           HD1      PRO  44  82.856  -9.046  11.097
  344    H    GLY  45           H        GLY  45  87.371 -12.019   9.640
  345    HA2  GLY  45           HA2      GLY  45  86.875 -14.268   8.241
  346    HA3  GLY  45           HA3      GLY  45  86.352 -13.020   7.113
  347    H    PHE  46           H        PHE  46  87.959 -11.295   6.621
  348    HA   PHE  46           HA       PHE  46  90.495 -12.499   5.972
  349    HB2  PHE  46           HB2      PHE  46  89.055 -10.718   4.651
  350    HB3  PHE  46           HB1      PHE  46  89.964  -9.569   5.632
  351    HD1  PHE  46           HD2      PHE  46  92.476  -9.571   5.550
  352    HD2  PHE  46           HD1      PHE  46  90.089 -11.920   2.859
  353    HE1  PHE  46           HE2      PHE  46  94.431  -9.840   4.048
  354    HE2  PHE  46           HE1      PHE  46  92.045 -12.189   1.359
  355    HZ   PHE  46           HZ       PHE  46  94.217 -11.149   1.953
  356    H    THR  47           H        THR  47  92.565 -11.680   6.594
  357    HA   THR  47           HA       THR  47  92.702 -10.972   9.380
  358    HB   THR  47           HB       THR  47  94.950 -11.119   7.364
  359    HG1  THR  47           HG1      THR  47  95.140 -13.264   8.292
  360   HG21  THR  47          HG21      THR  47  94.809 -11.217  10.385
  361   HG22  THR  47          HG22      THR  47  95.650 -10.029   9.387
  362   HG23  THR  47          HG23      THR  47  96.239 -11.690   9.467
  363    H    TYR  48           H        TYR  48  91.610  -8.915   9.320
  364    HA   TYR  48           HA       TYR  48  92.442  -6.703   7.796
  365    HB2  TYR  48           HB2      TYR  48  90.872  -7.097  10.302
  366    HB3  TYR  48           HB3      TYR  48  91.454  -5.471   9.957
  367    HD1  TYR  48           HD1      TYR  48  90.783  -4.306   7.886
  368    HD2  TYR  48           HD2      TYR  48  89.155  -8.132   8.951
  369    HE1  TYR  48           HE1      TYR  48  88.951  -3.976   6.253
  370    HE2  TYR  48           HE2      TYR  48  87.321  -7.804   7.315
  371    HH   TYR  48           HH       TYR  48  86.658  -4.785   5.902
  372    H    THR  49           H        THR  49  93.676  -4.857   8.413
  373    HA   THR  49           HA       THR  49  96.080  -5.563   9.874
  374    HB   THR  49           HB       THR  49  96.886  -3.357   9.156
  375    HG1  THR  49           HG1      THR  49  94.297  -3.077   8.039
  376   HG21  THR  49          HG21      THR  49  95.914  -5.453   7.395
  377   HG22  THR  49          HG22      THR  49  97.388  -4.493   7.270
  378   HG23  THR  49          HG23      THR  49  95.881  -3.888   6.585
  379    H    ASP  50           H        ASP  50  96.973  -4.170  11.566
  380    HA   ASP  50           HA       ASP  50  95.234  -3.829  13.736
  381    HB2  ASP  50           HB2      ASP  50  97.814  -2.308  13.400
  382    HB3  ASP  50           HB1      ASP  50  97.071  -2.882  14.892
  383    H    ALA  51           H        ALA  51  96.521  -1.453  11.431
  384    HA   ALA  51           HA       ALA  51  95.503   0.876  12.563
  385    HB1  ALA  51           HB1      ALA  51  95.609   0.322   9.596
  386    HB2  ALA  51           HB2      ALA  51  97.039   0.687  10.562
  387    HB3  ALA  51           HB3      ALA  51  95.750   1.881  10.409
  388    H    ASN  52           H        ASN  52  93.931  -1.484  10.450
  389    HA   ASN  52           HA       ASN  52  91.463   0.032  10.325
  390    HB2  ASN  52           HB2      ASN  52  92.567  -2.421   9.114
  391    HB3  ASN  52           HB1      ASN  52  90.841  -2.499   9.448
  392   HD21  ASN  52          HD21      ASN  52  90.345  -2.398   7.135
  393   HD22  ASN  52          HD22      ASN  52  90.503  -0.941   6.277
  394    H    LYS  53           H        LYS  53  92.842  -2.508  12.256
  395    HA   LYS  53           HA       LYS  53  90.310  -3.234  13.484
  396    HB2  LYS  53           HB2      LYS  53  91.554  -5.138  13.569
  397    HB3  LYS  53           HB3      LYS  53  93.072  -4.261  13.446
  398    HG2  LYS  53           HG2      LYS  53  92.964  -3.688  15.834
  399    HG3  LYS  53           HG3      LYS  53  91.402  -4.500  15.967
  400    HD2  LYS  53           HD2      LYS  53  92.619  -6.588  15.068
  401    HD3  LYS  53           HD3      LYS  53  94.110  -5.722  15.436
  402    HE2  LYS  53           HE2      LYS  53  93.380  -5.458  17.780
  403    HE3  LYS  53           HE3      LYS  53  91.894  -6.334  17.413
  404    HZ1  LYS  53           HZ1      LYS  53  93.079  -8.114  18.021
  405    HZ2  LYS  53           HZ2      LYS  53  94.574  -7.332  17.818
  406    HZ3  LYS  53           HZ3      LYS  53  93.773  -8.006  16.478
  407    H    ASN  54           H        ASN  54  92.581  -0.799  13.778
  408    HA   ASN  54           HA       ASN  54  92.687  -0.416  16.583
  409    HB2  ASN  54           HB2      ASN  54  93.758   1.568  16.089
  410    HB3  ASN  54           HB1      ASN  54  94.044   0.673  14.602
  411   HD21  ASN  54          HD21      ASN  54  91.389   0.954  13.472
  412   HD22  ASN  54          HD22      ASN  54  91.164   2.591  13.089
  413    H    LYS  55           H        LYS  55  90.270   0.067  14.237
  414    HA   LYS  55           HA       LYS  55  88.142   0.960  14.314
  415    HB2  LYS  55           HB2      LYS  55  88.534   0.569  17.290
  416    HB3  LYS  55           HB3      LYS  55  86.989   0.828  16.481
  417    HG2  LYS  55           HG2      LYS  55  86.949  -1.292  15.563
  418    HG3  LYS  55           HG3      LYS  55  88.707  -1.400  15.467
  419    HD2  LYS  55           HD2      LYS  55  87.855  -2.935  17.183
  420    HD3  LYS  55           HD3      LYS  55  88.816  -1.659  17.929
  421    HE2  LYS  55           HE2      LYS  55  86.784  -0.435  18.528
  422    HE3  LYS  55           HE3      LYS  55  85.791  -1.638  17.706
  423    HZ1  LYS  55           HZ1      LYS  55  87.553  -2.880  19.546
  424    HZ2  LYS  55           HZ2      LYS  55  85.856  -2.936  19.482
  425    HZ3  LYS  55           HZ3      LYS  55  86.636  -1.688  20.331
  426    H    GLY  56           H        GLY  56  89.588   2.951  13.705
  427    HA2  GLY  56           HA2      GLY  56  89.610   5.035  15.746
  428    HA3  GLY  56           HA3      GLY  56  90.254   5.165  14.112
  429    H    ILE  57           H        ILE  57  87.979   4.326  12.675
  430    HA   ILE  57           HA       ILE  57  85.888   6.267  13.420
  431    HB   ILE  57           HB       ILE  57  85.790   7.153  11.166
  432   HG12  ILE  57          HG12      ILE  57  87.931   6.447   9.720
  433   HG13  ILE  57          HG13      ILE  57  87.783   4.964  10.660
  434   HG21  ILE  57          HG21      ILE  57  88.632   7.143  12.223
  435   HG22  ILE  57          HG22      ILE  57  87.340   8.210  12.772
  436   HG23  ILE  57          HG23      ILE  57  87.946   8.337  11.121
  437   HD11  ILE  57          HD11      ILE  57  86.500   5.224   8.363
  438   HD12  ILE  57          HD12      ILE  57  85.326   6.092   9.346
  439   HD13  ILE  57          HD13      ILE  57  85.724   4.416   9.719
  440    H    THR  58           H        THR  58  84.067   6.006  11.587
  441    HA   THR  58           HA       THR  58  83.600   3.099  11.286
  442    HB   THR  58           HB       THR  58  81.630   5.281  11.986
  443    HG1  THR  58           HG1      THR  58  82.425   2.918  13.336
  444   HG21  THR  58          HG21      THR  58  80.503   3.805  10.480
  445   HG22  THR  58          HG22      THR  58  80.028   3.304  12.103
  446   HG23  THR  58          HG23      THR  58  81.244   2.386  11.217
  447    H    TRP  59           H        TRP  59  82.791   2.365   9.375
  448    HA   TRP  59           HA       TRP  59  83.171   3.934   7.053
  449    HB2  TRP  59           HB2      TRP  59  81.399   1.496   7.191
  450    HB3  TRP  59           HB1      TRP  59  82.335   2.093   5.820
  451    HD1  TRP  59           HD1      TRP  59  85.109   2.549   7.193
  452    HE1  TRP  59           HE1      TRP  59  86.523   0.522   7.952
  453    HE3  TRP  59           HE3      TRP  59  81.465  -1.008   7.565
  454    HZ2  TRP  59           HZ2      TRP  59  86.146  -2.215   8.663
  455    HZ3  TRP  59           HZ3      TRP  59  82.023  -3.314   8.277
  456    HH2  TRP  59           HH2      TRP  59  84.358  -3.919   8.826
  457    H    LYS  60           H        LYS  60  81.803   5.139   5.854
  458    HA   LYS  60           HA       LYS  60  78.934   5.073   6.273
  459    HB2  LYS  60           HB2      LYS  60  80.602   7.474   7.058
  460    HB3  LYS  60           HB3      LYS  60  78.865   7.551   6.769
  461    HG2  LYS  60           HG2      LYS  60  78.650   5.651   8.480
  462    HG3  LYS  60           HG3      LYS  60  80.325   5.995   8.910
  463    HD2  LYS  60           HD2      LYS  60  78.201   8.148   8.866
  464    HD3  LYS  60           HD3      LYS  60  78.536   7.183  10.303
  465    HE2  LYS  60           HE2      LYS  60  80.955   7.872  10.107
  466    HE3  LYS  60           HE3      LYS  60  80.474   8.981   8.822
  467    HZ1  LYS  60           HZ1      LYS  60  79.955  10.434  10.390
  468    HZ2  LYS  60           HZ2      LYS  60  80.263   9.307  11.623
  469    HZ3  LYS  60           HZ3      LYS  60  78.720   9.400  10.918
  470    H    GLU  61           H        GLU  61  78.346   7.535   5.039
  471    HA   GLU  61           HA       GLU  61  78.930   6.854   2.307
  472    HB2  GLU  61           HB2      GLU  61  76.759   7.865   3.173
  473    HB3  GLU  61           HB3      GLU  61  77.629   9.395   3.287
  474    HG2  GLU  61           HG2      GLU  61  78.291   9.030   0.840
  475    HG3  GLU  61           HG3      GLU  61  77.075   7.754   0.812
  476    H    GLU  62           H        GLU  62  79.531   9.808   4.235
  477    HA   GLU  62           HA       GLU  62  81.324  10.913   2.311
  478    HB2  GLU  62           HB2      GLU  62  80.964  11.590   5.240
  479    HB3  GLU  62           HB3      GLU  62  81.822  12.576   4.055
  480    HG2  GLU  62           HG2      GLU  62  79.777  12.852   2.750
  481    HG3  GLU  62           HG3      GLU  62  78.904  11.782   3.847
  482    H    THR  63           H        THR  63  81.773   9.085   5.310
  483    HA   THR  63           HA       THR  63  84.548   9.343   5.557
  484    HB   THR  63           HB       THR  63  84.459   7.244   6.829
  485    HG1  THR  63           HG1      THR  63  82.783   6.456   5.202
  486   HG21  THR  63          HG21      THR  63  82.198   9.202   7.210
  487   HG22  THR  63          HG22      THR  63  83.739   9.134   8.066
  488   HG23  THR  63          HG23      THR  63  82.514   7.899   8.354
  489    H    LEU  64           H        LEU  64  82.574   7.203   3.579
  490    HA   LEU  64           HA       LEU  64  84.716   5.577   2.657
  491    HB2  LEU  64           HB2      LEU  64  81.870   5.879   2.080
  492    HB3  LEU  64           HB3      LEU  64  82.810   5.539   0.635
  493    HG   LEU  64           HG       LEU  64  83.107   3.921   3.175
  494   HD11  LEU  64          HD11      LEU  64  80.998   3.192   2.736
  495   HD12  LEU  64          HD12      LEU  64  81.755   2.300   1.417
  496   HD13  LEU  64          HD13      LEU  64  80.999   3.860   1.106
  497   HD21  LEU  64          HD21      LEU  64  84.020   3.668   0.306
  498   HD22  LEU  64          HD22      LEU  64  83.860   2.237   1.322
  499   HD23  LEU  64          HD23      LEU  64  84.971   3.523   1.784
  500    H    MET  65           H        MET  65  83.283   8.609   1.553
  501    HA   MET  65           HA       MET  65  84.437   8.760  -0.989
  502    HB2  MET  65           HB2      MET  65  83.906  11.005   0.969
  503    HB3  MET  65           HB1      MET  65  84.257  11.219  -0.744
  504    HG2  MET  65           HG2      MET  65  82.269   9.996  -1.371
  505    HG3  MET  65           HG1      MET  65  81.957   9.560   0.308
  506    HE1  MET  65           HE1      MET  65  81.985  12.271  -2.406
  507    HE2  MET  65           HE2      MET  65  80.487  13.077  -1.947
  508    HE3  MET  65           HE3      MET  65  80.488  11.341  -2.251
  509    H    GLU  66           H        GLU  66  85.716  10.163   2.042
  510    HA   GLU  66           HA       GLU  66  88.189  10.966   0.963
  511    HB2  GLU  66           HB2      GLU  66  87.468  10.178   3.799
  512    HB3  GLU  66           HB3      GLU  66  88.973  10.970   3.333
  513    HG2  GLU  66           HG2      GLU  66  86.202  12.095   2.828
  514    HG3  GLU  66           HG3      GLU  66  87.263  12.589   4.146
  515    H    TYR  67           H        TYR  67  87.017   7.894   2.113
  516    HA   TYR  67           HA       TYR  67  89.619   6.641   2.225
  517    HB2  TYR  67           HB2      TYR  67  87.780   5.835   3.635
  518    HB3  TYR  67           HB3      TYR  67  86.835   5.458   2.198
  519    HD1  TYR  67           HD1      TYR  67  89.889   4.576   4.106
  520    HD2  TYR  67           HD2      TYR  67  87.238   3.481   0.906
  521    HE1  TYR  67           HE1      TYR  67  90.974   2.349   3.967
  522    HE2  TYR  67           HE2      TYR  67  88.327   1.256   0.767
  523    HH   TYR  67           HH       TYR  67  90.519   0.241   1.356
  524    H    LEU  68           H        LEU  68  87.135   7.164  -0.146
  525    HA   LEU  68           HA       LEU  68  88.079   5.143  -1.975
  526    HB2  LEU  68           HB2      LEU  68  85.886   7.138  -1.894
  527    HB3  LEU  68           HB3      LEU  68  86.475   6.715  -3.498
  528    HG   LEU  68           HG       LEU  68  85.674   4.666  -1.414
  529   HD11  LEU  68          HD11      LEU  68  84.090   6.063  -3.563
  530   HD12  LEU  68          HD12      LEU  68  83.640   5.710  -1.896
  531   HD13  LEU  68          HD13      LEU  68  83.682   4.413  -3.087
  532   HD21  LEU  68          HD21      LEU  68  86.603   4.584  -4.258
  533   HD22  LEU  68          HD22      LEU  68  85.401   3.408  -3.742
  534   HD23  LEU  68          HD23      LEU  68  86.959   3.487  -2.928
  535    H    GLU  69           H        GLU  69  88.849   8.447  -1.304
  536    HA   GLU  69           HA       GLU  69  90.222   8.739  -3.897
  537    HB2  GLU  69           HB2      GLU  69  90.344  11.067  -3.455
  538    HB3  GLU  69           HB3      GLU  69  88.729  10.575  -2.959
  539    HG2  GLU  69           HG2      GLU  69  89.273  11.703  -1.044
  540    HG3  GLU  69           HG3      GLU  69  90.048  10.179  -0.631
  541    H    ASN  70           H        ASN  70  90.810   7.649  -0.827
  542    HA   ASN  70           HA       ASN  70  93.606   7.386  -1.238
  543    HB2  ASN  70           HB2      ASN  70  94.447   8.824   0.531
  544    HB3  ASN  70           HB1      ASN  70  93.574   9.792  -0.651
  545   HD21  ASN  70          HD21      ASN  70  93.416   8.484   2.652
  546   HD22  ASN  70          HD22      ASN  70  92.128   9.468   3.155
  547    HA   PRO  71           HA       PRO  71  91.289   4.466   1.610
  548    HB2  PRO  71           HB2      PRO  71  93.085   2.608   0.125
  549    HB3  PRO  71           HB1      PRO  71  91.363   2.444   0.513
  550    HG2  PRO  71           HG2      PRO  71  92.207   3.040  -1.952
  551    HG3  PRO  71           HG1      PRO  71  90.698   3.691  -1.292
  552    HD2  PRO  71           HD2      PRO  71  93.313   5.068  -1.722
  553    HD3  PRO  71           HD1      PRO  71  91.663   5.730  -1.775
  554    H    LYS  72           H        LYS  72  94.723   4.662   0.729
  555    HA   LYS  72           HA       LYS  72  95.601   3.357   3.150
  556    HB2  LYS  72           HB2      LYS  72  96.833   3.190   1.003
  557    HB3  LYS  72           HB3      LYS  72  97.205   4.909   1.112
  558    HG2  LYS  72           HG2      LYS  72  99.116   3.986   2.076
  559    HG3  LYS  72           HG3      LYS  72  98.125   4.261   3.505
  560    HD2  LYS  72           HD2      LYS  72  98.833   2.043   3.799
  561    HD3  LYS  72           HD3      LYS  72  97.244   1.838   3.068
  562    HE2  LYS  72           HE2      LYS  72  98.507   0.420   1.735
  563    HE3  LYS  72           HE3      LYS  72  98.628   1.913   0.807
  564    HZ1  LYS  72           HZ1      LYS  72 100.658   2.234   2.475
  565    HZ2  LYS  72           HZ2      LYS  72 100.815   1.463   0.969
  566    HZ3  LYS  72           HZ3      LYS  72 100.648   0.540   2.386
  567    H    LYS  73           H        LYS  73  95.761   6.695   1.886
  568    HA   LYS  73           HA       LYS  73  97.119   7.788   4.075
  569    HB2  LYS  73           HB2      LYS  73  96.437   8.802   1.722
  570    HB3  LYS  73           HB3      LYS  73  95.086   9.451   2.649
  571    HG2  LYS  73           HG2      LYS  73  96.647  10.479   4.243
  572    HG3  LYS  73           HG3      LYS  73  98.013   9.796   3.362
  573    HD2  LYS  73           HD2      LYS  73  97.705  12.120   2.685
  574    HD3  LYS  73           HD3      LYS  73  97.299  11.060   1.336
  575    HE2  LYS  73           HE2      LYS  73  95.017  11.480   1.516
  576    HE3  LYS  73           HE3      LYS  73  95.121  11.897   3.226
  577    HZ1  LYS  73           HZ1      LYS  73  94.947  13.685   1.243
  578    HZ2  LYS  73           HZ2      LYS  73  96.632  13.615   1.459
  579    HZ3  LYS  73           HZ3      LYS  73  95.621  14.014   2.764
  580    H    TYR  74           H        TYR  74  93.684   7.139   3.610
  581    HA   TYR  74           HA       TYR  74  92.758   8.669   5.814
  582    HB2  TYR  74           HB2      TYR  74  91.495   7.408   3.809
  583    HB3  TYR  74           HB3      TYR  74  91.303   6.178   5.058
  584    HD1  TYR  74           HD1      TYR  74  91.101   9.927   4.773
  585    HD2  TYR  74           HD2      TYR  74  89.370   6.326   6.355
  586    HE1  TYR  74           HE1      TYR  74  89.271  11.253   5.791
  587    HE2  TYR  74           HE2      TYR  74  87.542   7.654   7.374
  588    HH   TYR  74           HH       TYR  74  86.436   9.928   6.892
  589    H    ILE  75           H        ILE  75  93.275   5.147   5.513
  590    HA   ILE  75           HA       ILE  75  93.871   5.076   8.413
  591    HB   ILE  75           HB       ILE  75  92.381   2.923   6.895
  592   HG12  ILE  75          HG12      ILE  75  91.209   4.815   8.943
  593   HG13  ILE  75          HG13      ILE  75  91.168   5.182   7.220
  594   HG21  ILE  75          HG21      ILE  75  93.569   2.041   8.801
  595   HG22  ILE  75          HG22      ILE  75  91.875   2.194   9.270
  596   HG23  ILE  75          HG23      ILE  75  93.053   3.388   9.815
  597   HD11  ILE  75          HD11      ILE  75  89.889   3.209   6.740
  598   HD12  ILE  75          HD12      ILE  75  89.109   3.995   8.112
  599   HD13  ILE  75          HD13      ILE  75  90.134   2.583   8.371
  600    HA   PRO  76           HA       PRO  76  97.444   3.602   5.690
  601    HB2  PRO  76           HB2      PRO  76  98.643   4.395   8.326
  602    HB3  PRO  76           HB1      PRO  76  99.284   4.621   6.686
  603    HG2  PRO  76           HG2      PRO  76  98.145   6.627   8.025
  604    HG3  PRO  76           HG1      PRO  76  97.955   6.449   6.272
  605    HD2  PRO  76           HD2      PRO  76  95.957   6.002   8.424
  606    HD3  PRO  76           HD1      PRO  76  95.700   6.387   6.709
  607    H    GLY  77           H        GLY  77  98.140   1.526   5.691
  608    HA2  GLY  77           HA2      GLY  77  99.081  -0.369   6.925
  609    HA3  GLY  77           HA3      GLY  77  97.898  -0.049   8.190
  610    H    THR  78           H        THR  78  95.728   0.491   6.319
  611    HA   THR  78           HA       THR  78  94.568  -2.035   6.122
  612    HB   THR  78           HB       THR  78  93.258   0.024   6.025
  613    HG1  THR  78           HG1      THR  78  92.567  -1.964   4.951
  614   HG21  THR  78          HG21      THR  78  94.958   1.283   4.682
  615   HG22  THR  78          HG22      THR  78  93.308   1.457   4.081
  616   HG23  THR  78          HG23      THR  78  94.436   0.376   3.263
  617    H    LYS  79           H        LYS  79  94.546  -3.622   4.593
  618    HA   LYS  79           HA       LYS  79  96.619  -3.516   2.563
  619    HB2  LYS  79           HB2      LYS  79  94.619  -5.674   3.270
  620    HB3  LYS  79           HB3      LYS  79  95.924  -5.854   2.098
  621    HG2  LYS  79           HG2      LYS  79  97.414  -4.997   4.131
  622    HG3  LYS  79           HG3      LYS  79  96.072  -5.629   5.083
  623    HD2  LYS  79           HD2      LYS  79  96.296  -7.783   3.747
  624    HD3  LYS  79           HD3      LYS  79  97.812  -7.133   3.120
  625    HE2  LYS  79           HE2      LYS  79  98.721  -6.949   5.370
  626    HE3  LYS  79           HE3      LYS  79  97.181  -7.449   6.068
  627    HZ1  LYS  79           HZ1      LYS  79  97.758  -9.417   4.284
  628    HZ2  LYS  79           HZ2      LYS  79  97.997  -9.500   5.964
  629    HZ3  LYS  79           HZ3      LYS  79  99.276  -9.044   4.942
  630    H    MET  80           H        MET  80  95.921  -1.980   1.058
  631    HA   MET  80           HA       MET  80  94.290  -2.964  -1.038
  632    HB2  MET  80           HB2      MET  80  92.436  -2.431   0.457
  633    HB3  MET  80           HB1      MET  80  93.050  -0.790   0.664
  634    HG2  MET  80           HG2      MET  80  92.610  -0.222  -1.602
  635    HG3  MET  80           HG1      MET  80  92.392  -1.909  -2.064
  636    HE1  MET  80           HE1      MET  80  90.569   0.338  -2.883
  637    HE2  MET  80           HE2      MET  80  90.586   1.297  -1.405
  638    HE3  MET  80           HE3      MET  80  89.072   0.601  -1.978
  639    H    ILE  81           H        ILE  81  95.966  -2.345  -2.353
  640    HA   ILE  81           HA       ILE  81  96.289   0.567  -2.755
  641    HB   ILE  81           HB       ILE  81  98.455  -1.551  -2.839
  642   HG12  ILE  81          HG12      ILE  81  99.464   0.123  -1.150
  643   HG13  ILE  81          HG13      ILE  81  97.842   0.801  -1.040
  644   HG21  ILE  81          HG21      ILE  81  98.906  -0.067  -4.645
  645   HG22  ILE  81          HG22      ILE  81  99.897   0.520  -3.309
  646   HG23  ILE  81          HG23      ILE  81  98.390   1.341  -3.717
  647   HD11  ILE  81          HD11      ILE  81  97.706  -2.081  -0.807
  648   HD12  ILE  81          HD12      ILE  81  97.199  -0.848   0.344
  649   HD13  ILE  81          HD13      ILE  81  98.859  -1.434   0.359
  650    H    PHE  82           H        PHE  82  94.983   0.722  -4.540
  651    HA   PHE  82           HA       PHE  82  95.897  -0.741  -6.939
  652    HB2  PHE  82           HB2      PHE  82  93.878  -1.866  -6.164
  653    HB3  PHE  82           HB1      PHE  82  93.021  -0.328  -6.087
  654    HD1  PHE  82           HD1      PHE  82  95.024  -2.387  -8.501
  655    HD2  PHE  82           HD2      PHE  82  91.749   0.336  -7.936
  656    HE1  PHE  82           HE1      PHE  82  94.428  -2.605 -10.898
  657    HE2  PHE  82           HE2      PHE  82  91.154   0.117 -10.333
  658    HZ   PHE  82           HZ       PHE  82  92.493  -1.353 -11.814
  659    H    ALA  83           H        ALA  83  93.286   1.595  -6.304
  660    HA   ALA  83           HA       ALA  83  94.659   3.840  -7.378
  661    HB1  ALA  83           HB1      ALA  83  92.819   2.322  -9.234
  662    HB2  ALA  83           HB2      ALA  83  94.503   2.770  -9.512
  663    HB3  ALA  83           HB3      ALA  83  93.252   4.014  -9.479
  664    H    GLY  84           H        GLY  84  93.742   5.418  -6.248
  665    HA2  GLY  84           HA2      GLY  84  91.138   5.197  -5.086
  666    HA3  GLY  84           HA3      GLY  84  92.175   6.621  -5.052
  667    H    ILE  85           H        ILE  85  89.726   7.344  -5.320
  668    HA   ILE  85           HA       ILE  85  88.922   7.414  -8.141
  669    HB   ILE  85           HB       ILE  85  87.600   8.406  -5.610
  670   HG12  ILE  85          HG12      ILE  85  87.800   5.858  -6.337
  671   HG13  ILE  85          HG13      ILE  85  86.283   6.488  -5.707
  672   HG21  ILE  85          HG21      ILE  85  85.600   8.630  -7.233
  673   HG22  ILE  85          HG22      ILE  85  86.812   8.633  -8.513
  674   HG23  ILE  85          HG23      ILE  85  86.831   9.892  -7.279
  675   HD11  ILE  85          HD11      ILE  85  86.853   6.546  -8.665
  676   HD12  ILE  85          HD12      ILE  85  85.297   6.607  -7.840
  677   HD13  ILE  85          HD13      ILE  85  86.205   5.097  -7.895
  678    H    LYS  86           H        LYS  86  88.372   9.483  -9.155
  679    HA   LYS  86           HA       LYS  86  90.284  11.581  -8.353
  680    HB2  LYS  86           HB2      LYS  86  89.155  10.664 -10.957
  681    HB3  LYS  86           HB3      LYS  86  89.571  12.371 -10.800
  682    HG2  LYS  86           HG2      LYS  86  91.849  11.717 -10.035
  683    HG3  LYS  86           HG3      LYS  86  91.425  10.024 -10.292
  684    HD2  LYS  86           HD2      LYS  86  91.274  10.283 -12.629
  685    HD3  LYS  86           HD3      LYS  86  91.119  12.037 -12.516
  686    HE2  LYS  86           HE2      LYS  86  93.466  12.136 -11.642
  687    HE3  LYS  86           HE3      LYS  86  93.605  10.402 -11.933
  688    HZ1  LYS  86           HZ1      LYS  86  94.317  11.062 -13.938
  689    HZ2  LYS  86           HZ2      LYS  86  93.610  12.602 -13.812
  690    HZ3  LYS  86           HZ3      LYS  86  92.669  11.268 -14.284
  691    H    LYS  87           H        LYS  87  87.144  11.605 -10.079
  692    HA   LYS  87           HA       LYS  87  86.542  14.217  -9.004
  693    HB2  LYS  87           HB2      LYS  87  84.652  12.435 -10.532
  694    HB3  LYS  87           HB3      LYS  87  84.649  14.195 -10.428
  695    HG2  LYS  87           HG2      LYS  87  86.920  14.174 -11.539
  696    HG3  LYS  87           HG3      LYS  87  86.695  12.447 -11.817
  697    HD2  LYS  87           HD2      LYS  87  84.473  13.074 -12.936
  698    HD3  LYS  87           HD3      LYS  87  85.060  14.737 -12.920
  699    HE2  LYS  87           HE2      LYS  87  86.256  12.355 -14.342
  700    HE3  LYS  87           HE3      LYS  87  85.709  13.878 -15.041
  701    HZ1  LYS  87           HZ1      LYS  87  88.085  13.415 -13.333
  702    HZ2  LYS  87           HZ2      LYS  87  87.479  14.967 -13.666
  703    HZ3  LYS  87           HZ3      LYS  87  88.047  13.984 -14.930
  704    H    LYS  88           H        LYS  88  84.472  14.706  -7.958
  705    HA   LYS  88           HA       LYS  88  84.102  13.094  -5.626
  706    HB2  LYS  88           HB2      LYS  88  83.825  15.572  -5.661
  707    HB3  LYS  88           HB3      LYS  88  82.377  15.363  -6.646
  708    HG2  LYS  88           HG2      LYS  88  81.381  13.960  -4.849
  709    HG3  LYS  88           HG3      LYS  88  82.809  14.249  -3.857
  710    HD2  LYS  88           HD2      LYS  88  81.983  16.235  -3.165
  711    HD3  LYS  88           HD3      LYS  88  81.796  16.777  -4.832
  712    HE2  LYS  88           HE2      LYS  88  79.633  15.556  -4.960
  713    HE3  LYS  88           HE3      LYS  88  79.813  15.099  -3.266
  714    HZ1  LYS  88           HZ1      LYS  88  79.025  17.058  -2.654
  715    HZ2  LYS  88           HZ2      LYS  88  78.740  17.446  -4.284
  716    HZ3  LYS  88           HZ3      LYS  88  80.212  17.873  -3.550
  717    H    THR  89           H        THR  89  81.947  13.901  -8.368
  718    HA   THR  89           HA       THR  89  79.777  12.331  -7.668
  719    HB   THR  89           HB       THR  89  79.303  12.175 -10.110
  720    HG1  THR  89           HG1      THR  89  81.937  13.134 -10.159
  721   HG21  THR  89          HG21      THR  89  78.606  14.152  -8.859
  722   HG22  THR  89          HG22      THR  89  79.165  14.640 -10.459
  723   HG23  THR  89          HG23      THR  89  80.206  14.869  -9.053
  724    H    GLU  90           H        GLU  90  82.894  11.364  -8.866
  725    HA   GLU  90           HA       GLU  90  82.164   8.746  -9.726
  726    HB2  GLU  90           HB2      GLU  90  84.779   9.999  -8.890
  727    HB3  GLU  90           HB3      GLU  90  84.661   8.298  -9.335
  728    HG2  GLU  90           HG2      GLU  90  83.973   8.815 -11.546
  729    HG3  GLU  90           HG3      GLU  90  83.609  10.487 -11.127
  730    H    ARG  91           H        ARG  91  83.243  10.153  -6.679
  731    HA   ARG  91           HA       ARG  91  83.326   7.641  -5.275
  732    HB2  ARG  91           HB2      ARG  91  83.310  10.505  -4.278
  733    HB3  ARG  91           HB3      ARG  91  83.587   9.089  -3.268
  734    HG2  ARG  91           HG2      ARG  91  85.469   8.491  -4.907
  735    HG3  ARG  91           HG3      ARG  91  85.305  10.134  -5.519
  736    HD2  ARG  91           HD2      ARG  91  85.443  10.090  -2.602
  737    HD3  ARG  91           HD3      ARG  91  86.850   9.329  -3.330
  738    HE   ARG  91           HE       ARG  91  87.470  11.399  -4.221
  739   HH11  ARG  91          HH21      ARG  91  84.280  11.492  -2.862
  740   HH12  ARG  91          HH22      ARG  91  84.165  13.218  -2.916
  741   HH21  ARG  91          HH11      ARG  91  87.313  13.660  -4.294
  742   HH22  ARG  91          HH12      ARG  91  85.875  14.443  -3.728
  743    H    GLU  92           H        GLU  92  81.101  10.428  -5.361
  744    HA   GLU  92           HA       GLU  92  79.226   9.449  -3.508
  745    HB2  GLU  92           HB2      GLU  92  79.321  11.787  -4.451
  746    HB3  GLU  92           HB3      GLU  92  78.612  11.151  -5.935
  747    HG2  GLU  92           HG2      GLU  92  76.677  10.309  -4.627
  748    HG3  GLU  92           HG3      GLU  92  77.376  11.014  -3.170
  749    H    ASP  93           H        ASP  93  79.204   9.283  -7.077
  750    HA   ASP  93           HA       ASP  93  76.910   7.681  -7.330
  751    HB2  ASP  93           HB2      ASP  93  79.349   7.820  -9.122
  752    HB3  ASP  93           HB1      ASP  93  77.795   7.121  -9.570
  753    H    LEU  94           H        LEU  94  80.352   6.776  -7.218
  754    HA   LEU  94           HA       LEU  94  80.036   4.001  -7.416
  755    HB2  LEU  94           HB2      LEU  94  82.229   5.059  -7.598
  756    HB3  LEU  94           HB3      LEU  94  82.125   5.592  -5.922
  757    HG   LEU  94           HG       LEU  94  82.107   3.288  -5.139
  758   HD11  LEU  94          HD11      LEU  94  81.897   2.740  -8.086
  759   HD12  LEU  94          HD12      LEU  94  80.984   2.032  -6.754
  760   HD13  LEU  94          HD13      LEU  94  82.656   1.549  -7.031
  761   HD21  LEU  94          HD21      LEU  94  84.285   4.464  -5.674
  762   HD22  LEU  94          HD22      LEU  94  84.295   3.600  -7.211
  763   HD23  LEU  94          HD23      LEU  94  84.372   2.705  -5.696
  764    H    ILE  95           H        ILE  95  79.916   6.159  -4.639
  765    HA   ILE  95           HA       ILE  95  79.707   4.043  -2.735
  766    HB   ILE  95           HB       ILE  95  79.426   7.023  -2.617
  767   HG12  ILE  95          HG12      ILE  95  81.102   5.433  -0.743
  768   HG13  ILE  95          HG13      ILE  95  81.563   5.336  -2.435
  769   HG21  ILE  95          HG21      ILE  95  78.466   4.997  -0.615
  770   HG22  ILE  95          HG22      ILE  95  77.736   6.533  -1.075
  771   HG23  ILE  95          HG23      ILE  95  79.164   6.511  -0.040
  772   HD11  ILE  95          HD11      ILE  95  82.393   7.305  -0.741
  773   HD12  ILE  95          HD12      ILE  95  80.986   8.073  -1.470
  774   HD13  ILE  95          HD13      ILE  95  82.297   7.483  -2.489
  775    H    ALA  96           H        ALA  96  77.493   5.857  -4.687
  776    HA   ALA  96           HA       ALA  96  75.119   5.313  -3.222
  777    HB1  ALA  96           HB1      ALA  96  73.945   5.954  -5.231
  778    HB2  ALA  96           HB2      ALA  96  75.387   5.693  -6.212
  779    HB3  ALA  96           HB3      ALA  96  75.337   7.022  -5.054
  780    H    TYR  97           H        TYR  97  76.977   3.581  -5.653
  781    HA   TYR  97           HA       TYR  97  75.035   1.481  -5.983
  782    HB2  TYR  97           HB2      TYR  97  76.506   1.877  -7.834
  783    HB3  TYR  97           HB3      TYR  97  77.933   1.741  -6.806
  784    HD1  TYR  97           HD1      TYR  97  75.052  -0.164  -8.202
  785    HD2  TYR  97           HD2      TYR  97  78.889  -0.382  -6.286
  786    HE1  TYR  97           HE1      TYR  97  75.103  -2.611  -8.586
  787    HE2  TYR  97           HE2      TYR  97  78.940  -2.831  -6.673
  788    HH   TYR  97           HH       TYR  97  77.933  -4.559  -7.650
  789    H    LEU  98           H        LEU  98  78.103   1.883  -4.224
  790    HA   LEU  98           HA       LEU  98  78.328  -0.706  -3.203
  791    HB2  LEU  98           HB2      LEU  98  79.262   1.987  -2.260
  792    HB3  LEU  98           HB3      LEU  98  79.512   0.572  -1.244
  793    HG   LEU  98           HG       LEU  98  80.306   0.453  -4.147
  794   HD11  LEU  98          HD11      LEU  98  82.225   1.380  -2.020
  795   HD12  LEU  98          HD12      LEU  98  81.299   2.540  -2.969
  796   HD13  LEU  98          HD13      LEU  98  82.410   1.436  -3.771
  797   HD21  LEU  98          HD21      LEU  98  81.847  -1.207  -3.335
  798   HD22  LEU  98          HD22      LEU  98  80.294  -1.540  -2.570
  799   HD23  LEU  98          HD23      LEU  98  81.565  -0.725  -1.663
  800    H    LYS  99           H        LYS  99  76.156   1.863  -2.388
  801    HA   LYS  99           HA       LYS  99  75.447   0.822   0.216
  802    HB2  LYS  99           HB2      LYS  99  74.444   3.045  -1.539
  803    HB3  LYS  99           HB3      LYS  99  73.473   2.504  -0.170
  804    HG2  LYS  99           HG2      LYS  99  75.591   2.791   1.251
  805    HG3  LYS  99           HG3      LYS  99  76.269   3.657  -0.126
  806    HD2  LYS  99           HD2      LYS  99  73.626   4.384   1.163
  807    HD3  LYS  99           HD3      LYS  99  75.159   5.134   1.603
  808    HE2  LYS  99           HE2      LYS  99  75.445   5.694  -0.871
  809    HE3  LYS  99           HE3      LYS  99  73.759   5.220  -1.077
  810    HZ1  LYS  99           HZ1      LYS  99  74.853   7.429   0.555
  811    HZ2  LYS  99           HZ2      LYS  99  73.282   6.830   0.798
  812    HZ3  LYS  99           HZ3      LYS  99  73.714   7.511  -0.699
  813    H    LYS 100           H        LYS 100  73.840   1.013  -2.961
  814    HA   LYS 100           HA       LYS 100  71.617  -0.606  -2.122
  815    HB2  LYS 100           HB2      LYS 100  71.660   1.159  -3.989
  816    HB3  LYS 100           HB3      LYS 100  72.437  -0.078  -4.975
  817    HG2  LYS 100           HG2      LYS 100  70.445  -1.592  -4.204
  818    HG3  LYS 100           HG3      LYS 100  69.664  -0.064  -3.803
  819    HD2  LYS 100           HD2      LYS 100  68.968  -0.341  -6.007
  820    HD3  LYS 100           HD3      LYS 100  70.427   0.621  -6.239
  821    HE2  LYS 100           HE2      LYS 100  70.720  -1.129  -7.777
  822    HE3  LYS 100           HE3      LYS 100  71.635  -1.694  -6.380
  823    HZ1  LYS 100           HZ1      LYS 100  68.801  -2.370  -6.468
  824    HZ2  LYS 100           HZ2      LYS 100  70.120  -3.281  -5.905
  825    HZ3  LYS 100           HZ3      LYS 100  69.810  -3.171  -7.571
  826    H    ALA 101           H        ALA 101  74.785  -1.236  -3.264
  827    HA   ALA 101           HA       ALA 101  74.180  -3.892  -4.285
  828    HB1  ALA 101           HB1      ALA 101  76.546  -4.031  -4.774
  829    HB2  ALA 101           HB2      ALA 101  76.871  -2.599  -3.798
  830    HB3  ALA 101           HB3      ALA 101  75.954  -2.454  -5.298
  831    H    THR 102           H        THR 102  75.448  -2.388  -1.384
  832    HA   THR 102           HA       THR 102  76.190  -4.971  -0.225
  833    HB   THR 102           HB       THR 102  76.914  -3.595   1.711
  834    HG1  THR 102           HG1      THR 102  76.731  -1.378   1.566
  835   HG21  THR 102          HG21      THR 102  78.609  -2.189   0.334
  836   HG22  THR 102          HG22      THR 102  77.845  -2.926  -1.074
  837   HG23  THR 102          HG23      THR 102  78.627  -3.941   0.138
  838    H    ASN 103           H        ASN 103  73.448  -3.124  -0.584
  839    HA   ASN 103           HA       ASN 103  72.243  -3.792   1.992
  840    HB2  ASN 103           HB2      ASN 103  71.430  -2.170  -0.399
  841    HB3  ASN 103           HB1      ASN 103  70.219  -2.681   0.769
  842   HD21  ASN 103          HD21      ASN 103  73.492  -2.069   1.867
  843   HD22  ASN 103          HD22      ASN 103  73.145  -0.619   2.677
  844    H    GLU 104           H        GLU 104  72.375  -4.956  -1.264
  845    HA   GLU 104           HA       GLU 104  70.110  -6.306  -1.791
  846    HB2  GLU 104           HB2      GLU 104  72.929  -7.382  -1.977
  847    HB3  GLU 104           HB3      GLU 104  71.532  -8.164  -2.716
  848    HG2  GLU 104           HG2      GLU 104  72.148  -5.258  -3.241
  849    HG3  GLU 104           HG3      GLU 104  72.914  -6.536  -4.182
  850    HHA  HEC 201           HA       HEC 105  89.243  -3.383   3.262
  851    HHB  HEC 201           HB       HEC 105  85.514   0.129  -0.449
  852    HHC  HEC 201           HC       HEC 105  88.747  -1.839  -5.522
  853    HHD  HEC 201           HD       HEC 105  92.046  -5.803  -1.864
  854   HMA1  HEC 201          HMA1      HEC 105  85.747   1.009   2.395
  855   HMA2  HEC 201          HMA2      HEC 105  84.996  -0.349   3.233
  856   HMA3  HEC 201          HMA3      HEC 105  84.590  -0.020   1.552
  857   HAA1  HEC 201          HAA1      HEC 105  86.765  -0.810   4.501
  858   HAA2  HEC 201          HAA2      HEC 105  88.328  -1.601   4.480
  859   HBA1  HEC 201          HBA1      HEC 105  87.282  -3.782   4.407
  860   HBA2  HEC 201          HBA2      HEC 105  85.685  -3.051   4.278
  861   HMB1  HEC 201          HMB1      HEC 105  84.813   1.228  -4.004
  862   HMB2  HEC 201          HMB2      HEC 105  85.136   1.613  -2.317
  863   HMB3  HEC 201          HMB3      HEC 105  84.099   0.249  -2.728
  864    HAB  HEC 201           HAB      HEC 105  87.261  -0.639  -6.210
  865   HBB1  HEC 201          HBB1      HEC 105  86.242   1.797  -6.561
  866   HBB2  HEC 201          HBB2      HEC 105  86.718   1.978  -4.874
  867   HBB3  HEC 201          HBB3      HEC 105  87.923   1.569  -6.089
  868   HMC1  HEC 201          HMC1      HEC 105  89.668  -3.572  -6.838
  869   HMC2  HEC 201          HMC2      HEC 105  91.230  -4.384  -6.808
  870   HMC3  HEC 201          HMC3      HEC 105  91.142  -2.636  -6.603
  871    HAC  HEC 201           HAC      HEC 105  92.509  -6.256  -3.779
  872   HBC1  HEC 201          HBC1      HEC 105  93.578  -5.687  -6.247
  873   HBC2  HEC 201          HBC2      HEC 105  94.247  -5.125  -4.716
  874   HBC3  HEC 201          HBC3      HEC 105  93.185  -4.075  -5.651
  875   HMD1  HEC 201          HMD1      HEC 105  93.137  -6.481   1.650
  876   HMD2  HEC 201          HMD2      HEC 105  93.247  -6.326  -0.099
  877   HMD3  HEC 201          HMD3      HEC 105  92.124  -7.484   0.613
  878   HAD1  HEC 201          HAD1      HEC 105  91.728  -6.225   3.313
  879   HAD2  HEC 201          HAD2      HEC 105  90.256  -5.406   3.797
  880   HBD1  HEC 201          HBD1      HEC 105  91.461  -3.297   4.026
  881   HBD2  HEC 201          HBD2      HEC 105  92.943  -4.060   3.455
  882    H1   HOH 301           H2       HOH 200  81.124   2.803  -0.857
  883    H2   HOH 301           H1       HOH 200  82.540   2.518  -0.398
  884    H1   HOH 302           H2       HOH 201  86.028   6.741   5.604
  885    H2   HOH 302           H1       HOH 201  85.670   5.360   6.115
  886    H1   HOH 303           H2       HOH 202  83.718  -6.382   4.827
  887    H2   HOH 303           H1       HOH 202  82.478  -5.564   5.127
  888    H1   HOH 304           H2       HOH 203  83.438  -9.431  -0.447
  889    H2   HOH 304           H1       HOH 203  84.678  -9.939   0.258
  Start of MODEL   32
    1    H1   GLY   1           H1       GLY   1  72.972  11.774  -7.379
    2    H2   GLY   1           H2       GLY   1  74.428  12.029  -8.217
    3    H3   GLY   1           H3       GLY   1  74.386  12.156  -6.523
    4    HA2  GLY   1           HA2      GLY   1  75.398  10.067  -7.232
    5    HA3  GLY   1           HA3      GLY   1  73.917   9.811  -6.309
    6    H    ASP   2           H        ASP   2  75.389   8.368  -8.626
    7    HA   ASP   2           HA       ASP   2  72.938   7.811 -10.173
    8    HB2  ASP   2           HB2      ASP   2  75.695   8.295 -11.320
    9    HB3  ASP   2           HB1      ASP   2  74.341   7.617 -12.223
   10    H    VAL   3           H        VAL   3  72.761   5.951  -8.832
   11    HA   VAL   3           HA       VAL   3  74.614   4.007  -8.291
   12    HB   VAL   3           HB       VAL   3  72.385   3.838  -7.403
   13   HG11  VAL   3          HG11      VAL   3  71.567   3.617 -10.310
   14   HG12  VAL   3          HG12      VAL   3  71.099   4.866  -9.156
   15   HG13  VAL   3          HG13      VAL   3  70.489   3.221  -8.971
   16   HG21  VAL   3          HG21      VAL   3  72.611   1.549  -9.367
   17   HG22  VAL   3          HG22      VAL   3  71.971   1.515  -7.723
   18   HG23  VAL   3          HG23      VAL   3  73.702   1.710  -7.992
   19    H    GLU   4           H        GLU   4  73.378   4.937 -11.361
   20    HA   GLU   4           HA       GLU   4  73.882   2.461 -12.729
   21    HB2  GLU   4           HB2      GLU   4  73.566   5.276 -13.800
   22    HB3  GLU   4           HB3      GLU   4  73.574   3.808 -14.778
   23    HG2  GLU   4           HG2      GLU   4  71.615   2.971 -13.496
   24    HG3  GLU   4           HG3      GLU   4  71.584   4.484 -12.594
   25    H    LYS   5           H        LYS   5  75.540   5.630 -12.857
   26    HA   LYS   5           HA       LYS   5  77.824   4.527 -14.196
   27    HB2  LYS   5           HB2      LYS   5  77.306   7.183 -12.845
   28    HB3  LYS   5           HB3      LYS   5  78.846   6.786 -13.609
   29    HG2  LYS   5           HG2      LYS   5  77.749   6.427 -15.750
   30    HG3  LYS   5           HG3      LYS   5  76.162   6.661 -15.017
   31    HD2  LYS   5           HD2      LYS   5  78.204   8.839 -14.720
   32    HD3  LYS   5           HD3      LYS   5  77.384   8.661 -16.271
   33    HE2  LYS   5           HE2      LYS   5  75.848   8.764 -13.672
   34    HE3  LYS   5           HE3      LYS   5  76.285  10.229 -14.551
   35    HZ1  LYS   5           HZ1      LYS   5  74.108   8.628 -15.017
   36    HZ2  LYS   5           HZ2      LYS   5  75.180   8.258 -16.282
   37    HZ3  LYS   5           HZ3      LYS   5  74.686   9.864 -16.024
   38    H    GLY   6           H        GLY   6  76.791   4.722 -10.944
   39    HA2  GLY   6           HA2      GLY   6  79.373   4.627  -9.692
   40    HA3  GLY   6           HA3      GLY   6  77.828   4.229  -8.933
   41    H    LYS   7           H        LYS   7  77.010   2.339 -10.895
   42    HA   LYS   7           HA       LYS   7  78.207  -0.024  -9.871
   43    HB2  LYS   7           HB2      LYS   7  75.882   0.024 -10.656
   44    HB3  LYS   7           HB3      LYS   7  76.433   0.379 -12.293
   45    HG2  LYS   7           HG2      LYS   7  77.659  -1.758 -12.351
   46    HG3  LYS   7           HG3      LYS   7  77.122  -2.116 -10.711
   47    HD2  LYS   7           HD2      LYS   7  74.964  -2.591 -11.370
   48    HD3  LYS   7           HD3      LYS   7  75.008  -1.444 -12.710
   49    HE2  LYS   7           HE2      LYS   7  76.217  -2.935 -14.098
   50    HE3  LYS   7           HE3      LYS   7  76.674  -3.961 -12.739
   51    HZ1  LYS   7           HZ1      LYS   7  74.285  -4.480 -12.458
   52    HZ2  LYS   7           HZ2      LYS   7  74.923  -5.020 -13.937
   53    HZ3  LYS   7           HZ3      LYS   7  73.958  -3.623 -13.885
   54    H    LYS   8           H        LYS   8  78.459   1.723 -12.962
   55    HA   LYS   8           HA       LYS   8  80.112  -0.073 -14.325
   56    HB2  LYS   8           HB2      LYS   8  79.099   1.788 -15.476
   57    HB3  LYS   8           HB3      LYS   8  79.965   2.942 -14.466
   58    HG2  LYS   8           HG2      LYS   8  81.730   1.000 -15.818
   59    HG3  LYS   8           HG3      LYS   8  80.835   2.033 -16.930
   60    HD2  LYS   8           HD2      LYS   8  82.389   3.111 -14.562
   61    HD3  LYS   8           HD3      LYS   8  83.079   2.954 -16.175
   62    HE2  LYS   8           HE2      LYS   8  80.830   4.275 -16.833
   63    HE3  LYS   8           HE3      LYS   8  81.007   4.858 -15.178
   64    HZ1  LYS   8           HZ1      LYS   8  83.419   5.286 -15.844
   65    HZ2  LYS   8           HZ2      LYS   8  82.232   6.348 -16.436
   66    HZ3  LYS   8           HZ3      LYS   8  82.875   5.141 -17.444
   67    H    ILE   9           H        ILE   9  80.989   2.629 -12.184
   68    HA   ILE   9           HA       ILE   9  83.799   2.291 -12.453
   69    HB   ILE   9           HB       ILE   9  82.216   3.573 -10.218
   70   HG12  ILE   9          HG12      ILE   9  83.585   4.957 -12.531
   71   HG13  ILE   9          HG13      ILE   9  81.914   4.406 -12.656
   72   HG21  ILE   9          HG21      ILE   9  85.124   3.745 -11.056
   73   HG22  ILE   9          HG22      ILE   9  84.496   3.124  -9.531
   74   HG23  ILE   9          HG23      ILE   9  84.365   4.842  -9.903
   75   HD11  ILE   9          HD11      ILE   9  81.346   5.721 -10.630
   76   HD12  ILE   9          HD12      ILE   9  81.969   6.746 -11.923
   77   HD13  ILE   9          HD13      ILE   9  83.007   6.312 -10.565
   78    H    PHE  10           H        PHE  10  81.382   0.700 -10.573
   79    HA   PHE  10           HA       PHE  10  83.214  -0.333  -8.588
   80    HB2  PHE  10           HB2      PHE  10  81.090  -0.146  -7.691
   81    HB3  PHE  10           HB1      PHE  10  80.301  -0.633  -9.189
   82    HD1  PHE  10           HD1      PHE  10  80.194  -3.007  -9.847
   83    HD2  PHE  10           HD2      PHE  10  81.901  -1.787  -6.106
   84    HE1  PHE  10           HE1      PHE  10  80.101  -5.350  -9.049
   85    HE2  PHE  10           HE2      PHE  10  81.811  -4.131  -5.303
   86    HZ   PHE  10           HZ       PHE  10  80.911  -5.914  -6.777
   87    H    VAL  11           H        VAL  11  81.340  -1.787 -11.260
   88    HA   VAL  11           HA       VAL  11  82.250  -4.397 -11.031
   89    HB   VAL  11           HB       VAL  11  81.709  -4.621 -13.445
   90   HG11  VAL  11          HG11      VAL  11  79.379  -4.233 -13.176
   91   HG12  VAL  11          HG12      VAL  11  79.654  -2.898 -12.059
   92   HG13  VAL  11          HG13      VAL  11  79.983  -4.554 -11.552
   93   HG21  VAL  11          HG21      VAL  11  81.299  -1.628 -13.230
   94   HG22  VAL  11          HG22      VAL  11  80.858  -2.614 -14.622
   95   HG23  VAL  11          HG23      VAL  11  82.555  -2.425 -14.175
   96    H    GLN  12           H        GLN  12  83.799  -1.609 -12.477
   97    HA   GLN  12           HA       GLN  12  85.936  -3.283 -13.577
   98    HB2  GLN  12           HB2      GLN  12  86.723  -1.285 -14.651
   99    HB3  GLN  12           HB1      GLN  12  84.977  -1.388 -14.875
  100    HG2  GLN  12           HG2      GLN  12  84.705   0.121 -12.876
  101    HG3  GLN  12           HG1      GLN  12  86.456   0.331 -12.866
  102   HE21  GLN  12          HE21      GLN  12  85.827  -0.066 -16.050
  103   HE22  GLN  12          HE22      GLN  12  85.563   1.543 -16.509
  104    H    LYS  13           H        LYS  13  85.396  -1.141 -10.846
  105    HA   LYS  13           HA       LYS  13  88.284  -1.143 -10.281
  106    HB2  LYS  13           HB2      LYS  13  86.769   0.963 -10.275
  107    HB3  LYS  13           HB3      LYS  13  86.273   0.398  -8.679
  108    HG2  LYS  13           HG2      LYS  13  88.522   0.491  -7.853
  109    HG3  LYS  13           HG3      LYS  13  89.180   0.722  -9.470
  110    HD2  LYS  13           HD2      LYS  13  87.175   2.724  -8.516
  111    HD3  LYS  13           HD3      LYS  13  88.786   2.788  -7.804
  112    HE2  LYS  13           HE2      LYS  13  88.397   2.639 -10.794
  113    HE3  LYS  13           HE3      LYS  13  88.387   4.182  -9.938
  114    HZ1  LYS  13           HZ1      LYS  13  90.582   2.190 -10.032
  115    HZ2  LYS  13           HZ2      LYS  13  90.567   3.519  -8.974
  116    HZ3  LYS  13           HZ3      LYS  13  90.595   3.768 -10.654
  117    H    CYS  14           H        CYS  14  85.362  -1.434  -8.197
  118    HA   CYS  14           HA       CYS  14  86.942  -2.769  -6.189
  119    HB2  CYS  14           HB2      CYS  14  83.973  -2.624  -6.025
  120    HB3  CYS  14           HB1      CYS  14  85.171  -2.453  -4.750
  121    H    ALA  15           H        ALA  15  84.402  -3.871  -8.423
  122    HA   ALA  15           HA       ALA  15  83.834  -6.331  -7.347
  123    HB1  ALA  15           HB1      ALA  15  83.680  -7.105  -9.813
  124    HB2  ALA  15           HB2      ALA  15  84.107  -5.439 -10.201
  125    HB3  ALA  15           HB3      ALA  15  82.640  -5.783  -9.284
  126    H    GLN  16           H        GLN  16  86.800  -5.294  -8.832
  127    HA   GLN  16           HA       GLN  16  88.005  -7.637  -9.611
  128    HB2  GLN  16           HB2      GLN  16  88.939  -5.026  -8.611
  129    HB3  GLN  16           HB1      GLN  16  90.102  -6.339  -8.424
  130    HG2  GLN  16           HG2      GLN  16  89.887  -6.888 -10.810
  131    HG3  GLN  16           HG1      GLN  16  88.690  -5.610 -11.009
  132   HE21  GLN  16          HE21      GLN  16  89.557  -3.340 -10.213
  133   HE22  GLN  16          HE22      GLN  16  91.161  -2.979 -10.636
  134    H    CYS  17           H        CYS  17  88.549  -6.231  -6.343
  135    HA   CYS  17           HA       CYS  17  88.921  -9.006  -5.364
  136    HB2  CYS  17           HB2      CYS  17  90.059  -6.827  -3.731
  137    HB3  CYS  17           HB1      CYS  17  90.762  -8.370  -4.200
  138    H    HIS  18           H        HSD  18  86.304  -8.046  -5.407
  139    HA   HIS  18           HA       HSD  18  85.723  -8.095  -2.556
  140    HB2  HIS  18           HB2      HSD  18  85.088  -5.711  -4.279
  141    HB3  HIS  18           HB1      HSD  18  84.120  -6.098  -2.858
  142    HD1  HIS  18           HD1      HSD  18  86.655  -7.190  -1.184
  143    HD2  HIS  18           HD2      HSD  18  86.329  -3.483  -3.056
  144    HE1  HIS  18           HE1      HSD  18  88.288  -5.647  -0.010
  145    H    THR  19           H        THR  19  83.162  -7.738  -2.359
  146    HA   THR  19           HA       THR  19  81.820  -9.253  -4.506
  147    HB   THR  19           HB       THR  19  80.736 -10.088  -2.004
  148    HG1  THR  19           HG1      THR  19  83.109 -11.127  -1.705
  149   HG21  THR  19          HG21      THR  19  82.570 -11.579  -3.898
  150   HG22  THR  19          HG22      THR  19  80.843 -11.351  -4.164
  151   HG23  THR  19          HG23      THR  19  81.406 -12.288  -2.781
  152    H    VAL  20           H        VAL  20  81.543  -7.235  -1.620
  153    HA   VAL  20           HA       VAL  20  79.841  -5.901  -0.836
  154    HB   VAL  20           HB       VAL  20  79.146  -4.195  -2.400
  155   HG11  VAL  20          HG11      VAL  20  81.954  -5.009  -3.166
  156   HG12  VAL  20          HG12      VAL  20  81.560  -4.367  -1.575
  157   HG13  VAL  20          HG13      VAL  20  81.299  -3.379  -3.011
  158   HG21  VAL  20          HG21      VAL  20  79.438  -4.376  -4.758
  159   HG22  VAL  20          HG22      VAL  20  78.676  -5.885  -4.264
  160   HG23  VAL  20          HG23      VAL  20  80.407  -5.837  -4.598
  161    H    GLU  21           H        GLU  21  78.984  -8.625  -1.591
  162    HA   GLU  21           HA       GLU  21  76.136  -8.011  -2.130
  163    HB2  GLU  21           HB2      GLU  21  76.025 -10.377  -3.054
  164    HB3  GLU  21           HB3      GLU  21  76.883  -9.201  -4.047
  165    HG2  GLU  21           HG2      GLU  21  78.980 -10.088  -3.522
  166    HG3  GLU  21           HG3      GLU  21  78.406 -10.834  -2.035
  167    H    LYS  22           H        LYS  22  74.733  -8.658  -0.635
  168    HA   LYS  22           HA       LYS  22  75.641  -9.733   1.840
  169    HB2  LYS  22           HB2      LYS  22  73.633  -8.201   1.437
  170    HB3  LYS  22           HB3      LYS  22  72.771  -9.646   0.911
  171    HG2  LYS  22           HG2      LYS  22  72.232  -9.754   3.146
  172    HG3  LYS  22           HG3      LYS  22  73.781 -10.592   3.224
  173    HD2  LYS  22           HD2      LYS  22  74.067  -8.993   4.893
  174    HD3  LYS  22           HD3      LYS  22  74.745  -8.145   3.505
  175    HE2  LYS  22           HE2      LYS  22  72.367  -7.221   3.131
  176    HE3  LYS  22           HE3      LYS  22  72.024  -7.788   4.764
  177    HZ1  LYS  22           HZ1      LYS  22  72.893  -5.397   4.402
  178    HZ2  LYS  22           HZ2      LYS  22  74.411  -6.146   4.257
  179    HZ3  LYS  22           HZ3      LYS  22  73.509  -6.318   5.686
  180    H    GLY  23           H        GLY  23  76.019 -11.789   2.338
  181    HA2  GLY  23           HA2      GLY  23  75.617 -14.070   2.538
  182    HA3  GLY  23           HA3      GLY  23  74.286 -13.914   1.398
  183    H    GLY  24           H        GLY  24  77.310 -12.546   0.467
  184    HA2  GLY  24           HA2      GLY  24  77.566 -14.543  -1.656
  185    HA3  GLY  24           HA3      GLY  24  78.440 -13.021  -1.542
  186    H    LYS  25           H        LYS  25  80.522 -13.675  -1.674
  187    HA   LYS  25           HA       LYS  25  81.604 -15.146   0.598
  188    HB2  LYS  25           HB2      LYS  25  82.957 -16.575  -1.097
  189    HB3  LYS  25           HB3      LYS  25  81.293 -17.043  -0.746
  190    HG2  LYS  25           HG2      LYS  25  80.524 -15.837  -2.757
  191    HG3  LYS  25           HG3      LYS  25  82.187 -15.369  -3.112
  192    HD2  LYS  25           HD2      LYS  25  82.845 -17.639  -3.486
  193    HD3  LYS  25           HD3      LYS  25  81.331 -18.255  -2.822
  194    HE2  LYS  25           HE2      LYS  25  80.118 -17.082  -4.689
  195    HE3  LYS  25           HE3      LYS  25  81.686 -16.692  -5.393
  196    HZ1  LYS  25           HZ1      LYS  25  80.547 -18.779  -6.216
  197    HZ2  LYS  25           HZ2      LYS  25  80.923 -19.466  -4.709
  198    HZ3  LYS  25           HZ3      LYS  25  82.166 -18.937  -5.739
  199    H    HIS  26           H        HIS  26  83.205 -13.894   1.284
  200    HA   HIS  26           HA       HIS  26  84.400 -11.838  -0.235
  201    HB2  HIS  26           HB2      HIS  26  86.170 -11.996   1.678
  202    HB3  HIS  26           HB1      HIS  26  84.520 -11.513   2.075
  203    HD1  HIS  26           HD1      HIS  26  85.274 -15.091   1.270
  204    HD2  HIS  26           HD2      HIS  26  84.679 -12.736   4.657
  205    HE1  HIS  26           HE1      HIS  26  85.001 -16.689   3.216
  206    HE2  HIS  26           HE2      HIS  26  84.639 -15.269   5.288
  207    H    LYS  27           H        LYS  27  86.141 -11.773  -1.529
  208    HA   LYS  27           HA       LYS  27  87.986 -14.065  -1.602
  209    HB2  LYS  27           HB2      LYS  27  87.894 -14.100  -4.069
  210    HB3  LYS  27           HB3      LYS  27  86.328 -14.495  -3.359
  211    HG2  LYS  27           HG2      LYS  27  85.649 -12.103  -3.642
  212    HG3  LYS  27           HG3      LYS  27  87.173 -11.809  -4.480
  213    HD2  LYS  27           HD2      LYS  27  86.593 -13.385  -6.224
  214    HD3  LYS  27           HD3      LYS  27  85.150 -13.892  -5.345
  215    HE2  LYS  27           HE2      LYS  27  84.331 -11.502  -5.499
  216    HE3  LYS  27           HE3      LYS  27  85.681 -11.182  -6.589
  217    HZ1  LYS  27           HZ1      LYS  27  83.207 -12.494  -7.117
  218    HZ2  LYS  27           HZ2      LYS  27  84.527 -13.471  -7.550
  219    HZ3  LYS  27           HZ3      LYS  27  84.369 -11.912  -8.205
  220    H    THR  28           H        THR  28  90.081 -13.499  -1.992
  221    HA   THR  28           HA       THR  28  91.883 -12.047  -1.913
  222    HB   THR  28           HB       THR  28  90.504 -10.680  -4.223
  223    HG1  THR  28           HG1      THR  28  90.489 -13.114  -4.169
  224   HG21  THR  28          HG21      THR  28  93.366 -11.275  -3.444
  225   HG22  THR  28          HG22      THR  28  92.618  -9.700  -3.702
  226   HG23  THR  28          HG23      THR  28  92.914 -10.768  -5.071
  227    H    GLY  29           H        GLY  29  89.478 -11.280  -0.369
  228    HA2  GLY  29           HA2      GLY  29  90.226  -8.984   0.849
  229    HA3  GLY  29           HA3      GLY  29  89.289  -8.397  -0.523
  230    HA   PRO  30           HA       PRO  30  86.564  -9.986   3.090
  231    HB2  PRO  30           HB2      PRO  30  86.062  -7.640   4.412
  232    HB3  PRO  30           HB1      PRO  30  87.398  -8.728   4.835
  233    HG2  PRO  30           HG2      PRO  30  87.441  -6.212   3.238
  234    HG3  PRO  30           HG1      PRO  30  88.599  -6.805   4.442
  235    HD2  PRO  30           HD2      PRO  30  89.036  -7.007   1.748
  236    HD3  PRO  30           HD1      PRO  30  89.689  -8.171   2.924
  237    H    ASN  31           H        ASN  31  84.280  -9.049   3.617
  238    HA   ASN  31           HA       ASN  31  83.112  -8.129   1.078
  239    HB2  ASN  31           HB2      ASN  31  81.035  -8.980   1.898
  240    HB3  ASN  31           HB1      ASN  31  82.256 -10.191   2.284
  241   HD21  ASN  31          HD21      ASN  31  82.159 -10.932   4.402
  242   HD22  ASN  31          HD22      ASN  31  81.537 -10.051   5.713
  243    H    LEU  32           H        LEU  32  81.315  -6.529   1.232
  244    HA   LEU  32           HA       LEU  32  81.872  -4.511   3.329
  245    HB2  LEU  32           HB2      LEU  32  80.773  -3.936   0.573
  246    HB3  LEU  32           HB3      LEU  32  81.363  -2.778   1.757
  247    HG   LEU  32           HG       LEU  32  82.988  -4.785   0.173
  248   HD11  LEU  32          HD11      LEU  32  83.402  -1.805   0.458
  249   HD12  LEU  32          HD12      LEU  32  82.283  -2.460  -0.733
  250   HD13  LEU  32          HD13      LEU  32  83.992  -2.877  -0.811
  251   HD21  LEU  32          HD21      LEU  32  83.624  -3.308   2.705
  252   HD22  LEU  32          HD22      LEU  32  84.892  -3.477   1.497
  253   HD23  LEU  32          HD23      LEU  32  84.140  -4.908   2.189
  254    H    HIS  33           H        HIS  33  79.976  -6.672   3.603
  255    HA   HIS  33           HA       HIS  33  77.329  -5.926   3.009
  256    HB2  HIS  33           HB2      HIS  33  78.271  -7.496   5.419
  257    HB3  HIS  33           HB1      HIS  33  76.668  -7.542   4.686
  258    HD1  HIS  33           HD1      HIS  33  78.654 -10.031   4.923
  259    HD2  HIS  33           HD2      HIS  33  78.046  -7.710   1.514
  260    HE1  HIS  33           HE1      HIS  33  79.323 -11.469   2.950
  261    HE2  HIS  33           HE2      HIS  33  78.959 -10.069   0.863
  262    H    GLY  34           H        GLY  34  75.814  -4.692   4.081
  263    HA2  GLY  34           HA2      GLY  34  75.260  -2.722   5.231
  264    HA3  GLY  34           HA3      GLY  34  75.555  -3.802   6.591
  265    H    LEU  35           H        LEU  35  78.015  -2.746   4.350
  266    HA   LEU  35           HA       LEU  35  80.002  -2.128   6.093
  267    HB2  LEU  35           HB2      LEU  35  80.311  -2.150   3.682
  268    HB3  LEU  35           HB3      LEU  35  79.303  -0.716   3.510
  269    HG   LEU  35           HG       LEU  35  81.070   0.333   5.191
  270   HD11  LEU  35          HD11      LEU  35  82.869  -1.581   3.735
  271   HD12  LEU  35          HD12      LEU  35  82.179  -2.034   5.290
  272   HD13  LEU  35          HD13      LEU  35  83.214  -0.613   5.162
  273   HD21  LEU  35          HD21      LEU  35  81.815  -0.174   2.301
  274   HD22  LEU  35          HD22      LEU  35  82.286   1.206   3.295
  275   HD23  LEU  35          HD23      LEU  35  80.603   1.002   2.810
  276    H    PHE  36           H        PHE  36  77.764   0.291   4.749
  277    HA   PHE  36           HA       PHE  36  78.630   2.460   6.268
  278    HB2  PHE  36           HB2      PHE  36  75.781   2.006   5.363
  279    HB3  PHE  36           HB1      PHE  36  76.592   3.550   5.631
  280    HD1  PHE  36           HD2      PHE  36  76.515   0.524   3.467
  281    HD2  PHE  36           HD1      PHE  36  78.019   4.521   3.957
  282    HE1  PHE  36           HE2      PHE  36  77.338   0.506   1.128
  283    HE2  PHE  36           HE1      PHE  36  78.834   4.501   1.624
  284    HZ   PHE  36           HZ       PHE  36  78.494   2.496   0.205
  285    H    GLY  37           H        GLY  37  78.987   1.900   8.434
  286    HA2  GLY  37           HA2      GLY  37  77.458   2.580  10.428
  287    HA3  GLY  37           HA3      GLY  37  76.637   1.085  10.015
  288    H    ARG  38           H        ARG  38  79.255  -0.214   9.286
  289    HA   ARG  38           HA       ARG  38  79.894  -1.092  11.989
  290    HB2  ARG  38           HB2      ARG  38  80.292  -2.126   9.250
  291    HB3  ARG  38           HB3      ARG  38  81.590  -2.498  10.383
  292    HG2  ARG  38           HG2      ARG  38  79.770  -3.299  11.994
  293    HG3  ARG  38           HG3      ARG  38  78.657  -3.202  10.628
  294    HD2  ARG  38           HD2      ARG  38  81.247  -4.697  10.321
  295    HD3  ARG  38           HD3      ARG  38  79.897  -5.466  11.147
  296    HE   ARG  38           HE       ARG  38  78.733  -4.590   8.875
  297   HH11  ARG  38          HH21      ARG  38  81.682  -6.306   9.510
  298   HH12  ARG  38          HH22      ARG  38  81.654  -7.172   8.011
  299   HH21  ARG  38          HH11      ARG  38  78.693  -5.746   6.923
  300   HH22  ARG  38          HH12      ARG  38  79.965  -6.861   6.555
  301    H    LYS  39           H        LYS  39  82.053  -1.258  12.806
  302    HA   LYS  39           HA       LYS  39  83.604   1.131  12.344
  303    HB2  LYS  39           HB2      LYS  39  83.678  -1.150  14.272
  304    HB3  LYS  39           HB3      LYS  39  85.146  -0.199  14.054
  305    HG2  LYS  39           HG2      LYS  39  82.538   1.234  14.473
  306    HG3  LYS  39           HG3      LYS  39  83.351   0.516  15.864
  307    HD2  LYS  39           HD2      LYS  39  85.435   1.759  15.218
  308    HD3  LYS  39           HD3      LYS  39  84.511   2.564  13.950
  309    HE2  LYS  39           HE2      LYS  39  84.257   2.831  16.933
  310    HE3  LYS  39           HE3      LYS  39  84.344   4.097  15.708
  311    HZ1  LYS  39           HZ1      LYS  39  82.064   2.252  16.178
  312    HZ2  LYS  39           HZ2      LYS  39  82.148   3.393  14.921
  313    HZ3  LYS  39           HZ3      LYS  39  82.108   3.908  16.540
  314    H    THR  40           H        THR  40  86.031   0.957  12.100
  315    HA   THR  40           HA       THR  40  86.649  -0.375   9.684
  316    HB   THR  40           HB       THR  40  89.031   0.303  10.271
  317    HG1  THR  40           HG1      THR  40  87.763   1.744  12.333
  318   HG21  THR  40          HG21      THR  40  87.681   1.726   8.870
  319   HG22  THR  40          HG22      THR  40  88.470   2.754  10.067
  320   HG23  THR  40          HG23      THR  40  86.773   2.316  10.263
  321    H    GLY  41           H        GLY  41  87.913  -2.148   9.235
  322    HA2  GLY  41           HA2      GLY  41  88.527  -4.348   9.541
  323    HA3  GLY  41           HA3      GLY  41  89.490  -3.682  10.857
  324    H    GLN  42           H        GLN  42  85.991  -4.125  10.379
  325    HA   GLN  42           HA       GLN  42  85.920  -5.568  12.965
  326    HB2  GLN  42           HB2      GLN  42  84.735  -3.277  12.709
  327    HB3  GLN  42           HB1      GLN  42  83.554  -4.156  11.742
  328    HG2  GLN  42           HG2      GLN  42  84.266  -5.412  14.345
  329    HG3  GLN  42           HG1      GLN  42  83.382  -3.894  14.448
  330   HE21  GLN  42          HE21      GLN  42  81.271  -3.802  13.206
  331   HE22  GLN  42          HE22      GLN  42  80.400  -5.242  12.991
  332    H    ALA  43           H        ALA  43  85.561  -5.916   9.638
  333    HA   ALA  43           HA       ALA  43  83.406  -7.809   9.628
  334    HB1  ALA  43           HB1      ALA  43  83.552  -7.119   7.488
  335    HB2  ALA  43           HB2      ALA  43  84.855  -8.294   7.328
  336    HB3  ALA  43           HB3      ALA  43  85.227  -6.606   7.679
  337    HA   PRO  44           HA       PRO  44  86.090 -11.138  11.037
  338    HB2  PRO  44           HB2      PRO  44  84.193 -13.047  11.317
  339    HB3  PRO  44           HB1      PRO  44  84.324 -11.683  12.447
  340    HG2  PRO  44           HG2      PRO  44  82.435 -12.082  10.175
  341    HG3  PRO  44           HG1      PRO  44  82.133 -11.414  11.789
  342    HD2  PRO  44           HD2      PRO  44  82.508  -9.868   9.526
  343    HD3  PRO  44           HD1      PRO  44  82.821  -9.301  11.183
  344    H    GLY  45           H        GLY  45  87.400 -12.142   9.604
  345    HA2  GLY  45           HA2      GLY  45  86.954 -14.322   8.101
  346    HA3  GLY  45           HA3      GLY  45  86.386 -13.045   7.030
  347    H    PHE  46           H        PHE  46  87.898 -11.398   6.366
  348    HA   PHE  46           HA       PHE  46  90.469 -12.466   5.728
  349    HB2  PHE  46           HB2      PHE  46  89.017 -10.748   4.418
  350    HB3  PHE  46           HB1      PHE  46  89.760  -9.552   5.480
  351    HD1  PHE  46           HD2      PHE  46  90.510 -12.264   3.035
  352    HD2  PHE  46           HD1      PHE  46  92.000  -8.826   5.138
  353    HE1  PHE  46           HE2      PHE  46  92.553 -12.289   1.629
  354    HE2  PHE  46           HE1      PHE  46  94.042  -8.852   3.732
  355    HZ   PHE  46           HZ       PHE  46  94.319 -10.583   1.978
  356    H    THR  47           H        THR  47  92.507 -11.800   6.435
  357    HA   THR  47           HA       THR  47  92.677 -11.086   9.195
  358    HB   THR  47           HB       THR  47  94.442 -12.449   8.597
  359    HG1  THR  47           HG1      THR  47  95.605  -9.950   7.983
  360   HG21  THR  47          HG21      THR  47  94.334 -10.938   6.005
  361   HG22  THR  47          HG22      THR  47  94.236 -12.676   6.285
  362   HG23  THR  47          HG23      THR  47  95.783 -11.845   6.433
  363    H    TYR  48           H        TYR  48  91.554  -9.042   9.181
  364    HA   TYR  48           HA       TYR  48  92.323  -6.787   7.705
  365    HB2  TYR  48           HB2      TYR  48  90.854  -7.247  10.257
  366    HB3  TYR  48           HB3      TYR  48  91.404  -5.610   9.921
  367    HD1  TYR  48           HD1      TYR  48  90.703  -4.462   7.824
  368    HD2  TYR  48           HD2      TYR  48  89.040  -8.231   9.028
  369    HE1  TYR  48           HE1      TYR  48  88.815  -4.120   6.264
  370    HE2  TYR  48           HE2      TYR  48  87.145  -7.890   7.465
  371    HH   TYR  48           HH       TYR  48  86.574  -4.850   5.926
  372    H    THR  49           H        THR  49  93.591  -4.975   8.259
  373    HA   THR  49           HA       THR  49  96.036  -5.660   9.655
  374    HB   THR  49           HB       THR  49  96.793  -3.435   8.918
  375    HG1  THR  49           HG1      THR  49  95.255  -2.033   8.730
  376   HG21  THR  49          HG21      THR  49  97.184  -5.007   7.241
  377   HG22  THR  49          HG22      THR  49  96.193  -3.828   6.386
  378   HG23  THR  49          HG23      THR  49  95.467  -5.316   6.988
  379    H    ASP  50           H        ASP  50  96.944  -4.358  11.376
  380    HA   ASP  50           HA       ASP  50  95.245  -4.002  13.562
  381    HB2  ASP  50           HB2      ASP  50  97.618  -4.295  13.882
  382    HB3  ASP  50           HB1      ASP  50  97.964  -2.805  13.005
  383    H    ALA  51           H        ALA  51  96.520  -1.595  11.276
  384    HA   ALA  51           HA       ALA  51  95.518   0.714  12.471
  385    HB1  ALA  51           HB1      ALA  51  97.000   0.953  10.623
  386    HB2  ALA  51           HB2      ALA  51  95.450   1.614  10.098
  387    HB3  ALA  51           HB3      ALA  51  95.948   0.006   9.570
  388    H    ASN  52           H        ASN  52  93.924  -1.626  10.365
  389    HA   ASN  52           HA       ASN  52  91.464  -0.100  10.242
  390    HB2  ASN  52           HB2      ASN  52  92.552  -2.564   9.041
  391    HB3  ASN  52           HB1      ASN  52  90.829  -2.637   9.390
  392   HD21  ASN  52          HD21      ASN  52  90.266  -2.532   7.105
  393   HD22  ASN  52          HD22      ASN  52  90.440  -1.089   6.223
  394    H    LYS  53           H        LYS  53  92.835  -2.651  12.172
  395    HA   LYS  53           HA       LYS  53  90.308  -3.342  13.427
  396    HB2  LYS  53           HB2      LYS  53  91.543  -5.256  13.500
  397    HB3  LYS  53           HB3      LYS  53  93.067  -4.387  13.384
  398    HG2  LYS  53           HG2      LYS  53  92.965  -3.823  15.766
  399    HG3  LYS  53           HG3      LYS  53  91.386  -4.600  15.899
  400    HD2  LYS  53           HD2      LYS  53  92.546  -6.722  15.026
  401    HD3  LYS  53           HD3      LYS  53  94.064  -5.890  15.366
  402    HE2  LYS  53           HE2      LYS  53  93.349  -5.566  17.715
  403    HE3  LYS  53           HE3      LYS  53  91.854  -6.436  17.371
  404    HZ1  LYS  53           HZ1      LYS  53  94.554  -7.590  16.955
  405    HZ2  LYS  53           HZ2      LYS  53  93.064  -8.402  16.898
  406    HZ3  LYS  53           HZ3      LYS  53  93.654  -7.807  18.376
  407    H    ASN  54           H        ASN  54  92.601  -0.929  13.682
  408    HA   ASN  54           HA       ASN  54  92.746  -0.527  16.482
  409    HB2  ASN  54           HB2      ASN  54  93.829   1.441  15.962
  410    HB3  ASN  54           HB1      ASN  54  94.083   0.537  14.474
  411   HD21  ASN  54          HD21      ASN  54  91.399   0.847  13.399
  412   HD22  ASN  54          HD22      ASN  54  91.194   2.483  13.006
  413    H    LYS  55           H        LYS  55  90.293  -0.040  14.175
  414    HA   LYS  55           HA       LYS  55  88.175   0.872  14.282
  415    HB2  LYS  55           HB2      LYS  55  88.679   0.363  17.218
  416    HB3  LYS  55           HB3      LYS  55  87.118   0.851  16.558
  417    HG2  LYS  55           HG2      LYS  55  86.968  -1.140  15.220
  418    HG3  LYS  55           HG3      LYS  55  88.638  -1.578  15.582
  419    HD2  LYS  55           HD2      LYS  55  88.006  -1.755  18.004
  420    HD3  LYS  55           HD3      LYS  55  86.326  -1.485  17.540
  421    HE2  LYS  55           HE2      LYS  55  86.646  -3.868  17.700
  422    HE3  LYS  55           HE3      LYS  55  86.533  -3.470  15.985
  423    HZ1  LYS  55           HZ1      LYS  55  88.390  -4.987  16.559
  424    HZ2  LYS  55           HZ2      LYS  55  89.096  -3.730  17.458
  425    HZ3  LYS  55           HZ3      LYS  55  88.887  -3.566  15.780
  426    H    GLY  56           H        GLY  56  89.613   2.849  13.635
  427    HA2  GLY  56           HA2      GLY  56  89.672   4.947  15.665
  428    HA3  GLY  56           HA3      GLY  56  90.313   5.058  14.029
  429    H    ILE  57           H        ILE  57  87.964   4.175  12.657
  430    HA   ILE  57           HA       ILE  57  85.910   6.146  13.389
  431    HB   ILE  57           HB       ILE  57  85.862   7.144  11.205
  432   HG12  ILE  57          HG12      ILE  57  87.850   6.406   9.626
  433   HG13  ILE  57          HG13      ILE  57  87.779   4.911  10.553
  434   HG21  ILE  57          HG21      ILE  57  87.607   7.881  12.910
  435   HG22  ILE  57          HG22      ILE  57  87.944   8.319  11.235
  436   HG23  ILE  57          HG23      ILE  57  88.780   6.954  11.975
  437   HD11  ILE  57          HD11      ILE  57  85.146   5.892   9.622
  438   HD12  ILE  57          HD12      ILE  57  85.819   4.266   9.586
  439   HD13  ILE  57          HD13      ILE  57  86.257   5.424   8.338
  440    H    THR  58           H        THR  58  84.043   5.938  11.680
  441    HA   THR  58           HA       THR  58  83.542   3.046  11.293
  442    HB   THR  58           HB       THR  58  81.560   5.268  11.834
  443    HG1  THR  58           HG1      THR  58  82.686   3.213  13.411
  444   HG21  THR  58          HG21      THR  58  81.067   2.289  11.825
  445   HG22  THR  58          HG22      THR  58  80.810   3.282  10.393
  446   HG23  THR  58          HG23      THR  58  79.876   3.586  11.855
  447    H    TRP  59           H        TRP  59  82.755   2.329   9.362
  448    HA   TRP  59           HA       TRP  59  83.195   3.897   7.040
  449    HB2  TRP  59           HB2      TRP  59  81.388   1.482   7.157
  450    HB3  TRP  59           HB1      TRP  59  82.352   2.065   5.801
  451    HD1  TRP  59           HD1      TRP  59  85.111   2.475   7.230
  452    HE1  TRP  59           HE1      TRP  59  86.480   0.420   7.992
  453    HE3  TRP  59           HE3      TRP  59  81.404  -1.019   7.512
  454    HZ2  TRP  59           HZ2      TRP  59  86.045  -2.323   8.673
  455    HZ3  TRP  59           HZ3      TRP  59  81.907  -3.339   8.215
  456    HH2  TRP  59           HH2      TRP  59  84.222  -3.993   8.795
  457    H    LYS  60           H        LYS  60  81.840   5.139   5.852
  458    HA   LYS  60           HA       LYS  60  78.969   5.080   6.258
  459    HB2  LYS  60           HB2      LYS  60  80.633   7.473   7.074
  460    HB3  LYS  60           HB3      LYS  60  78.893   7.538   6.805
  461    HG2  LYS  60           HG2      LYS  60  78.717   5.607   8.489
  462    HG3  LYS  60           HG3      LYS  60  80.392   5.967   8.907
  463    HD2  LYS  60           HD2      LYS  60  78.258   8.108   8.905
  464    HD3  LYS  60           HD3      LYS  60  78.575   7.111  10.323
  465    HE2  LYS  60           HE2      LYS  60  80.976   7.802  10.216
  466    HE3  LYS  60           HE3      LYS  60  80.566   8.893   8.894
  467    HZ1  LYS  60           HZ1      LYS  60  79.870   9.067  11.733
  468    HZ2  LYS  60           HZ2      LYS  60  78.765   9.684  10.599
  469    HZ3  LYS  60           HZ3      LYS  60  80.350  10.291  10.660
  470    H    GLU  61           H        GLU  61  78.346   7.515   5.065
  471    HA   GLU  61           HA       GLU  61  78.928   6.913   2.322
  472    HB2  GLU  61           HB2      GLU  61  76.757   7.825   2.965
  473    HB3  GLU  61           HB3      GLU  61  77.531   9.286   3.580
  474    HG2  GLU  61           HG2      GLU  61  78.245   9.942   1.395
  475    HG3  GLU  61           HG3      GLU  61  77.840   8.366   0.716
  476    H    GLU  62           H        GLU  62  79.567   9.820   4.313
  477    HA   GLU  62           HA       GLU  62  81.340  10.961   2.391
  478    HB2  GLU  62           HB2      GLU  62  81.162  11.595   5.343
  479    HB3  GLU  62           HB3      GLU  62  81.795  12.635   4.068
  480    HG2  GLU  62           HG2      GLU  62  79.514  12.548   2.985
  481    HG3  GLU  62           HG3      GLU  62  78.930  11.721   4.428
  482    H    THR  63           H        THR  63  81.829   9.074   5.351
  483    HA   THR  63           HA       THR  63  84.613   9.316   5.539
  484    HB   THR  63           HB       THR  63  84.547   7.236   6.822
  485    HG1  THR  63           HG1      THR  63  82.791   5.945   6.781
  486   HG21  THR  63          HG21      THR  63  83.810   9.127   8.054
  487   HG22  THR  63          HG22      THR  63  82.620   7.865   8.374
  488   HG23  THR  63          HG23      THR  63  82.254   9.153   7.227
  489    H    LEU  64           H        LEU  64  82.576   7.219   3.582
  490    HA   LEU  64           HA       LEU  64  84.677   5.568   2.612
  491    HB2  LEU  64           HB2      LEU  64  81.826   5.941   2.062
  492    HB3  LEU  64           HB3      LEU  64  82.750   5.556   0.619
  493    HG   LEU  64           HG       LEU  64  82.858   3.967   3.198
  494   HD11  LEU  64          HD11      LEU  64  80.833   3.232   2.460
  495   HD12  LEU  64          HD12      LEU  64  81.793   2.299   1.312
  496   HD13  LEU  64          HD13      LEU  64  81.088   3.839   0.825
  497   HD21  LEU  64          HD21      LEU  64  84.399   3.945   0.669
  498   HD22  LEU  64          HD22      LEU  64  83.796   2.364   1.168
  499   HD23  LEU  64          HD23      LEU  64  84.823   3.296   2.251
  500    H    MET  65           H        MET  65  83.273   8.630   1.542
  501    HA   MET  65           HA       MET  65  84.437   8.789  -1.004
  502    HB2  MET  65           HB2      MET  65  83.911  11.025   0.968
  503    HB3  MET  65           HB1      MET  65  84.249  11.242  -0.748
  504    HG2  MET  65           HG2      MET  65  82.255  10.041  -1.367
  505    HG3  MET  65           HG1      MET  65  81.963   9.567   0.304
  506    HE1  MET  65           HE1      MET  65  80.297  11.358  -2.110
  507    HE2  MET  65           HE2      MET  65  81.828  12.180  -2.401
  508    HE3  MET  65           HE3      MET  65  80.429  13.104  -1.859
  509    H    GLU  66           H        GLU  66  85.699  10.168   2.044
  510    HA   GLU  66           HA       GLU  66  88.173  10.996   1.003
  511    HB2  GLU  66           HB2      GLU  66  87.336  10.202   3.796
  512    HB3  GLU  66           HB3      GLU  66  88.934  10.849   3.420
  513    HG2  GLU  66           HG2      GLU  66  86.379  12.266   2.639
  514    HG3  GLU  66           HG3      GLU  66  87.198  12.560   4.173
  515    H    TYR  67           H        TYR  67  87.017   7.891   2.077
  516    HA   TYR  67           HA       TYR  67  89.621   6.654   2.207
  517    HB2  TYR  67           HB2      TYR  67  87.815   5.786   3.580
  518    HB3  TYR  67           HB3      TYR  67  86.824   5.507   2.152
  519    HD1  TYR  67           HD1      TYR  67  89.841   4.408   3.992
  520    HD2  TYR  67           HD2      TYR  67  87.186   3.612   0.711
  521    HE1  TYR  67           HE1      TYR  67  90.839   2.153   3.732
  522    HE2  TYR  67           HE2      TYR  67  88.187   1.358   0.448
  523    HH   TYR  67           HH       TYR  67  89.637  -0.114   1.252
  524    H    LEU  68           H        LEU  68  87.137   7.134  -0.189
  525    HA   LEU  68           HA       LEU  68  88.159   5.176  -2.036
  526    HB2  LEU  68           HB2      LEU  68  86.050   7.315  -2.150
  527    HB3  LEU  68           HB3      LEU  68  86.569   6.503  -3.620
  528    HG   LEU  68           HG       LEU  68  85.484   5.133  -1.143
  529   HD11  LEU  68          HD11      LEU  68  84.228   5.238  -3.883
  530   HD12  LEU  68          HD12      LEU  68  83.888   6.468  -2.669
  531   HD13  LEU  68          HD13      LEU  68  83.489   4.779  -2.351
  532   HD21  LEU  68          HD21      LEU  68  85.346   3.301  -3.134
  533   HD22  LEU  68          HD22      LEU  68  86.702   3.413  -2.016
  534   HD23  LEU  68          HD23      LEU  68  86.810   4.155  -3.612
  535    H    GLU  69           H        GLU  69  88.805   8.511  -1.337
  536    HA   GLU  69           HA       GLU  69  90.141   8.933  -3.911
  537    HB2  GLU  69           HB2      GLU  69  90.145  11.192  -3.411
  538    HB3  GLU  69           HB3      GLU  69  88.715  10.662  -2.527
  539    HG2  GLU  69           HG2      GLU  69  90.323  10.302  -0.534
  540    HG3  GLU  69           HG3      GLU  69  91.459  11.293  -1.445
  541    H    ASN  70           H        ASN  70  90.862   7.673  -0.904
  542    HA   ASN  70           HA       ASN  70  93.606   7.293  -1.475
  543    HB2  ASN  70           HB2      ASN  70  93.325   9.831  -0.730
  544    HB3  ASN  70           HB1      ASN  70  93.335   9.120   0.879
  545   HD21  ASN  70          HD21      ASN  70  95.187   7.003   0.508
  546   HD22  ASN  70          HD22      ASN  70  96.707   7.659   0.128
  547    HA   PRO  71           HA       PRO  71  91.278   4.491   1.494
  548    HB2  PRO  71           HB2      PRO  71  93.088   2.635   0.003
  549    HB3  PRO  71           HB1      PRO  71  91.388   2.426   0.463
  550    HG2  PRO  71           HG2      PRO  71  92.085   3.007  -2.038
  551    HG3  PRO  71           HG1      PRO  71  90.614   3.673  -1.306
  552    HD2  PRO  71           HD2      PRO  71  93.206   5.033  -1.896
  553    HD3  PRO  71           HD1      PRO  71  91.560   5.704  -1.863
  554    H    LYS  72           H        LYS  72  94.722   4.681   0.651
  555    HA   LYS  72           HA       LYS  72  95.576   3.364   3.068
  556    HB2  LYS  72           HB2      LYS  72  96.873   3.213   0.984
  557    HB3  LYS  72           HB3      LYS  72  97.152   4.948   1.030
  558    HG2  LYS  72           HG2      LYS  72  99.114   4.099   1.997
  559    HG3  LYS  72           HG3      LYS  72  98.140   4.499   3.407
  560    HD2  LYS  72           HD2      LYS  72  99.131   2.274   3.675
  561    HD3  LYS  72           HD3      LYS  72  97.382   2.137   3.537
  562    HE2  LYS  72           HE2      LYS  72  97.498   1.044   1.531
  563    HE3  LYS  72           HE3      LYS  72  98.865   2.006   0.968
  564    HZ1  LYS  72           HZ1      LYS  72  99.821  -0.036   1.306
  565    HZ2  LYS  72           HZ2      LYS  72  98.857  -0.402   2.656
  566    HZ3  LYS  72           HZ3      LYS  72 100.132   0.712   2.796
  567    H    LYS  73           H        LYS  73  95.708   6.729   1.881
  568    HA   LYS  73           HA       LYS  73  97.003   7.799   4.113
  569    HB2  LYS  73           HB2      LYS  73  96.660   8.976   1.937
  570    HB3  LYS  73           HB3      LYS  73  94.974   9.223   2.386
  571    HG2  LYS  73           HG2      LYS  73  96.925  10.042   4.458
  572    HG3  LYS  73           HG3      LYS  73  96.996  10.983   2.970
  573    HD2  LYS  73           HD2      LYS  73  94.574  11.420   3.124
  574    HD3  LYS  73           HD3      LYS  73  94.497  10.480   4.613
  575    HE2  LYS  73           HE2      LYS  73  94.652  12.799   5.246
  576    HE3  LYS  73           HE3      LYS  73  96.215  12.057   5.590
  577    HZ1  LYS  73           HZ1      LYS  73  95.771  13.275   2.958
  578    HZ2  LYS  73           HZ2      LYS  73  97.210  13.116   3.847
  579    HZ3  LYS  73           HZ3      LYS  73  96.065  14.292   4.284
  580    H    TYR  74           H        TYR  74  93.597   7.077   3.576
  581    HA   TYR  74           HA       TYR  74  92.577   8.540   5.779
  582    HB2  TYR  74           HB2      TYR  74  91.399   7.266   3.739
  583    HB3  TYR  74           HB3      TYR  74  91.241   6.002   4.957
  584    HD1  TYR  74           HD1      TYR  74  90.878   9.741   4.748
  585    HD2  TYR  74           HD2      TYR  74  89.284   6.034   6.225
  586    HE1  TYR  74           HE1      TYR  74  88.975  10.963   5.765
  587    HE2  TYR  74           HE2      TYR  74  87.384   7.258   7.243
  588    HH   TYR  74           HH       TYR  74  86.482   9.242   7.646
  589    H    ILE  75           H        ILE  75  93.210   5.040   5.457
  590    HA   ILE  75           HA       ILE  75  93.793   4.956   8.356
  591    HB   ILE  75           HB       ILE  75  92.310   2.816   6.808
  592   HG12  ILE  75          HG12      ILE  75  91.160   4.594   8.964
  593   HG13  ILE  75          HG13      ILE  75  91.095   5.063   7.268
  594   HG21  ILE  75          HG21      ILE  75  93.562   1.882   8.654
  595   HG22  ILE  75          HG22      ILE  75  91.876   1.982   9.157
  596   HG23  ILE  75          HG23      ILE  75  93.038   3.178   9.730
  597   HD11  ILE  75          HD11      ILE  75  89.880   3.033   6.700
  598   HD12  ILE  75          HD12      ILE  75  89.042   3.851   8.018
  599   HD13  ILE  75          HD13      ILE  75  90.042   2.437   8.351
  600    HA   PRO  76           HA       PRO  76  97.403   3.641   5.615
  601    HB2  PRO  76           HB2      PRO  76  98.549   4.307   8.310
  602    HB3  PRO  76           HB1      PRO  76  99.219   4.617   6.696
  603    HG2  PRO  76           HG2      PRO  76  98.032   6.548   8.099
  604    HG3  PRO  76           HG1      PRO  76  97.871   6.444   6.337
  605    HD2  PRO  76           HD2      PRO  76  95.846   5.883   8.434
  606    HD3  PRO  76           HD1      PRO  76  95.609   6.332   6.732
  607    H    GLY  77           H        GLY  77  98.654   1.734   5.756
  608    HA2  GLY  77           HA2      GLY  77  99.406  -0.277   6.728
  609    HA3  GLY  77           HA3      GLY  77  98.309  -0.013   8.081
  610    H    THR  78           H        THR  78  96.047   0.600   6.278
  611    HA   THR  78           HA       THR  78  94.844  -1.909   6.125
  612    HB   THR  78           HB       THR  78  93.658   0.293   6.041
  613    HG1  THR  78           HG1      THR  78  92.763  -1.776   5.318
  614   HG21  THR  78          HG21      THR  78  93.567   1.535   4.009
  615   HG22  THR  78          HG22      THR  78  94.381   0.254   3.110
  616   HG23  THR  78          HG23      THR  78  95.276   1.206   4.296
  617    H    LYS  79           H        LYS  79  94.622  -3.446   4.530
  618    HA   LYS  79           HA       LYS  79  96.669  -3.401   2.456
  619    HB2  LYS  79           HB2      LYS  79  94.872  -5.448   3.658
  620    HB3  LYS  79           HB3      LYS  79  95.405  -5.723   2.001
  621    HG2  LYS  79           HG2      LYS  79  97.416  -4.932   4.096
  622    HG3  LYS  79           HG3      LYS  79  96.874  -6.606   3.997
  623    HD2  LYS  79           HD2      LYS  79  97.749  -5.203   1.486
  624    HD3  LYS  79           HD3      LYS  79  98.971  -5.819   2.598
  625    HE2  LYS  79           HE2      LYS  79  98.382  -8.033   2.237
  626    HE3  LYS  79           HE3      LYS  79  96.713  -7.635   1.831
  627    HZ1  LYS  79           HZ1      LYS  79  99.074  -7.683   0.140
  628    HZ2  LYS  79           HZ2      LYS  79  97.997  -6.397  -0.132
  629    HZ3  LYS  79           HZ3      LYS  79  97.453  -8.002  -0.246
  630    H    MET  80           H        MET  80  95.972  -1.837   0.986
  631    HA   MET  80           HA       MET  80  94.287  -2.737  -1.089
  632    HB2  MET  80           HB2      MET  80  92.428  -2.281   0.393
  633    HB3  MET  80           HB1      MET  80  93.057  -0.672   0.752
  634    HG2  MET  80           HG2      MET  80  92.510   0.160  -1.361
  635    HG3  MET  80           HG1      MET  80  92.523  -1.437  -2.106
  636    HE1  MET  80           HE1      MET  80  88.919   0.656  -1.762
  637    HE2  MET  80           HE2      MET  80  90.246   0.412  -2.894
  638    HE3  MET  80           HE3      MET  80  90.512   1.343  -1.424
  639    H    ILE  81           H        ILE  81  95.923  -2.060  -2.421
  640    HA   ILE  81           HA       ILE  81  96.201   0.862  -2.740
  641    HB   ILE  81           HB       ILE  81  98.469  -1.143  -2.863
  642   HG12  ILE  81          HG12      ILE  81  99.203   0.586  -0.943
  643   HG13  ILE  81          HG13      ILE  81  97.456   0.731  -0.756
  644   HG21  ILE  81          HG21      ILE  81  98.265   1.828  -3.382
  645   HG22  ILE  81          HG22      ILE  81  98.916   0.578  -4.443
  646   HG23  ILE  81          HG23      ILE  81  99.799   1.051  -2.990
  647   HD11  ILE  81          HD11      ILE  81  97.836  -1.058   0.658
  648   HD12  ILE  81          HD12      ILE  81  99.231  -1.622  -0.260
  649   HD13  ILE  81          HD13      ILE  81  97.601  -1.942  -0.848
  650    H    PHE  82           H        PHE  82  94.628   0.534  -4.452
  651    HA   PHE  82           HA       PHE  82  95.767  -0.747  -6.869
  652    HB2  PHE  82           HB2      PHE  82  93.613  -1.707  -5.981
  653    HB3  PHE  82           HB1      PHE  82  92.851  -0.153  -6.323
  654    HD1  PHE  82           HD2      PHE  82  94.828  -2.897  -7.919
  655    HD2  PHE  82           HD1      PHE  82  92.072   0.347  -8.496
  656    HE1  PHE  82           HE2      PHE  82  94.547  -3.558 -10.291
  657    HE2  PHE  82           HE1      PHE  82  91.792  -0.315 -10.869
  658    HZ   PHE  82           HZ       PHE  82  93.028  -2.268 -11.767
  659    H    ALA  83           H        ALA  83  93.311   1.751  -6.182
  660    HA   ALA  83           HA       ALA  83  94.743   3.907  -7.299
  661    HB1  ALA  83           HB1      ALA  83  94.591   2.879  -9.439
  662    HB2  ALA  83           HB2      ALA  83  93.335   4.116  -9.417
  663    HB3  ALA  83           HB3      ALA  83  92.908   2.422  -9.180
  664    H    GLY  84           H        GLY  84  93.862   5.550  -6.234
  665    HA2  GLY  84           HA2      GLY  84  91.261   5.424  -5.060
  666    HA3  GLY  84           HA3      GLY  84  92.326   6.826  -5.079
  667    H    ILE  85           H        ILE  85  89.757   7.397  -5.360
  668    HA   ILE  85           HA       ILE  85  89.007   7.475  -8.181
  669    HB   ILE  85           HB       ILE  85  87.673   8.468  -5.658
  670   HG12  ILE  85          HG12      ILE  85  87.866   5.928  -6.385
  671   HG13  ILE  85          HG13      ILE  85  86.337   6.560  -5.784
  672   HG21  ILE  85          HG21      ILE  85  85.678   8.743  -7.251
  673   HG22  ILE  85          HG22      ILE  85  86.858   8.689  -8.558
  674   HG23  ILE  85          HG23      ILE  85  86.942   9.969  -7.348
  675   HD11  ILE  85          HD11      ILE  85  86.350   5.163  -7.994
  676   HD12  ILE  85          HD12      ILE  85  86.928   6.657  -8.730
  677   HD13  ILE  85          HD13      ILE  85  85.368   6.624  -7.907
  678    H    LYS  86           H        LYS  86  88.361   9.577  -9.166
  679    HA   LYS  86           HA       LYS  86  90.304  11.667  -8.417
  680    HB2  LYS  86           HB2      LYS  86  90.364  10.641 -10.729
  681    HB3  LYS  86           HB3      LYS  86  88.812  11.422 -11.029
  682    HG2  LYS  86           HG2      LYS  86  89.766  13.613 -10.629
  683    HG3  LYS  86           HG3      LYS  86  91.294  12.899 -10.114
  684    HD2  LYS  86           HD2      LYS  86  91.602  11.939 -12.374
  685    HD3  LYS  86           HD3      LYS  86  90.086  12.679 -12.887
  686    HE2  LYS  86           HE2      LYS  86  91.854  14.149 -13.593
  687    HE3  LYS  86           HE3      LYS  86  91.063  14.918 -12.217
  688    HZ1  LYS  86           HZ1      LYS  86  92.838  13.707 -10.848
  689    HZ2  LYS  86           HZ2      LYS  86  93.302  15.088 -11.720
  690    HZ3  LYS  86           HZ3      LYS  86  93.669  13.539 -12.316
  691    H    LYS  87           H        LYS  87  87.095  11.659 -10.022
  692    HA   LYS  87           HA       LYS  87  86.527  14.274  -8.902
  693    HB2  LYS  87           HB2      LYS  87  84.476  12.648 -10.356
  694    HB3  LYS  87           HB3      LYS  87  84.768  14.385 -10.404
  695    HG2  LYS  87           HG2      LYS  87  87.016  13.817 -11.507
  696    HG3  LYS  87           HG3      LYS  87  86.367  12.193 -11.732
  697    HD2  LYS  87           HD2      LYS  87  84.353  13.284 -12.847
  698    HD3  LYS  87           HD3      LYS  87  85.276  14.787 -12.843
  699    HE2  LYS  87           HE2      LYS  87  87.038  13.767 -14.174
  700    HE3  LYS  87           HE3      LYS  87  86.247  12.194 -14.080
  701    HZ1  LYS  87           HZ1      LYS  87  85.801  14.254 -15.925
  702    HZ2  LYS  87           HZ2      LYS  87  84.381  14.050 -15.015
  703    HZ3  LYS  87           HZ3      LYS  87  85.056  12.731 -15.848
  704    H    LYS  88           H        LYS  88  84.464  14.725  -7.806
  705    HA   LYS  88           HA       LYS  88  84.146  13.032  -5.525
  706    HB2  LYS  88           HB2      LYS  88  83.829  15.551  -5.573
  707    HB3  LYS  88           HB3      LYS  88  82.287  15.255  -6.377
  708    HG2  LYS  88           HG2      LYS  88  81.689  13.720  -4.449
  709    HG3  LYS  88           HG3      LYS  88  83.134  14.307  -3.627
  710    HD2  LYS  88           HD2      LYS  88  81.589  15.810  -2.787
  711    HD3  LYS  88           HD3      LYS  88  82.082  16.685  -4.236
  712    HE2  LYS  88           HE2      LYS  88  80.162  15.433  -5.424
  713    HE3  LYS  88           HE3      LYS  88  79.591  15.034  -3.804
  714    HZ1  LYS  88           HZ1      LYS  88  79.702  17.466  -3.317
  715    HZ2  LYS  88           HZ2      LYS  88  78.520  17.023  -4.454
  716    HZ3  LYS  88           HZ3      LYS  88  79.975  17.733  -4.969
  717    H    THR  89           H        THR  89  81.960  13.895  -8.220
  718    HA   THR  89           HA       THR  89  79.803  12.301  -7.540
  719    HB   THR  89           HB       THR  89  79.280  12.223  -9.955
  720    HG1  THR  89           HG1      THR  89  80.816  13.355 -11.312
  721   HG21  THR  89          HG21      THR  89  78.688  14.219  -8.689
  722   HG22  THR  89          HG22      THR  89  79.242  14.696 -10.293
  723   HG23  THR  89          HG23      THR  89  80.313  14.870  -8.902
  724    H    GLU  90           H        GLU  90  82.919  11.372  -8.775
  725    HA   GLU  90           HA       GLU  90  82.179   8.765  -9.674
  726    HB2  GLU  90           HB2      GLU  90  84.799  10.053  -8.922
  727    HB3  GLU  90           HB3      GLU  90  84.703   8.338  -9.311
  728    HG2  GLU  90           HG2      GLU  90  83.692   8.885 -11.491
  729    HG3  GLU  90           HG3      GLU  90  83.793  10.601 -11.106
  730    H    ARG  91           H        ARG  91  83.272  10.144  -6.620
  731    HA   ARG  91           HA       ARG  91  83.431   7.597  -5.266
  732    HB2  ARG  91           HB2      ARG  91  83.327  10.417  -4.152
  733    HB3  ARG  91           HB3      ARG  91  83.732   8.964  -3.237
  734    HG2  ARG  91           HG2      ARG  91  85.581   8.576  -4.953
  735    HG3  ARG  91           HG3      ARG  91  85.284  10.223  -5.504
  736    HD2  ARG  91           HD2      ARG  91  85.459  10.437  -2.710
  737    HD3  ARG  91           HD3      ARG  91  86.733   9.304  -3.149
  738    HE   ARG  91           HE       ARG  91  87.806  11.015  -4.353
  739   HH11  ARG  91          HH21      ARG  91  84.705  12.002  -3.143
  740   HH12  ARG  91          HH22      ARG  91  84.984  13.686  -3.434
  741   HH21  ARG  91          HH11      ARG  91  88.160  13.218  -4.735
  742   HH22  ARG  91          HH12      ARG  91  86.932  14.373  -4.334
  743    H    GLU  92           H        GLU  92  81.162  10.346  -5.267
  744    HA   GLU  92           HA       GLU  92  79.325   9.283  -3.419
  745    HB2  GLU  92           HB2      GLU  92  79.417  11.661  -4.360
  746    HB3  GLU  92           HB3      GLU  92  78.571  11.023  -5.771
  747    HG2  GLU  92           HG2      GLU  92  76.801  10.133  -4.224
  748    HG3  GLU  92           HG3      GLU  92  77.609  10.968  -2.897
  749    H    ASP  93           H        ASP  93  79.267   9.224  -6.995
  750    HA   ASP  93           HA       ASP  93  76.987   7.607  -7.274
  751    HB2  ASP  93           HB2      ASP  93  79.427   7.792  -9.062
  752    HB3  ASP  93           HB1      ASP  93  77.884   7.074  -9.521
  753    H    LEU  94           H        LEU  94  80.434   6.696  -7.269
  754    HA   LEU  94           HA       LEU  94  80.144   3.933  -7.481
  755    HB2  LEU  94           HB2      LEU  94  82.334   4.981  -7.638
  756    HB3  LEU  94           HB3      LEU  94  82.210   5.549  -5.975
  757    HG   LEU  94           HG       LEU  94  82.264   3.293  -5.120
  758   HD11  LEU  94          HD11      LEU  94  82.706   1.449  -6.912
  759   HD12  LEU  94          HD12      LEU  94  81.968   2.596  -8.030
  760   HD13  LEU  94          HD13      LEU  94  81.052   1.995  -6.648
  761   HD21  LEU  94          HD21      LEU  94  84.409   4.527  -6.078
  762   HD22  LEU  94          HD22      LEU  94  84.395   3.189  -7.226
  763   HD23  LEU  94          HD23      LEU  94  84.511   2.867  -5.499
  764    H    ILE  95           H        ILE  95  80.032   6.039  -4.660
  765    HA   ILE  95           HA       ILE  95  79.819   3.901  -2.782
  766    HB   ILE  95           HB       ILE  95  79.412   6.880  -2.600
  767   HG12  ILE  95          HG12      ILE  95  81.386   5.086  -1.179
  768   HG13  ILE  95          HG13      ILE  95  81.682   5.683  -2.810
  769   HG21  ILE  95          HG21      ILE  95  78.768   4.710  -0.623
  770   HG22  ILE  95          HG22      ILE  95  77.915   6.221  -0.933
  771   HG23  ILE  95          HG23      ILE  95  79.429   6.234  -0.030
  772   HD11  ILE  95          HD11      ILE  95  82.666   7.095  -0.939
  773   HD12  ILE  95          HD12      ILE  95  81.011   7.517  -0.510
  774   HD13  ILE  95          HD13      ILE  95  81.651   7.955  -2.092
  775    H    ALA  96           H        ALA  96  77.581   5.781  -4.670
  776    HA   ALA  96           HA       ALA  96  75.230   5.201  -3.184
  777    HB1  ALA  96           HB1      ALA  96  75.452   5.728  -6.156
  778    HB2  ALA  96           HB2      ALA  96  75.439   6.995  -4.929
  779    HB3  ALA  96           HB3      ALA  96  74.029   5.955  -5.138
  780    H    TYR  97           H        TYR  97  77.028   3.553  -5.710
  781    HA   TYR  97           HA       TYR  97  75.059   1.518  -6.173
  782    HB2  TYR  97           HB2      TYR  97  76.654   1.942  -7.924
  783    HB3  TYR  97           HB3      TYR  97  78.009   1.690  -6.825
  784    HD1  TYR  97           HD1      TYR  97  75.122  -0.008  -8.456
  785    HD2  TYR  97           HD2      TYR  97  78.847  -0.496  -6.377
  786    HE1  TYR  97           HE1      TYR  97  75.090  -2.432  -8.971
  787    HE2  TYR  97           HE2      TYR  97  78.816  -2.921  -6.891
  788    HH   TYR  97           HH       TYR  97  76.023  -4.439  -8.418
  789    H    LEU  98           H        LEU  98  77.888   1.914  -4.114
  790    HA   LEU  98           HA       LEU  98  78.157  -0.707  -3.170
  791    HB2  LEU  98           HB2      LEU  98  78.805   2.001  -2.052
  792    HB3  LEU  98           HB3      LEU  98  79.009   0.573  -1.044
  793    HG   LEU  98           HG       LEU  98  80.182   0.633  -3.821
  794   HD11  LEU  98          HD11      LEU  98  81.476   2.383  -3.210
  795   HD12  LEU  98          HD12      LEU  98  82.286   1.246  -2.137
  796   HD13  LEU  98          HD13      LEU  98  80.990   2.269  -1.520
  797   HD21  LEU  98          HD21      LEU  98  81.790  -0.919  -2.750
  798   HD22  LEU  98          HD22      LEU  98  80.133  -1.490  -2.565
  799   HD23  LEU  98          HD23      LEU  98  80.951  -0.711  -1.213
  800    H    LYS  99           H        LYS  99  76.268   2.025  -1.912
  801    HA   LYS  99           HA       LYS  99  75.200   0.805   0.355
  802    HB2  LYS  99           HB2      LYS  99  74.145   2.976  -1.450
  803    HB3  LYS  99           HB3      LYS  99  73.288   2.466   0.004
  804    HG2  LYS  99           HG2      LYS  99  75.435   2.880   1.292
  805    HG3  LYS  99           HG3      LYS  99  76.083   3.626  -0.168
  806    HD2  LYS  99           HD2      LYS  99  73.460   4.507   1.056
  807    HD3  LYS  99           HD3      LYS  99  75.003   5.206   1.546
  808    HE2  LYS  99           HE2      LYS  99  75.438   5.724  -0.893
  809    HE3  LYS  99           HE3      LYS  99  73.775   5.239  -1.223
  810    HZ1  LYS  99           HZ1      LYS  99  74.261   7.180   0.916
  811    HZ2  LYS  99           HZ2      LYS  99  72.930   7.030  -0.129
  812    HZ3  LYS  99           HZ3      LYS  99  74.380   7.714  -0.689
  813    H    LYS 100           H        LYS 100  73.683   1.118  -2.865
  814    HA   LYS 100           HA       LYS 100  71.466  -0.550  -2.201
  815    HB2  LYS 100           HB2      LYS 100  72.582   0.418  -4.834
  816    HB3  LYS 100           HB3      LYS 100  71.119  -0.558  -4.709
  817    HG2  LYS 100           HG2      LYS 100  70.098   1.134  -3.243
  818    HG3  LYS 100           HG3      LYS 100  71.565   2.109  -3.337
  819    HD2  LYS 100           HD2      LYS 100  71.246   2.577  -5.638
  820    HD3  LYS 100           HD3      LYS 100  70.067   1.277  -5.823
  821    HE2  LYS 100           HE2      LYS 100  69.567   3.613  -3.975
  822    HE3  LYS 100           HE3      LYS 100  69.143   3.678  -5.686
  823    HZ1  LYS 100           HZ1      LYS 100  67.895   1.562  -5.312
  824    HZ2  LYS 100           HZ2      LYS 100  67.247   2.921  -4.525
  825    HZ3  LYS 100           HZ3      LYS 100  68.141   1.774  -3.648
  826    H    ALA 101           H        ALA 101  74.676  -1.191  -3.378
  827    HA   ALA 101           HA       ALA 101  74.016  -3.872  -4.296
  828    HB1  ALA 101           HB1      ALA 101  76.437  -4.037  -4.760
  829    HB2  ALA 101           HB2      ALA 101  76.674  -2.455  -4.016
  830    HB3  ALA 101           HB3      ALA 101  75.720  -2.601  -5.492
  831    H    THR 102           H        THR 102  75.091  -2.343  -1.396
  832    HA   THR 102           HA       THR 102  76.070  -4.863  -0.253
  833    HB   THR 102           HB       THR 102  76.635  -3.401   1.714
  834    HG1  THR 102           HG1      THR 102  75.195  -1.663   0.168
  835   HG21  THR 102          HG21      THR 102  78.459  -3.753   0.298
  836   HG22  THR 102          HG22      THR 102  78.339  -1.994   0.301
  837   HG23  THR 102          HG23      THR 102  77.697  -2.919  -1.057
  838    H    ASN 103           H        ASN 103  73.180  -3.527  -0.776
  839    HA   ASN 103           HA       ASN 103  72.027  -4.214   1.850
  840    HB2  ASN 103           HB2      ASN 103  71.087  -2.561  -0.480
  841    HB3  ASN 103           HB1      ASN 103  69.948  -3.157   0.723
  842   HD21  ASN 103          HD21      ASN 103  73.247  -2.360   1.653
  843   HD22  ASN 103          HD22      ASN 103  72.850  -0.964   2.531
  844    H    GLU 104           H        GLU 104  72.255  -5.217  -1.448
  845    HA   GLU 104           HA       GLU 104  70.560  -7.554  -0.841
  846    HB2  GLU 104           HB2      GLU 104  69.713  -7.380  -3.246
  847    HB3  GLU 104           HB3      GLU 104  69.057  -6.212  -2.098
  848    HG2  GLU 104           HG2      GLU 104  70.419  -4.463  -2.920
  849    HG3  GLU 104           HG3      GLU 104  71.495  -5.578  -3.759
  850    HHA  HEC 201           HA       HEC 105  89.304  -3.397   3.204
  851    HHB  HEC 201           HB       HEC 105  85.453   0.022  -0.471
  852    HHC  HEC 201           HC       HEC 105  88.753  -1.782  -5.563
  853    HHD  HEC 201           HD       HEC 105  92.105  -5.750  -1.958
  854   HMA1  HEC 201          HMA1      HEC 105  85.699   0.899   2.414
  855   HMA2  HEC 201          HMA2      HEC 105  84.955  -0.495   3.196
  856   HMA3  HEC 201          HMA3      HEC 105  84.569  -0.117   1.522
  857   HAA1  HEC 201          HAA1      HEC 105  86.750  -0.911   4.472
  858   HAA2  HEC 201          HAA2      HEC 105  88.335  -1.660   4.443
  859   HBA1  HEC 201          HBA1      HEC 105  87.414  -3.848   4.465
  860   HBA2  HEC 201          HBA2      HEC 105  85.796  -3.252   4.109
  861   HMB1  HEC 201          HMB1      HEC 105  84.786   1.247  -3.965
  862   HMB2  HEC 201          HMB2      HEC 105  84.863   1.334  -2.209
  863   HMB3  HEC 201          HMB3      HEC 105  83.999   0.013  -2.992
  864    HAB  HEC 201           HAB      HEC 105  87.259  -0.588  -6.234
  865   HBB1  HEC 201          HBB1      HEC 105  86.604   1.997  -4.856
  866   HBB2  HEC 201          HBB2      HEC 105  87.921   1.628  -5.964
  867   HBB3  HEC 201          HBB3      HEC 105  86.283   1.832  -6.581
  868   HMC1  HEC 201          HMC1      HEC 105  90.963  -2.499  -6.681
  869   HMC2  HEC 201          HMC2      HEC 105  89.688  -3.692  -6.914
  870   HMC3  HEC 201          HMC3      HEC 105  91.373  -4.204  -6.861
  871    HAC  HEC 201           HAC      HEC 105  92.524  -6.213  -3.890
  872   HBC1  HEC 201          HBC1      HEC 105  94.302  -5.408  -5.023
  873   HBC2  HEC 201          HBC2      HEC 105  93.371  -3.971  -5.442
  874   HBC3  HEC 201          HBC3      HEC 105  93.356  -5.374  -6.509
  875   HMD1  HEC 201          HMD1      HEC 105  93.222  -6.449   1.546
  876   HMD2  HEC 201          HMD2      HEC 105  93.324  -6.277  -0.202
  877   HMD3  HEC 201          HMD3      HEC 105  92.210  -7.448   0.504
  878   HAD1  HEC 201          HAD1      HEC 105  91.842  -6.195   3.221
  879   HAD2  HEC 201          HAD2      HEC 105  90.348  -5.423   3.714
  880   HBD1  HEC 201          HBD1      HEC 105  91.526  -3.262   3.901
  881   HBD2  HEC 201          HBD2      HEC 105  93.029  -4.050   3.430
  882    H1   HOH 301           H2       HOH 200  83.804   2.881  -1.301
  883    H2   HOH 301           H1       HOH 200  82.720   2.222  -0.478
  884    H1   HOH 302           H2       HOH 201  86.953   5.567   5.648
  885    H2   HOH 302           H1       HOH 201  85.765   4.804   6.194
  886    H1   HOH 303           H2       HOH 202  83.315  -6.502   5.549
  887    H2   HOH 303           H1       HOH 202  82.835  -5.070   5.648
  888    H1   HOH 304           H2       HOH 203  80.433 -10.493   0.006
  889    H2   HOH 304           H1       HOH 203  81.619 -11.376   0.329