*HEADER    CELL CYCLE                              25-AUG-16   5LSD              
*TITLE     RECOMBINANT MOUSE NERVE GROWTH FACTOR                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BETA-NERVE GROWTH FACTOR;                                  
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 SYNONYM: BETA-NGF;                                                   
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 OTHER_DETAILS: NGF IS A HOMODIMER                                    
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE   3 ORGANISM_COMMON: MOUSE;                                              
*SOURCE   4 ORGANISM_TAXID: 10090;                                               
*SOURCE   5 GENE: NGF, NGFB;                                                     
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    NGF, HOMODIMER, CYSTIN-KNOT, DIMERFIT_1, CELL CYCLE                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    F.PAOLETTI,C.DE CHIARA,G.KELLY,D.LAMBA,A.CATTANEO,A.PASTORE           
*REVDAT   1   05-JUL-17 5LSD    0                                                
# Restraints file 1: NGF_unambig.tbl
assign (segid "   A" and resid   42 and name HG12) (segid "   A" and resid   42 and name HG22) 1.555 1.555 4.445 weight 1.000 ! spec=13Cn...5deg, no=5, id=3383, vol=1.789000e+05
    or (segid "   A" and resid   42 and name HG12) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   42 and name HG12) (segid "   A" and resid   42 and name HG23)
    or (segid "   A" and resid   42 and name HG11) (segid "   A" and resid   42 and name HG22)
    or (segid "   A" and resid   42 and name HG11) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   42 and name HG11) (segid "   A" and resid   42 and name HG23)
    or (segid "   A" and resid   42 and name HG13) (segid "   A" and resid   42 and name HG22)
    or (segid "   A" and resid   42 and name HG13) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   42 and name HG13) (segid "   A" and resid   42 and name HG23)
assign (segid "   B" and resid   42 and name HG12) (segid "   B" and resid   42 and name HG22) 1.555 1.555 4.445 weight 1.000 ! spec=13Cn...5deg, no=5, id=3383, vol=1.789000e+05
    or (segid "   B" and resid   42 and name HG12) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   42 and name HG12) (segid "   B" and resid   42 and name HG23)
    or (segid "   B" and resid   42 and name HG11) (segid "   B" and resid   42 and name HG22)
    or (segid "   B" and resid   42 and name HG11) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   42 and name HG11) (segid "   B" and resid   42 and name HG23)
    or (segid "   B" and resid   42 and name HG13) (segid "   B" and resid   42 and name HG22)
    or (segid "   B" and resid   42 and name HG13) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   42 and name HG13) (segid "   B" and resid   42 and name HG23)
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    6 and name HG22) 3.333 1.388 1.388 weight 1.000 ! spec=13Cn...5deg, no=15, id=3392, vol=2.606000e+04
    or (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    6 and name HG23)
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    6 and name HG22) 3.333 1.388 1.388 weight 1.000 ! spec=13Cn...5deg, no=15, id=3392, vol=2.606000e+04
    or (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    6 and name HG23)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    6 and name HG22) 1.036 1.036 4.964 weight 1.000 ! spec=13Cn...5deg, no=16, id=3393, vol=2.653000e+06
    or (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    6 and name HG23)
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    6 and name HG22)
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    6 and name HG23)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    6 and name HG22)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    6 and name HG23)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    6 and name HG22) 1.036 1.036 4.964 weight 1.000 ! spec=13Cn...5deg, no=16, id=3393, vol=2.653000e+06
    or (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    6 and name HG23)
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    6 and name HG22)
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    6 and name HG23)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    6 and name HG22)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    6 and name HG23)
assign (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    6 and name   HB) 1.759 0.387 0.387 weight 1.000 ! spec=13Cn...5deg, no=17, id=3394, vol=1.327000e+05
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    6 and name   HB)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    6 and name   HB)
assign (segid "   B" and resid    6 and name HG22) (segid "   B" and resid    6 and name   HB) 1.759 0.387 0.387 weight 1.000 ! spec=13Cn...5deg, no=17, id=3394, vol=1.327000e+05
    or (segid "   B" and resid    6 and name HG21) (segid "   B" and resid    6 and name   HB)
    or (segid "   B" and resid    6 and name HG23) (segid "   B" and resid    6 and name   HB)
assign (segid "   A" and resid   48 and name   HB) (segid "   A" and resid   48 and name HG12) 1.707 0.364 0.364 weight 1.000 ! spec=13Cn...5deg, no=20, id=3396, vol=2.178000e+05
    or (segid "   A" and resid   48 and name   HB) (segid "   A" and resid   48 and name HG11)
    or (segid "   A" and resid   48 and name   HB) (segid "   A" and resid   48 and name HG13)
assign (segid "   B" and resid   48 and name   HB) (segid "   B" and resid   48 and name HG12) 1.707 0.364 0.364 weight 1.000 ! spec=13Cn...5deg, no=20, id=3396, vol=2.178000e+05
    or (segid "   B" and resid   48 and name   HB) (segid "   B" and resid   48 and name HG11)
    or (segid "   B" and resid   48 and name   HB) (segid "   B" and resid   48 and name HG13)
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HG12) 2.644 0.874 0.874 weight 1.000 ! spec=13Cn...5deg, no=21, id=3397, vol=5.110000e+04
    or (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HG11)
    or (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HG13)
assign (segid "   B" and resid   48 and name   HA) (segid "   B" and resid   48 and name HG12) 2.644 0.874 0.874 weight 1.000 ! spec=13Cn...5deg, no=21, id=3397, vol=5.110000e+04
    or (segid "   B" and resid   48 and name   HA) (segid "   B" and resid   48 and name HG11)
    or (segid "   B" and resid   48 and name   HA) (segid "   B" and resid   48 and name HG13)
assign (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   96 and name   HN) 4.671 2.727 2.727 weight 1.000 ! spec=13Cn...5deg, no=35, id=3410, vol=2.950000e+04
assign (segid "   B" and resid   95 and name  HG2) (segid "   B" and resid   96 and name   HN) 4.671 2.727 2.727 weight 1.000 ! spec=13Cn...5deg, no=35, id=3410, vol=2.950000e+04
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   63 and name   HA) 4.435 2.458 2.458 weight 1.000 ! spec=13Cn...5deg, no=58, id=3427, vol=3.613000e+04
assign (segid "   B" and resid   63 and name  HG2) (segid "   B" and resid   63 and name   HA) 4.435 2.458 2.458 weight 1.000 ! spec=13Cn...5deg, no=58, id=3427, vol=3.613000e+04
assign (segid "   A" and resid   63 and name  HD2) (segid "   A" and resid   63 and name   HA) 3.100 1.201 1.201 weight 1.000 ! spec=13Cn...5deg, no=59, id=3428, vol=7.272000e+04
assign (segid "   B" and resid   63 and name  HD2) (segid "   B" and resid   63 and name   HA) 3.100 1.201 1.201 weight 1.000 ! spec=13Cn...5deg, no=59, id=3428, vol=7.272000e+04
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG22) 2.186 0.597 0.597 weight 1.000 ! spec=13Cn...5deg, no=94, id=3452, vol=3.954000e+04
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG23)
assign (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   14 and name HG22) 2.186 0.597 0.597 weight 1.000 ! spec=13Cn...5deg, no=94, id=3452, vol=3.954000e+04
    or (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   14 and name HG21)
    or (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   14 and name HG23)
assign (segid "   A" and resid  118 and name  HD1) (segid "   A" and resid  118 and name  HD2) 1.608 0.323 0.323 weight 1.000 ! spec=13Cn...5deg, no=101, id=3458, vol=3.098000e+05
assign (segid "   B" and resid  118 and name  HD1) (segid "   B" and resid  118 and name  HD2) 1.608 0.323 0.323 weight 1.000 ! spec=13Cn...5deg, no=101, id=3458, vol=3.098000e+05
assign (segid "   A" and resid  118 and name  HD1) (segid "   A" and resid  118 and name  HB1) 4.667 2.722 2.722 weight 1.000 ! spec=13Cn...5deg, no=103, id=3459, vol=8.988000e+03
assign (segid "   B" and resid  118 and name  HD1) (segid "   B" and resid  118 and name  HB1) 4.667 2.722 2.722 weight 1.000 ! spec=13Cn...5deg, no=103, id=3459, vol=8.988000e+03
assign (segid "   A" and resid  118 and name  HD1) (segid "   A" and resid  118 and name   HA) 6.801 5.782 5.782 weight 1.000 ! spec=13Cn...5deg, no=104, id=3460, vol=4.290000e+03
assign (segid "   B" and resid  118 and name  HD1) (segid "   B" and resid  118 and name   HA) 6.801 5.782 5.782 weight 1.000 ! spec=13Cn...5deg, no=104, id=3460, vol=4.290000e+03
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   69 and name   HN) 4.805 2.886 2.886 weight 1.000 ! spec=13Cn...5deg, no=131, id=3482, vol=4.682000e+03
assign (segid "   B" and resid   14 and name   HA) (segid "   B" and resid   69 and name   HN) 4.805 2.886 2.886 weight 1.000 ! spec=13Cn...5deg, no=131, id=3482, vol=4.682000e+03
assign (segid "   A" and resid   14 and name HG12) (segid "   A" and resid   14 and name HG22) 1.321 1.321 4.679 weight 1.000 ! spec=13Cn...5deg, no=134, id=3485, vol=6.983000e+05
    or (segid "   A" and resid   14 and name HG12) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name HG12) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid   14 and name HG23)
assign (segid "   B" and resid   14 and name HG12) (segid "   B" and resid   14 and name HG22) 1.321 1.321 4.679 weight 1.000 ! spec=13Cn...5deg, no=134, id=3485, vol=6.983000e+05
    or (segid "   B" and resid   14 and name HG12) (segid "   B" and resid   14 and name HG21)
    or (segid "   B" and resid   14 and name HG12) (segid "   B" and resid   14 and name HG23)
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid   14 and name HG22)
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid   14 and name HG21)
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid   14 and name HG23)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid   14 and name HG22)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid   14 and name HG21)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid   14 and name HG23)
assign (segid "   A" and resid   14 and name HG12) (segid "   A" and resid   14 and name   HA) 2.351 0.691 0.691 weight 1.000 ! spec=13Cn...5deg, no=135, id=3486, vol=1.382000e+05
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid   14 and name   HA)
assign (segid "   B" and resid   14 and name HG12) (segid "   B" and resid   14 and name   HA) 2.351 0.691 0.691 weight 1.000 ! spec=13Cn...5deg, no=135, id=3486, vol=1.382000e+05
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid   14 and name   HA)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid   14 and name   HA)
assign (segid "   A" and resid  115 and name   HA) (segid "   A" and resid  115 and name  HB1) 3.552 1.577 1.577 weight 1.000 ! spec=13Cn...5deg, no=140, id=3490, vol=1.427000e+04
assign (segid "   B" and resid  115 and name   HA) (segid "   B" and resid  115 and name  HB1) 3.552 1.577 1.577 weight 1.000 ! spec=13Cn...5deg, no=140, id=3490, vol=1.427000e+04
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   29 and name   HB) 4.503 2.535 2.535 weight 1.000 ! spec=13Cn...5deg, no=158, id=3500, vol=2.886000e+04
assign (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   29 and name   HB) 4.503 2.535 2.535 weight 1.000 ! spec=13Cn...5deg, no=158, id=3500, vol=2.886000e+04
assign (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  101 and name   HA) 3.705 1.716 1.716 weight 1.000 ! spec=13Cn...5deg, no=179, id=3515, vol=9.022000e+03
assign (segid "   B" and resid  101 and name  HB1) (segid "   B" and resid  101 and name   HA) 3.705 1.716 1.716 weight 1.000 ! spec=13Cn...5deg, no=179, id=3515, vol=9.022000e+03
assign (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  101 and name   HZ) 4.918 3.023 3.023 weight 1.000 ! spec=13Cn...5deg, no=183, id=3519, vol=1.319000e+04
assign (segid "   B" and resid  101 and name  HB1) (segid "   B" and resid  101 and name   HZ) 4.918 3.023 3.023 weight 1.000 ! spec=13Cn...5deg, no=183, id=3519, vol=1.319000e+04
assign (segid "   A" and resid   16 and name  HB1) (segid "   A" and resid   16 and name   HA) 3.696 1.708 1.708 weight 1.000 ! spec=13Cn...5deg, no=189, id=3524, vol=1.527000e+04
assign (segid "   B" and resid   16 and name  HB1) (segid "   B" and resid   16 and name   HA) 3.696 1.708 1.708 weight 1.000 ! spec=13Cn...5deg, no=189, id=3524, vol=1.527000e+04
assign (segid "   A" and resid  104 and name HG11) (segid "   A" and resid  104 and name   HA) 4.287 2.297 2.297 weight 1.000 ! spec=13Cn...5deg, no=191, id=3526, vol=1.088000e+04
assign (segid "   B" and resid  104 and name HG11) (segid "   B" and resid  104 and name   HA) 4.287 2.297 2.297 weight 1.000 ! spec=13Cn...5deg, no=191, id=3526, vol=1.088000e+04
assign (segid "   A" and resid  104 and name   HA) (segid "   A" and resid  104 and name HG12) 4.235 2.242 2.242 weight 1.000 ! spec=13Cn...5deg, no=193, id=3528, vol=1.305000e+04
assign (segid "   B" and resid  104 and name   HA) (segid "   B" and resid  104 and name HG12) 4.235 2.242 2.242 weight 1.000 ! spec=13Cn...5deg, no=193, id=3528, vol=1.305000e+04
assign (segid "   A" and resid   74 and name  HE1) (segid "   A" and resid   74 and name  HB2) 2.354 0.693 0.693 weight 1.000 ! spec=13Cn...5deg, no=210, id=3542, vol=2.458000e+05
assign (segid "   B" and resid   74 and name  HE1) (segid "   B" and resid   74 and name  HB2) 2.354 0.693 0.693 weight 1.000 ! spec=13Cn...5deg, no=210, id=3542, vol=2.458000e+05
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name  HB1) 1.572 0.309 0.309 weight 1.000 ! spec=13Cn...5deg, no=219, id=3550, vol=5.534000e+05
assign (segid "   B" and resid   96 and name  HB2) (segid "   B" and resid   96 and name  HB1) 1.572 0.309 0.309 weight 1.000 ! spec=13Cn...5deg, no=219, id=3550, vol=5.534000e+05
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   63 and name  HB2) 6.206 4.815 4.815 weight 1.000 ! spec=13Cn...5deg, no=227, id=3557, vol=8.556000e+03
assign (segid "   B" and resid   62 and name   HA) (segid "   B" and resid   63 and name  HB2) 6.206 4.815 4.815 weight 1.000 ! spec=13Cn...5deg, no=227, id=3557, vol=8.556000e+03
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name   HN) 4.047 2.047 2.047 weight 1.000 ! spec=13Cn...5deg, no=233, id=3558, vol=6.637000e+03
assign (segid "   B" and resid   99 and name   HA) (segid "   B" and resid   99 and name   HN) 4.047 2.047 2.047 weight 1.000 ! spec=13Cn...5deg, no=233, id=3558, vol=6.637000e+03
assign (segid "   A" and resid   34 and name  HD2) (segid "   A" and resid   34 and name  HB2) 1.704 1.704 4.296 weight 1.000 ! spec=13Cn...5deg, no=243, id=3568, vol=1.594000e+06
assign (segid "   B" and resid   34 and name  HD2) (segid "   B" and resid   34 and name  HB2) 1.704 1.704 4.296 weight 1.000 ! spec=13Cn...5deg, no=243, id=3568, vol=1.594000e+06
assign (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   32 and name  HG2) 1.540 0.296 0.296 weight 1.000 ! spec=13Cn...5deg, no=252, id=3577, vol=2.331000e+05
assign (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name  HG2) 1.540 0.296 0.296 weight 1.000 ! spec=13Cn...5deg, no=252, id=3577, vol=2.331000e+05
assign (segid "   A" and resid    5 and name  HG2) (segid "   A" and resid    7 and name  HD1) 6.562 5.383 5.383 weight 1.000 ! spec=13Cn...5deg, no=256, id=3581, vol=7.443000e+03
assign (segid "   B" and resid    5 and name  HG2) (segid "   B" and resid    7 and name  HD1) 6.562 5.383 5.383 weight 1.000 ! spec=13Cn...5deg, no=256, id=3581, vol=7.443000e+03
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name  HG2) 1.642 0.337 0.337 weight 1.000 ! spec=13Cn...5deg, no=257, id=3582, vol=3.178000e+05
assign (segid "   B" and resid    5 and name  HG1) (segid "   B" and resid    5 and name  HG2) 1.642 0.337 0.337 weight 1.000 ! spec=13Cn...5deg, no=257, id=3582, vol=3.178000e+05
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name  HG1) 2.300 0.661 0.661 weight 1.000 ! spec=13Cn...5deg, no=270, id=3595, vol=1.098000e+05
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   34 and name  HG1) 2.300 0.661 0.661 weight 1.000 ! spec=13Cn...5deg, no=270, id=3595, vol=1.098000e+05
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   52 and name   HN) 3.491 1.524 1.524 weight 1.000 ! spec=13Cn...5deg, no=277, id=3601, vol=1.241000e+04
assign (segid "   B" and resid   52 and name   HA) (segid "   B" and resid   52 and name   HN) 3.491 1.524 1.524 weight 1.000 ! spec=13Cn...5deg, no=277, id=3601, vol=1.241000e+04
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name HE21) 4.565 2.605 2.605 weight 1.000 ! spec=13Cn...5deg, no=280, id=3604, vol=1.570000e+04
assign (segid "   B" and resid   51 and name   HA) (segid "   B" and resid   51 and name HE21) 4.565 2.605 2.605 weight 1.000 ! spec=13Cn...5deg, no=280, id=3604, vol=1.570000e+04
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name  HG1) 5.447 3.708 3.708 weight 1.000 ! spec=13Cn...5deg, no=283, id=3606, vol=7.795000e+03
assign (segid "   B" and resid   51 and name   HA) (segid "   B" and resid   51 and name  HG1) 5.447 3.708 3.708 weight 1.000 ! spec=13Cn...5deg, no=283, id=3606, vol=7.795000e+03
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   25 and name  HD2) 1.506 0.283 0.283 weight 1.000 ! spec=13Cn...5deg, no=285, id=3608, vol=2.560000e+05
assign (segid "   B" and resid   25 and name  HD1) (segid "   B" and resid   25 and name  HD2) 1.506 0.283 0.283 weight 1.000 ! spec=13Cn...5deg, no=285, id=3608, vol=2.560000e+05
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   25 and name  HG2) 1.959 0.480 0.480 weight 1.000 ! spec=13Cn...5deg, no=286, id=3609, vol=3.466000e+05
assign (segid "   B" and resid   25 and name  HD1) (segid "   B" and resid   25 and name  HG2) 1.959 0.480 0.480 weight 1.000 ! spec=13Cn...5deg, no=286, id=3609, vol=3.466000e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HD1) 3.212 1.289 1.289 weight 1.000 ! spec=13Cn...5deg, no=288, id=3611, vol=1.429000e+04
assign (segid "   B" and resid   25 and name  HE2) (segid "   B" and resid   25 and name  HD1) 3.212 1.289 1.289 weight 1.000 ! spec=13Cn...5deg, no=288, id=3611, vol=1.429000e+04
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   25 and name  HB2) 1.503 1.503 4.497 weight 1.000 ! spec=13Cn...5deg, no=291, id=3613, vol=2.001000e+06
assign (segid "   B" and resid   25 and name  HD1) (segid "   B" and resid   25 and name  HB2) 1.503 1.503 4.497 weight 1.000 ! spec=13Cn...5deg, no=291, id=3613, vol=2.001000e+06
assign (segid "   A" and resid   88 and name  HG1) (segid "   A" and resid   88 and name  HD2) 2.473 0.764 0.764 weight 1.000 ! spec=13Cn...5deg, no=292, id=3614, vol=1.676000e+05
assign (segid "   B" and resid   88 and name  HG1) (segid "   B" and resid   88 and name  HD2) 2.473 0.764 0.764 weight 1.000 ! spec=13Cn...5deg, no=292, id=3614, vol=1.676000e+05
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   88 and name   HA) 4.566 2.606 2.606 weight 1.000 ! spec=13Cn...5deg, no=293, id=3615, vol=3.477000e+04
assign (segid "   B" and resid   88 and name  HD2) (segid "   B" and resid   88 and name   HA) 4.566 2.606 2.606 weight 1.000 ! spec=13Cn...5deg, no=293, id=3615, vol=3.477000e+04
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   88 and name   HN) 5.352 3.581 3.581 weight 1.000 ! spec=13Cn...5deg, no=295, id=3617, vol=1.963000e+04
assign (segid "   B" and resid   88 and name  HD2) (segid "   B" and resid   88 and name   HN) 5.352 3.581 3.581 weight 1.000 ! spec=13Cn...5deg, no=295, id=3617, vol=1.963000e+04
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   76 and name  HD1) 5.645 3.984 3.984 weight 1.000 ! spec=13Cn...5deg, no=341, id=3657, vol=4.727000e+03
assign (segid "   B" and resid   76 and name   HA) (segid "   B" and resid   76 and name  HD1) 5.645 3.984 3.984 weight 1.000 ! spec=13Cn...5deg, no=341, id=3657, vol=4.727000e+03
assign (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   76 and name   HA) 3.749 1.757 1.757 weight 1.000 ! spec=13Cn...5deg, no=344, id=3659, vol=1.613000e+04
assign (segid "   B" and resid   76 and name  HB1) (segid "   B" and resid   76 and name   HA) 3.749 1.757 1.757 weight 1.000 ! spec=13Cn...5deg, no=344, id=3659, vol=1.613000e+04
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name  HB2) 1.593 0.317 0.317 weight 1.000 ! spec=13Cn...5deg, no=350, id=3664, vol=6.174000e+05
assign (segid "   B" and resid    4 and name  HB1) (segid "   B" and resid    4 and name  HB2) 1.593 0.317 0.317 weight 1.000 ! spec=13Cn...5deg, no=350, id=3664, vol=6.174000e+05
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name  HG2) 2.991 1.118 1.118 weight 1.000 ! spec=13Cn...5deg, no=359, id=3671, vol=1.615000e+05
assign (segid "   B" and resid    5 and name  HB2) (segid "   B" and resid    5 and name  HG2) 2.991 1.118 1.118 weight 1.000 ! spec=13Cn...5deg, no=359, id=3671, vol=1.615000e+05
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name  HG1) 3.252 1.322 1.322 weight 1.000 ! spec=13Cn...5deg, no=360, id=3672, vol=2.793000e+04
assign (segid "   B" and resid    5 and name  HB2) (segid "   B" and resid    5 and name  HG1) 3.252 1.322 1.322 weight 1.000 ! spec=13Cn...5deg, no=360, id=3672, vol=2.793000e+04
assign (segid "   A" and resid   26 and name HG21) (segid "   A" and resid   26 and name   HA) 3.120 1.217 1.217 weight 1.000 ! spec=13Cn...5deg, no=368, id=3679, vol=8.317000e+04
    or (segid "   A" and resid   26 and name HG22) (segid "   A" and resid   26 and name   HA)
    or (segid "   A" and resid   26 and name HG23) (segid "   A" and resid   26 and name   HA)
assign (segid "   B" and resid   26 and name HG21) (segid "   B" and resid   26 and name   HA) 3.120 1.217 1.217 weight 1.000 ! spec=13Cn...5deg, no=368, id=3679, vol=8.317000e+04
    or (segid "   B" and resid   26 and name HG22) (segid "   B" and resid   26 and name   HA)
    or (segid "   B" and resid   26 and name HG23) (segid "   B" and resid   26 and name   HA)
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name  HB2) 1.989 0.494 0.494 weight 1.000 ! spec=13Cn...5deg, no=377, id=3687, vol=1.458000e+05
assign (segid "   B" and resid   49 and name  HB1) (segid "   B" and resid   49 and name  HB2) 1.989 0.494 0.494 weight 1.000 ! spec=13Cn...5deg, no=377, id=3687, vol=1.458000e+05
assign (segid "   A" and resid   69 and name  HD2) (segid "   A" and resid   69 and name  HD1) 2.143 0.574 0.574 weight 1.000 ! spec=13Cn...5deg, no=389, id=3698, vol=5.521000e+04
assign (segid "   B" and resid   69 and name  HD2) (segid "   B" and resid   69 and name  HD1) 2.143 0.574 0.574 weight 1.000 ! spec=13Cn...5deg, no=389, id=3698, vol=5.521000e+04
assign (segid "   A" and resid   69 and name  HD2) (segid "   A" and resid   69 and name   HN) 6.988 6.104 6.104 weight 1.000 ! spec=13Cn...5deg, no=392, id=3701, vol=4.312000e+03
assign (segid "   B" and resid   69 and name  HD2) (segid "   B" and resid   69 and name   HN) 6.988 6.104 6.104 weight 1.000 ! spec=13Cn...5deg, no=392, id=3701, vol=4.312000e+03
assign (segid "   A" and resid   95 and name  HD2) (segid "   A" and resid   95 and name  HE2) 2.475 0.766 0.766 weight 1.000 ! spec=13Cn...5deg, no=408, id=3713, vol=1.856000e+05
assign (segid "   B" and resid   95 and name  HD2) (segid "   B" and resid   95 and name  HE2) 2.475 0.766 0.766 weight 1.000 ! spec=13Cn...5deg, no=408, id=3713, vol=1.856000e+05
assign (segid "   A" and resid   95 and name  HD2) (segid "   A" and resid   95 and name  HB1) 1.532 1.532 4.468 weight 1.000 ! spec=13Cn...5deg, no=411, id=3716, vol=1.815000e+06
assign (segid "   B" and resid   95 and name  HD2) (segid "   B" and resid   95 and name  HB1) 1.532 1.532 4.468 weight 1.000 ! spec=13Cn...5deg, no=411, id=3716, vol=1.815000e+06
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid   86 and name  HE1) 5.295 3.505 3.505 weight 1.000 ! spec=13Cn...5deg, no=413, id=3718, vol=1.247000e+04
assign (segid "   B" and resid  103 and name   HA) (segid "   B" and resid   86 and name  HE1) 5.295 3.505 3.505 weight 1.000 ! spec=13Cn...5deg, no=413, id=3718, vol=1.247000e+04
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  103 and name   HA) 3.284 1.348 1.348 weight 1.000 ! spec=13Cn...5deg, no=414, id=3719, vol=1.686000e+04
assign (segid "   B" and resid  103 and name  HB2) (segid "   B" and resid  103 and name   HA) 3.284 1.348 1.348 weight 1.000 ! spec=13Cn...5deg, no=414, id=3719, vol=1.686000e+04
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HB1) 3.896 1.897 1.897 weight 1.000 ! spec=13Cn...5deg, no=418, id=3722, vol=5.793000e+03
assign (segid "   B" and resid  103 and name   HA) (segid "   B" and resid  103 and name  HB1) 3.896 1.897 1.897 weight 1.000 ! spec=13Cn...5deg, no=418, id=3722, vol=5.793000e+03
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HD2) 6.220 4.837 4.837 weight 1.000 ! spec=13Cn...5deg, no=419, id=3723, vol=8.886000e+03
assign (segid "   B" and resid  103 and name   HA) (segid "   B" and resid  103 and name  HD2) 6.220 4.837 4.837 weight 1.000 ! spec=13Cn...5deg, no=419, id=3723, vol=8.886000e+03
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HD1) 5.069 3.212 3.212 weight 1.000 ! spec=13Cn...5deg, no=420, id=3724, vol=2.340000e+04
assign (segid "   B" and resid  103 and name   HA) (segid "   B" and resid  103 and name  HD1) 5.069 3.212 3.212 weight 1.000 ! spec=13Cn...5deg, no=420, id=3724, vol=2.340000e+04
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HG1) 5.362 3.594 3.594 weight 1.000 ! spec=13Cn...5deg, no=421, id=3725, vol=5.681000e+03
assign (segid "   B" and resid  103 and name   HA) (segid "   B" and resid  103 and name  HG1) 5.362 3.594 3.594 weight 1.000 ! spec=13Cn...5deg, no=421, id=3725, vol=5.681000e+03
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   84 and name   HN) 4.630 2.679 2.679 weight 1.000 ! spec=13Cn...5deg, no=445, id=3744, vol=1.218000e+04
assign (segid "   B" and resid   85 and name   HB) (segid "   B" and resid   84 and name   HN) 4.630 2.679 2.679 weight 1.000 ! spec=13Cn...5deg, no=445, id=3744, vol=1.218000e+04
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name   HA) 3.204 1.283 1.283 weight 1.000 ! spec=13Cn...5deg, no=463, id=3760, vol=1.586000e+04
assign (segid "   B" and resid   57 and name  HB1) (segid "   B" and resid   57 and name   HA) 3.204 1.283 1.283 weight 1.000 ! spec=13Cn...5deg, no=463, id=3760, vol=1.586000e+04
assign (segid "   A" and resid   10 and name  HA1) (segid "   A" and resid   12 and name  HE1) 6.880 5.917 5.917 weight 1.000 ! spec=13Cn...5deg, no=473, id=3766, vol=6.034000e+03
assign (segid "   B" and resid   10 and name  HA1) (segid "   B" and resid   12 and name  HE1) 6.880 5.917 5.917 weight 1.000 ! spec=13Cn...5deg, no=473, id=3766, vol=6.034000e+03
assign (segid "   A" and resid   10 and name  HA2) (segid "   A" and resid   10 and name  HA1) 1.474 0.272 0.272 weight 1.000 ! spec=13Cn...5deg, no=476, id=3769, vol=1.047000e+06
assign (segid "   B" and resid   10 and name  HA2) (segid "   B" and resid   10 and name  HA1) 1.474 0.272 0.272 weight 1.000 ! spec=13Cn...5deg, no=476, id=3769, vol=1.047000e+06
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name   HN) 4.743 2.811 2.811 weight 1.000 ! spec=13Cn...5deg, no=504, id=3793, vol=4.557000e+03
assign (segid "   B" and resid    9 and name  HB2) (segid "   B" and resid    9 and name   HN) 4.743 2.811 2.811 weight 1.000 ! spec=13Cn...5deg, no=504, id=3793, vol=4.557000e+03
assign (segid "   A" and resid  115 and name  HE2) (segid "   A" and resid  115 and name   HA) 5.139 3.301 3.301 weight 1.000 ! spec=13Cn...5deg, no=509, id=3798, vol=2.137000e+04
assign (segid "   B" and resid  115 and name  HE2) (segid "   B" and resid  115 and name   HA) 5.139 3.301 3.301 weight 1.000 ! spec=13Cn...5deg, no=509, id=3798, vol=2.137000e+04
assign (segid "   A" and resid  115 and name  HE2) (segid "   A" and resid  115 and name  HB1) 2.253 0.634 0.634 weight 1.000 ! spec=13Cn...5deg, no=510, id=3799, vol=1.253000e+05
assign (segid "   B" and resid  115 and name  HE2) (segid "   B" and resid  115 and name  HB1) 2.253 0.634 0.634 weight 1.000 ! spec=13Cn...5deg, no=510, id=3799, vol=1.253000e+05
assign (segid "   A" and resid  115 and name  HD2) (segid "   A" and resid  115 and name  HE2) 2.016 0.508 0.508 weight 1.000 ! spec=13Cn...5deg, no=512, id=3801, vol=2.180000e+05
assign (segid "   B" and resid  115 and name  HD2) (segid "   B" and resid  115 and name  HE2) 2.016 0.508 0.508 weight 1.000 ! spec=13Cn...5deg, no=512, id=3801, vol=2.180000e+05
assign (segid "   A" and resid  115 and name  HE2) (segid "   A" and resid  115 and name  HB2) 1.812 0.410 0.410 weight 1.000 ! spec=13Cn...5deg, no=513, id=3802, vol=2.887000e+05
assign (segid "   B" and resid  115 and name  HE2) (segid "   B" and resid  115 and name  HB2) 1.812 0.410 0.410 weight 1.000 ! spec=13Cn...5deg, no=513, id=3802, vol=2.887000e+05
assign (segid "   A" and resid  115 and name  HE2) (segid "   A" and resid  115 and name  HG1) 3.419 1.461 1.461 weight 1.000 ! spec=13Cn...5deg, no=514, id=3803, vol=5.854000e+04
assign (segid "   B" and resid  115 and name  HE2) (segid "   B" and resid  115 and name  HG1) 3.419 1.461 1.461 weight 1.000 ! spec=13Cn...5deg, no=514, id=3803, vol=5.854000e+04
assign (segid "   A" and resid  114 and name   HA) (segid "   A" and resid  114 and name  HG2) 3.871 1.873 1.873 weight 1.000 ! spec=13Cn...5deg, no=517, id=3806, vol=2.163000e+04
assign (segid "   B" and resid  114 and name   HA) (segid "   B" and resid  114 and name  HG2) 3.871 1.873 1.873 weight 1.000 ! spec=13Cn...5deg, no=517, id=3806, vol=2.163000e+04
assign (segid "   A" and resid  114 and name  HB2) (segid "   A" and resid  114 and name   HA) 3.882 1.884 1.884 weight 1.000 ! spec=13Cn...5deg, no=519, id=3808, vol=1.745000e+04
assign (segid "   B" and resid  114 and name  HB2) (segid "   B" and resid  114 and name   HA) 3.882 1.884 1.884 weight 1.000 ! spec=13Cn...5deg, no=519, id=3808, vol=1.745000e+04
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid  100 and name  HB1) 1.790 0.400 0.400 weight 1.000 ! spec=13Cn...5deg, no=537, id=3824, vol=1.209000e+05
assign (segid "   B" and resid  100 and name  HB2) (segid "   B" and resid  100 and name  HB1) 1.790 0.400 0.400 weight 1.000 ! spec=13Cn...5deg, no=537, id=3824, vol=1.209000e+05
assign (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name  HG2) 2.481 0.769 0.769 weight 1.000 ! spec=13Cn...5deg, no=542, id=3829, vol=9.204000e+04
assign (segid "   B" and resid  100 and name  HB1) (segid "   B" and resid  100 and name  HG2) 2.481 0.769 0.769 weight 1.000 ! spec=13Cn...5deg, no=542, id=3829, vol=9.204000e+04
assign (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   21 and name  HB2) 1.837 0.422 0.422 weight 1.000 ! spec=13Cn...5deg, no=559, id=3844, vol=2.190000e+05
assign (segid "   B" and resid   21 and name  HB1) (segid "   B" and resid   21 and name  HB2) 1.837 0.422 0.422 weight 1.000 ! spec=13Cn...5deg, no=559, id=3844, vol=2.190000e+05
assign (segid "   A" and resid   91 and name HG21) (segid "   A" and resid   38 and name   HN) 3.342 1.396 1.396 weight 1.000 ! spec=13Cn...5deg, no=565, id=3848, vol=3.559000e+04
    or (segid "   A" and resid   91 and name HG22) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   91 and name HG23) (segid "   A" and resid   38 and name   HN)
assign (segid "   B" and resid   91 and name HG21) (segid "   B" and resid   38 and name   HN) 3.342 1.396 1.396 weight 1.000 ! spec=13Cn...5deg, no=565, id=3848, vol=3.559000e+04
    or (segid "   B" and resid   91 and name HG22) (segid "   B" and resid   38 and name   HN)
    or (segid "   B" and resid   91 and name HG23) (segid "   B" and resid   38 and name   HN)
assign (segid "   A" and resid   91 and name   HB) (segid "   A" and resid   91 and name HG21) 1.966 0.483 0.483 weight 1.000 ! spec=13Cn...5deg, no=566, id=3849, vol=7.853000e+04
    or (segid "   A" and resid   91 and name   HB) (segid "   A" and resid   91 and name HG22)
    or (segid "   A" and resid   91 and name   HB) (segid "   A" and resid   91 and name HG23)
assign (segid "   B" and resid   91 and name   HB) (segid "   B" and resid   91 and name HG21) 1.966 0.483 0.483 weight 1.000 ! spec=13Cn...5deg, no=566, id=3849, vol=7.853000e+04
    or (segid "   B" and resid   91 and name   HB) (segid "   B" and resid   91 and name HG22)
    or (segid "   B" and resid   91 and name   HB) (segid "   B" and resid   91 and name HG23)
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  103 and name  HB2) 1.841 0.424 0.424 weight 1.000 ! spec=13Cn...5deg, no=599, id=3879, vol=1.151000e+05
assign (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid  103 and name  HB2) 1.841 0.424 0.424 weight 1.000 ! spec=13Cn...5deg, no=599, id=3879, vol=1.151000e+05
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   45 and name   HA) 4.061 2.062 2.062 weight 1.000 ! spec=13Cn...5deg, no=606, id=3885, vol=1.340000e+04
assign (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   45 and name   HA) 4.061 2.062 2.062 weight 1.000 ! spec=13Cn...5deg, no=606, id=3885, vol=1.340000e+04
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   47 and name   HN) 6.574 5.402 5.402 weight 1.000 ! spec=13Cn...5deg, no=608, id=3887, vol=5.624000e+03
assign (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   47 and name   HN) 6.574 5.402 5.402 weight 1.000 ! spec=13Cn...5deg, no=608, id=3887, vol=5.624000e+03
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   65 and name  HB2) 5.176 3.349 3.349 weight 1.000 ! spec=13Cn...5deg, no=628, id=3904, vol=1.707000e+04
assign (segid "   B" and resid   64 and name   HA) (segid "   B" and resid   65 and name  HB2) 5.176 3.349 3.349 weight 1.000 ! spec=13Cn...5deg, no=628, id=3904, vol=1.707000e+04
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   87 and name HG22) 1.515 1.515 4.485 weight 1.000 ! spec=13Cn...5deg, no=637, id=3913, vol=2.938000e+05
    or (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   87 and name HG23)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   87 and name HG22)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   87 and name HG23)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   87 and name HG22)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   87 and name HG23)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   87 and name HG22) 1.515 1.515 4.485 weight 1.000 ! spec=13Cn...5deg, no=637, id=3913, vol=2.938000e+05
    or (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   87 and name HG23)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   87 and name HG22)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   87 and name HG23)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   87 and name HG22)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   87 and name HG23)
assign (segid "   A" and resid   81 and name   HB) (segid "   A" and resid   81 and name HG21) 2.224 0.618 0.618 weight 1.000 ! spec=13Cn...5deg, no=650, id=3920, vol=7.444000e+04
    or (segid "   A" and resid   81 and name   HB) (segid "   A" and resid   81 and name HG22)
    or (segid "   A" and resid   81 and name   HB) (segid "   A" and resid   81 and name HG23)
assign (segid "   B" and resid   81 and name   HB) (segid "   B" and resid   81 and name HG21) 2.224 0.618 0.618 weight 1.000 ! spec=13Cn...5deg, no=650, id=3920, vol=7.444000e+04
    or (segid "   B" and resid   81 and name   HB) (segid "   B" and resid   81 and name HG22)
    or (segid "   B" and resid   81 and name   HB) (segid "   B" and resid   81 and name HG23)
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name   HA) 3.489 1.521 1.521 weight 1.000 ! spec=13Cn...5deg, no=653, id=3923, vol=2.275000e+04
assign (segid "   B" and resid   57 and name  HB2) (segid "   B" and resid   57 and name   HA) 3.489 1.521 1.521 weight 1.000 ! spec=13Cn...5deg, no=653, id=3923, vol=2.275000e+04
assign (segid "   A" and resid   81 and name   HB) (segid "   A" and resid   81 and name   HA) 3.280 1.345 1.345 weight 1.000 ! spec=13Cn...5deg, no=677, id=3944, vol=2.703000e+04
assign (segid "   B" and resid   81 and name   HB) (segid "   B" and resid   81 and name   HA) 3.280 1.345 1.345 weight 1.000 ! spec=13Cn...5deg, no=677, id=3944, vol=2.703000e+04
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid  102 and name HG12) 4.618 2.665 2.665 weight 1.000 ! spec=13Cn...5deg, no=679, id=3946, vol=1.131000e+04
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid  102 and name HG12) 4.618 2.665 2.665 weight 1.000 ! spec=13Cn...5deg, no=679, id=3946, vol=1.131000e+04
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name   HA) 3.603 1.622 1.622 weight 1.000 ! spec=13Cn...5deg, no=719, id=3982, vol=1.638000e+04
assign (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   50 and name   HA) 3.603 1.622 1.622 weight 1.000 ! spec=13Cn...5deg, no=719, id=3982, vol=1.638000e+04
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   42 and name   HN) 4.991 3.114 3.114 weight 1.000 ! spec=13Cn...5deg, no=721, id=3983, vol=1.049000e+04
assign (segid "   B" and resid   50 and name   HA) (segid "   B" and resid   42 and name   HN) 4.991 3.114 3.114 weight 1.000 ! spec=13Cn...5deg, no=721, id=3983, vol=1.049000e+04
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   29 and name   HA) 3.108 1.208 1.208 weight 1.000 ! spec=13Cn...5deg, no=722, id=3984, vol=3.027000e+04
assign (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   29 and name   HA) 3.108 1.208 1.208 weight 1.000 ! spec=13Cn...5deg, no=722, id=3984, vol=3.027000e+04
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   63 and name  HB1) 3.488 1.520 1.520 weight 1.000 ! spec=13Cn...5deg, no=750, id=4006, vol=4.345000e+04
assign (segid "   B" and resid   63 and name  HG2) (segid "   B" and resid   63 and name  HB1) 3.488 1.520 1.520 weight 1.000 ! spec=13Cn...5deg, no=750, id=4006, vol=4.345000e+04
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   65 and name  HB2) 5.198 3.377 3.377 weight 1.000 ! spec=13Cn...5deg, no=758, id=4014, vol=2.397000e+04
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   65 and name  HB2)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   65 and name  HB2)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   65 and name  HB2) 5.198 3.377 3.377 weight 1.000 ! spec=13Cn...5deg, no=758, id=4014, vol=2.397000e+04
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   65 and name  HB2)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   65 and name  HB2)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name HG12) 2.329 0.678 0.678 weight 1.000 ! spec=13Cn...5deg, no=763, id=4019, vol=1.176000e+05
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name HG11)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name HG13)
assign (segid "   B" and resid   22 and name   HA) (segid "   B" and resid   22 and name HG12) 2.329 0.678 0.678 weight 1.000 ! spec=13Cn...5deg, no=763, id=4019, vol=1.176000e+05
    or (segid "   B" and resid   22 and name   HA) (segid "   B" and resid   22 and name HG11)
    or (segid "   B" and resid   22 and name   HA) (segid "   B" and resid   22 and name HG13)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name HG12) 1.333 1.333 4.667 weight 1.000 ! spec=13Cn...5deg, no=764, id=4020, vol=6.086000e+05
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name HG11)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name HG13)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name HG12)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name HG11)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name HG13)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name HG12)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name HG11)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name HG13)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   22 and name HG12) 1.333 1.333 4.667 weight 1.000 ! spec=13Cn...5deg, no=764, id=4020, vol=6.086000e+05
    or (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   22 and name HG11)
    or (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   22 and name HG13)
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   22 and name HG12)
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   22 and name HG11)
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   22 and name HG13)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   22 and name HG12)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   22 and name HG11)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   22 and name HG13)
assign (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  102 and name HG12) 2.163 2.163 3.837 weight 1.000 ! spec=13Cn...5deg, no=771, id=4026, vol=1.820000e+05
assign (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  102 and name HG12) 2.163 2.163 3.837 weight 1.000 ! spec=13Cn...5deg, no=771, id=4026, vol=1.820000e+05
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   68 and name  HB1) 3.642 1.658 1.658 weight 1.000 ! spec=13Cn...5deg, no=778, id=4032, vol=1.176000e+04
assign (segid "   B" and resid   68 and name   HA) (segid "   B" and resid   68 and name  HB1) 3.642 1.658 1.658 weight 1.000 ! spec=13Cn...5deg, no=778, id=4032, vol=1.176000e+04
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   47 and name   HA) 3.542 1.568 1.568 weight 1.000 ! spec=13Cn...5deg, no=782, id=4034, vol=5.899000e+04
assign (segid "   B" and resid   47 and name  HB2) (segid "   B" and resid   47 and name   HA) 3.542 1.568 1.568 weight 1.000 ! spec=13Cn...5deg, no=782, id=4034, vol=5.899000e+04
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name   HA) 3.219 1.295 1.295 weight 1.000 ! spec=13Cn...5deg, no=784, id=4036, vol=3.736000e+04
assign (segid "   B" and resid   47 and name  HB1) (segid "   B" and resid   47 and name   HA) 3.219 1.295 1.295 weight 1.000 ! spec=13Cn...5deg, no=784, id=4036, vol=3.736000e+04
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   37 and name   HA) 4.346 2.361 2.361 weight 1.000 ! spec=13Cn...5deg, no=793, id=4045, vol=3.290000e+04
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   37 and name   HA) 4.346 2.361 2.361 weight 1.000 ! spec=13Cn...5deg, no=793, id=4045, vol=3.290000e+04
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   12 and name   HZ) 5.888 4.333 4.333 weight 1.000 ! spec=13Cn...5deg, no=798, id=4048, vol=4.704000e+03
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   12 and name   HZ) 5.888 4.333 4.333 weight 1.000 ! spec=13Cn...5deg, no=798, id=4048, vol=4.704000e+03
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   17 and name   HA) 3.958 1.959 1.959 weight 1.000 ! spec=13Cn...5deg, no=815, id=4062, vol=3.695000e+04
assign (segid "   B" and resid   18 and name   HA) (segid "   B" and resid   17 and name   HA) 3.958 1.959 1.959 weight 1.000 ! spec=13Cn...5deg, no=815, id=4062, vol=3.695000e+04
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   58 and name   HA) 2.968 1.101 1.101 weight 1.000 ! spec=13Cn...5deg, no=818, id=4065, vol=5.654000e+04
assign (segid "   B" and resid   17 and name   HA) (segid "   B" and resid   58 and name   HA) 2.968 1.101 1.101 weight 1.000 ! spec=13Cn...5deg, no=818, id=4065, vol=5.654000e+04
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid  112 and name HD12) 4.995 3.119 3.119 weight 1.000 ! spec=13Cn...5deg, no=824, id=4069, vol=1.028000e+04
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid  112 and name HD11)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid  112 and name HD13)
assign (segid "   B" and resid   76 and name   HA) (segid "   B" and resid  112 and name HD12) 4.995 3.119 3.119 weight 1.000 ! spec=13Cn...5deg, no=824, id=4069, vol=1.028000e+04
    or (segid "   B" and resid   76 and name   HA) (segid "   B" and resid  112 and name HD11)
    or (segid "   B" and resid   76 and name   HA) (segid "   B" and resid  112 and name HD13)
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   76 and name  HE3) 5.161 3.330 3.330 weight 1.000 ! spec=13Cn...5deg, no=825, id=4070, vol=4.710000e+03
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   76 and name  HE3)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   76 and name  HE3)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   76 and name  HE3) 5.161 3.330 3.330 weight 1.000 ! spec=13Cn...5deg, no=825, id=4070, vol=4.710000e+03
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   76 and name  HE3)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   76 and name  HE3)
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD12) 1.652 0.341 0.341 weight 1.000 ! spec=13Cn...5deg, no=828, id=4072, vol=7.054000e+04
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD13)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD12)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD13)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD12)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD13)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD12) 1.652 0.341 0.341 weight 1.000 ! spec=13Cn...5deg, no=828, id=4072, vol=7.054000e+04
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD13)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD12)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD13)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD12)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD13)
assign (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name HD12) 2.731 0.932 0.932 weight 1.000 ! spec=13Cn...5deg, no=836, id=4078, vol=4.274000e+04
    or (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name HD11)
    or (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name HD13)
assign (segid "   B" and resid  112 and name  HB2) (segid "   B" and resid  112 and name HD12) 2.731 0.932 0.932 weight 1.000 ! spec=13Cn...5deg, no=836, id=4078, vol=4.274000e+04
    or (segid "   B" and resid  112 and name  HB2) (segid "   B" and resid  112 and name HD11)
    or (segid "   B" and resid  112 and name  HB2) (segid "   B" and resid  112 and name HD13)
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid  105 and name   HN) 4.942 3.053 3.053 weight 1.000 ! spec=13Cn...5deg, no=845, id=4085, vol=6.227000e+03
assign (segid "   B" and resid   55 and name  HG2) (segid "   B" and resid  105 and name   HN) 4.942 3.053 3.053 weight 1.000 ! spec=13Cn...5deg, no=845, id=4085, vol=6.227000e+03
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name  HG2) 3.196 1.277 1.277 weight 1.000 ! spec=13Cn...5deg, no=846, id=4086, vol=7.072000e+04
assign (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   55 and name  HG2) 3.196 1.277 1.277 weight 1.000 ! spec=13Cn...5deg, no=846, id=4086, vol=7.072000e+04
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   11 and name  HB2) 3.882 1.884 1.884 weight 1.000 ! spec=13Cn...5deg, no=864, id=4102, vol=1.895000e+04
assign (segid "   B" and resid   11 and name   HA) (segid "   B" and resid   11 and name  HB2) 3.882 1.884 1.884 weight 1.000 ! spec=13Cn...5deg, no=864, id=4102, vol=1.895000e+04
assign (segid "   A" and resid   11 and name  HG2) (segid "   A" and resid   11 and name   HA) 4.304 2.316 2.316 weight 1.000 ! spec=13Cn...5deg, no=866, id=4104, vol=1.677000e+04
assign (segid "   B" and resid   11 and name  HG2) (segid "   B" and resid   11 and name   HA) 4.304 2.316 2.316 weight 1.000 ! spec=13Cn...5deg, no=866, id=4104, vol=1.677000e+04
assign (segid "   A" and resid   67 and name  HA2) (segid "   A" and resid   67 and name  HA1) 2.438 0.743 0.743 weight 1.000 ! spec=13Cn...5deg, no=872, id=4106, vol=2.526000e+04
assign (segid "   B" and resid   67 and name  HA2) (segid "   B" and resid   67 and name  HA1) 2.438 0.743 0.743 weight 1.000 ! spec=13Cn...5deg, no=872, id=4106, vol=2.526000e+04
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name  HE2) 1.190 1.190 4.810 weight 1.000 ! spec=13Cn...5deg, no=889, id=4123, vol=3.472000e+06
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name  HE1)
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name  HE3)
assign (segid "   B" and resid    9 and name  HB2) (segid "   B" and resid    9 and name  HE2) 1.190 1.190 4.810 weight 1.000 ! spec=13Cn...5deg, no=889, id=4123, vol=3.472000e+06
    or (segid "   B" and resid    9 and name  HB2) (segid "   B" and resid    9 and name  HE1)
    or (segid "   B" and resid    9 and name  HB2) (segid "   B" and resid    9 and name  HE3)
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    8 and name  HD2) 5.608 3.931 3.931 weight 1.000 ! spec=13Cn...5deg, no=892, id=4125, vol=5.199000e+03
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    8 and name  HD2)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    8 and name  HD2)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    8 and name  HD2) 5.608 3.931 3.931 weight 1.000 ! spec=13Cn...5deg, no=892, id=4125, vol=5.199000e+03
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    8 and name  HD2)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    8 and name  HD2)
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid   12 and name  HD1) 5.319 3.537 3.537 weight 1.000 ! spec=13Cn...5deg, no=893, id=4126, vol=6.058000e+03
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid   12 and name  HD1)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid   12 and name  HD1)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid   12 and name  HD1) 5.319 3.537 3.537 weight 1.000 ! spec=13Cn...5deg, no=893, id=4126, vol=6.058000e+03
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid   12 and name  HD1)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid   12 and name  HD1)
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    9 and name   HN) 5.407 3.654 3.654 weight 1.000 ! spec=13Cn...5deg, no=894, id=4127, vol=5.914000e+03
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    9 and name   HN)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    9 and name   HN)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    9 and name   HN) 5.407 3.654 3.654 weight 1.000 ! spec=13Cn...5deg, no=894, id=4127, vol=5.914000e+03
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    9 and name   HN)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    9 and name   HN)
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    9 and name  HB1) 1.609 1.609 4.391 weight 1.000 ! spec=13Cn...5deg, no=896, id=4129, vol=3.233000e+06
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    9 and name  HB1)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    9 and name  HB1)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    9 and name  HB1) 1.609 1.609 4.391 weight 1.000 ! spec=13Cn...5deg, no=896, id=4129, vol=3.233000e+06
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    9 and name  HB1)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    9 and name  HB1)
assign (segid "   A" and resid  113 and name  HB2) (segid "   A" and resid  112 and name  HB1) 5.668 4.015 4.015 weight 1.000 ! spec=13Cn...5deg, no=900, id=4133, vol=7.738000e+03
assign (segid "   B" and resid  113 and name  HB2) (segid "   B" and resid  112 and name  HB1) 5.668 4.015 4.015 weight 1.000 ! spec=13Cn...5deg, no=900, id=4133, vol=7.738000e+03
assign (segid "   A" and resid  113 and name  HB2) (segid "   A" and resid   77 and name   HN) 5.246 3.440 3.440 weight 1.000 ! spec=13Cn...5deg, no=903, id=4136, vol=1.788000e+04
assign (segid "   B" and resid  113 and name  HB2) (segid "   B" and resid   77 and name   HN) 5.246 3.440 3.440 weight 1.000 ! spec=13Cn...5deg, no=903, id=4136, vol=1.788000e+04
assign (segid "   A" and resid  104 and name HG12) (segid "   A" and resid  104 and name HG11) 1.525 0.291 0.291 weight 1.000 ! spec=13Cn...5deg, no=906, id=4138, vol=1.378000e+05
assign (segid "   B" and resid  104 and name HG12) (segid "   B" and resid  104 and name HG11) 1.525 0.291 0.291 weight 1.000 ! spec=13Cn...5deg, no=906, id=4138, vol=1.378000e+05
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name  HG1) 4.858 2.950 2.950 weight 1.000 ! spec=13Cn...5deg, no=922, id=4149, vol=6.950000e+03
assign (segid "   B" and resid   88 and name   HA) (segid "   B" and resid   88 and name  HG1) 4.858 2.950 2.950 weight 1.000 ! spec=13Cn...5deg, no=922, id=4149, vol=6.950000e+03
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name  HG2) 3.455 1.492 1.492 weight 1.000 ! spec=13Cn...5deg, no=924, id=4151, vol=2.494000e+04
assign (segid "   B" and resid   88 and name   HA) (segid "   B" and resid   88 and name  HG2) 3.455 1.492 1.492 weight 1.000 ! spec=13Cn...5deg, no=924, id=4151, vol=2.494000e+04
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name  HB2) 3.419 1.461 1.461 weight 1.000 ! spec=13Cn...5deg, no=926, id=4153, vol=1.479000e+04
assign (segid "   B" and resid   88 and name   HA) (segid "   B" and resid   88 and name  HB2) 3.419 1.461 1.461 weight 1.000 ! spec=13Cn...5deg, no=926, id=4153, vol=1.479000e+04
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   17 and name   HA) 3.974 1.974 1.974 weight 1.000 ! spec=13Cn...5deg, no=928, id=4155, vol=3.477000e+04
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   17 and name   HA)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   17 and name   HA)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   17 and name   HA) 3.974 1.974 1.974 weight 1.000 ! spec=13Cn...5deg, no=928, id=4155, vol=3.477000e+04
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   17 and name   HA)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   17 and name   HA)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   19 and name  HB2) 4.069 2.070 2.070 weight 1.000 ! spec=13Cn...5deg, no=932, id=4158, vol=5.708000e+04
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   19 and name  HB2)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   19 and name  HB2)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   19 and name  HB2) 4.069 2.070 2.070 weight 1.000 ! spec=13Cn...5deg, no=932, id=4158, vol=5.708000e+04
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   19 and name  HB2)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   19 and name  HB2)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   36 and name   HB) 2.029 0.515 0.515 weight 1.000 ! spec=13Cn...5deg, no=938, id=4164, vol=5.431000e+04
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name   HB)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   36 and name   HB)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name   HB) 2.029 0.515 0.515 weight 1.000 ! spec=13Cn...5deg, no=938, id=4164, vol=5.431000e+04
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name   HB)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   36 and name   HB)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   92 and name   HN) 4.046 2.047 2.047 weight 1.000 ! spec=13Cn...5deg, no=939, id=4165, vol=3.998000e+04
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   92 and name   HN)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   92 and name   HN)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   92 and name   HN) 4.046 2.047 2.047 weight 1.000 ! spec=13Cn...5deg, no=939, id=4165, vol=3.998000e+04
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   92 and name   HN)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   92 and name   HN)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   30 and name  HB2) 3.778 1.784 1.784 weight 1.000 ! spec=13Cn...5deg, no=942, id=4168, vol=2.079000e+04
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   30 and name  HB2)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   30 and name  HB2)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   30 and name  HB2) 3.778 1.784 1.784 weight 1.000 ! spec=13Cn...5deg, no=942, id=4168, vol=2.079000e+04
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   30 and name  HB2)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   30 and name  HB2)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   36 and name HG22) 1.494 1.494 4.506 weight 1.000 ! spec=13Cn...5deg, no=945, id=4171, vol=2.374000e+05
    or (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   36 and name HG21)
    or (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   36 and name HG23)
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name HG22)
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name HG21)
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name HG23)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   36 and name HG22)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   36 and name HG21)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   36 and name HG23)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name HG22) 1.494 1.494 4.506 weight 1.000 ! spec=13Cn...5deg, no=945, id=4171, vol=2.374000e+05
    or (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name HG21)
    or (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name HG23)
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HG22)
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HG21)
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name HG23)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   36 and name HG22)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   36 and name HG21)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   36 and name HG23)
assign (segid "   A" and resid   33 and name  HA1) (segid "   A" and resid   29 and name HG21) 4.026 2.027 2.027 weight 1.000 ! spec=13Cn...5deg, no=953, id=4178, vol=4.878000e+04
    or (segid "   A" and resid   33 and name  HA1) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   33 and name  HA1) (segid "   A" and resid   29 and name HG23)
assign (segid "   B" and resid   33 and name  HA1) (segid "   B" and resid   29 and name HG21) 4.026 2.027 2.027 weight 1.000 ! spec=13Cn...5deg, no=953, id=4178, vol=4.878000e+04
    or (segid "   B" and resid   33 and name  HA1) (segid "   B" and resid   29 and name HG22)
    or (segid "   B" and resid   33 and name  HA1) (segid "   B" and resid   29 and name HG23)
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   35 and name  HB2) 3.878 3.878 2.122 weight 1.000 ! spec=13Cn...5deg, no=959, id=4184, vol=7.026000e+04
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   35 and name  HB2)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   35 and name  HB2)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   35 and name  HB2) 3.878 3.878 2.122 weight 1.000 ! spec=13Cn...5deg, no=959, id=4184, vol=7.026000e+04
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   35 and name  HB2)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   35 and name  HB2)
assign (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name  HB2) 1.833 0.420 0.420 weight 1.000 ! spec=13Cn...5deg, no=964, id=4189, vol=2.876000e+05
assign (segid "   B" and resid   62 and name  HB1) (segid "   B" and resid   62 and name  HB2) 1.833 0.420 0.420 weight 1.000 ! spec=13Cn...5deg, no=964, id=4189, vol=2.876000e+05
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid   78 and name   HA) 3.576 1.598 1.598 weight 1.000 ! spec=13Cn...5deg, no=977, id=4202, vol=1.202000e+04
assign (segid "   B" and resid  112 and name   HA) (segid "   B" and resid   78 and name   HA) 3.576 1.598 1.598 weight 1.000 ! spec=13Cn...5deg, no=977, id=4202, vol=1.202000e+04
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name  HB2) 4.066 2.066 2.066 weight 1.000 ! spec=13Cn...5deg, no=978, id=4203, vol=1.265000e+04
assign (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name  HB2) 4.066 2.066 2.066 weight 1.000 ! spec=13Cn...5deg, no=978, id=4203, vol=1.265000e+04
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   11 and name  HB1) 2.343 0.686 0.686 weight 1.000 ! spec=13Cn...5deg, no=1020, id=4235, vol=5.699000e+04
assign (segid "   B" and resid   11 and name  HB2) (segid "   B" and resid   11 and name  HB1) 2.343 0.686 0.686 weight 1.000 ! spec=13Cn...5deg, no=1020, id=4235, vol=5.699000e+04
assign (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   66 and name   HA) 5.166 3.336 3.336 weight 1.000 ! spec=13Cn...5deg, no=1025, id=4240, vol=2.034000e+04
assign (segid "   B" and resid   65 and name  HB2) (segid "   B" and resid   66 and name   HA) 5.166 3.336 3.336 weight 1.000 ! spec=13Cn...5deg, no=1025, id=4240, vol=2.034000e+04
assign (segid "   A" and resid   95 and name  HE1) (segid "   A" and resid   95 and name  HE2) 1.001 1.001 4.999 weight 1.000 ! spec=13Cn...5deg, no=1040, id=4255, vol=4.247000e+06
assign (segid "   B" and resid   95 and name  HE1) (segid "   B" and resid   95 and name  HE2) 1.001 1.001 4.999 weight 1.000 ! spec=13Cn...5deg, no=1040, id=4255, vol=4.247000e+06
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name  HE1) 4.907 3.010 3.010 weight 1.000 ! spec=13Cn...5deg, no=1043, id=4258, vol=3.145000e+04
assign (segid "   B" and resid   95 and name  HB2) (segid "   B" and resid   95 and name  HE1) 4.907 3.010 3.010 weight 1.000 ! spec=13Cn...5deg, no=1043, id=4258, vol=3.145000e+04
assign (segid "   A" and resid  115 and name  HD1) (segid "   A" and resid  115 and name  HB1) 2.995 1.121 1.121 weight 1.000 ! spec=13Cn...5deg, no=1048, id=4262, vol=2.545000e+05
assign (segid "   B" and resid  115 and name  HD1) (segid "   B" and resid  115 and name  HB1) 2.995 1.121 1.121 weight 1.000 ! spec=13Cn...5deg, no=1048, id=4262, vol=2.545000e+05
assign (segid "   A" and resid  115 and name  HD1) (segid "   A" and resid  115 and name  HB2) 3.128 1.223 1.223 weight 1.000 ! spec=13Cn...5deg, no=1052, id=4265, vol=1.915000e+05
assign (segid "   B" and resid  115 and name  HD1) (segid "   B" and resid  115 and name  HB2) 3.128 1.223 1.223 weight 1.000 ! spec=13Cn...5deg, no=1052, id=4265, vol=1.915000e+05
assign (segid "   A" and resid  115 and name  HD1) (segid "   A" and resid  115 and name  HG1) 3.100 1.201 1.201 weight 1.000 ! spec=13Cn...5deg, no=1053, id=4266, vol=2.211000e+04
assign (segid "   B" and resid  115 and name  HD1) (segid "   B" and resid  115 and name  HG1) 3.100 1.201 1.201 weight 1.000 ! spec=13Cn...5deg, no=1053, id=4266, vol=2.211000e+04
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name   HN) 3.476 1.510 1.510 weight 1.000 ! spec=13Cn...5deg, no=1057, id=4270, vol=2.414000e+04
assign (segid "   B" and resid   16 and name   HA) (segid "   B" and resid   16 and name   HN) 3.476 1.510 1.510 weight 1.000 ! spec=13Cn...5deg, no=1057, id=4270, vol=2.414000e+04
assign (segid "   A" and resid   88 and name  HG1) (segid "   A" and resid   88 and name  HG2) 1.268 1.268 4.732 weight 1.000 ! spec=13Cn...5deg, no=1064, id=4276, vol=8.556000e+05
assign (segid "   B" and resid   88 and name  HG1) (segid "   B" and resid   88 and name  HG2) 1.268 1.268 4.732 weight 1.000 ! spec=13Cn...5deg, no=1064, id=4276, vol=8.556000e+05
assign (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HG2) 4.464 2.491 2.491 weight 1.000 ! spec=13Cn...5deg, no=1087, id=4297, vol=3.559000e+04
assign (segid "   B" and resid   96 and name   HA) (segid "   B" and resid   96 and name  HG2) 4.464 2.491 2.491 weight 1.000 ! spec=13Cn...5deg, no=1087, id=4297, vol=3.559000e+04
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name  HB1) 1.442 0.260 0.260 weight 1.000 ! spec=13Cn...5deg, no=1095, id=4305, vol=5.432000e+05
assign (segid "   B" and resid   77 and name  HB2) (segid "   B" and resid   77 and name  HB1) 1.442 0.260 0.260 weight 1.000 ! spec=13Cn...5deg, no=1095, id=4305, vol=5.432000e+05
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HG2) 1.293 1.293 4.707 weight 1.000 ! spec=13Cn...5deg, no=1098, id=4308, vol=5.526000e+05
assign (segid "   B" and resid   34 and name  HG1) (segid "   B" and resid   34 and name  HG2) 1.293 1.293 4.707 weight 1.000 ! spec=13Cn...5deg, no=1098, id=4308, vol=5.526000e+05
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HG2) 3.831 1.834 1.834 weight 1.000 ! spec=13Cn...5deg, no=1127, id=4332, vol=2.606000e+04
assign (segid "   B" and resid   25 and name   HA) (segid "   B" and resid   25 and name  HG2) 3.831 1.834 1.834 weight 1.000 ! spec=13Cn...5deg, no=1127, id=4332, vol=2.606000e+04
assign (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  108 and name   HN) 2.718 0.923 0.923 weight 1.000 ! spec=13Cn...5deg, no=1141, id=4343, vol=5.663000e+04
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  108 and name   HN)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  108 and name   HN)
assign (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  108 and name   HN) 2.718 0.923 0.923 weight 1.000 ! spec=13Cn...5deg, no=1141, id=4343, vol=5.663000e+04
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  108 and name   HN)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  108 and name   HN)
assign (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  109 and name   HB) 2.076 0.539 0.539 weight 1.000 ! spec=13Cn...5deg, no=1142, id=4344, vol=8.330000e+04
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  109 and name   HB)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  109 and name   HB)
assign (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  109 and name   HB) 2.076 0.539 0.539 weight 1.000 ! spec=13Cn...5deg, no=1142, id=4344, vol=8.330000e+04
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  109 and name   HB)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  109 and name   HB)
assign (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  109 and name HG22) 1.644 0.338 0.338 weight 1.000 ! spec=13Cn...5deg, no=1146, id=4348, vol=1.818000e+05
    or (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  109 and name HG21)
    or (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  109 and name HG23)
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  109 and name HG22)
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  109 and name HG21)
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  109 and name HG23)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  109 and name HG22)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  109 and name HG21)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  109 and name HG23)
assign (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  109 and name HG22) 1.644 0.338 0.338 weight 1.000 ! spec=13Cn...5deg, no=1146, id=4348, vol=1.818000e+05
    or (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  109 and name HG21)
    or (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  109 and name HG23)
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  109 and name HG22)
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  109 and name HG21)
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  109 and name HG23)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  109 and name HG22)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  109 and name HG21)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  109 and name HG23)
assign (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid   54 and name  HB2) 1.608 0.323 0.323 weight 1.000 ! spec=13Cn...5deg, no=1160, id=4360, vol=4.967000e+05
assign (segid "   B" and resid   54 and name  HB1) (segid "   B" and resid   54 and name  HB2) 1.608 0.323 0.323 weight 1.000 ! spec=13Cn...5deg, no=1160, id=4360, vol=4.967000e+05
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   94 and name  HG1) 1.728 1.728 4.272 weight 1.000 ! spec=13Cn...5deg, no=1173, id=4371, vol=1.390000e+06
assign (segid "   B" and resid   94 and name  HB2) (segid "   B" and resid   94 and name  HG1) 1.728 1.728 4.272 weight 1.000 ! spec=13Cn...5deg, no=1173, id=4371, vol=1.390000e+06
assign (segid "   A" and resid  110 and name  HB1) (segid "   A" and resid  110 and name  HB2) 1.200 1.200 4.800 weight 1.000 ! spec=13Cn...5deg, no=1175, id=4372, vol=2.528000e+06
assign (segid "   B" and resid  110 and name  HB1) (segid "   B" and resid  110 and name  HB2) 1.200 1.200 4.800 weight 1.000 ! spec=13Cn...5deg, no=1175, id=4372, vol=2.528000e+06
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name   HA) 3.581 1.603 1.603 weight 1.000 ! spec=13Cn...5deg, no=1179, id=4374, vol=1.271000e+04
assign (segid "   B" and resid   90 and name  HB2) (segid "   B" and resid   90 and name   HA) 3.581 1.603 1.603 weight 1.000 ! spec=13Cn...5deg, no=1179, id=4374, vol=1.271000e+04
assign (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name  HB1) 3.405 1.450 1.450 weight 1.000 ! spec=13Cn...5deg, no=1181, id=4376, vol=1.078000e+04
assign (segid "   B" and resid   90 and name   HA) (segid "   B" and resid   90 and name  HB1) 3.405 1.450 1.450 weight 1.000 ! spec=13Cn...5deg, no=1181, id=4376, vol=1.078000e+04
assign (segid "   A" and resid   90 and name   HG) (segid "   A" and resid   90 and name   HA) 3.569 1.593 1.593 weight 1.000 ! spec=13Cn...5deg, no=1182, id=4377, vol=7.522000e+03
assign (segid "   B" and resid   90 and name   HG) (segid "   B" and resid   90 and name   HA) 3.569 1.593 1.593 weight 1.000 ! spec=13Cn...5deg, no=1182, id=4377, vol=7.522000e+03
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   49 and name  HE1) 5.382 3.620 3.620 weight 1.000 ! spec=13Cn...5deg, no=1187, id=4382, vol=7.283000e+03
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   49 and name  HE1) 5.382 3.620 3.620 weight 1.000 ! spec=13Cn...5deg, no=1187, id=4382, vol=7.283000e+03
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name   HA) 3.896 1.898 1.898 weight 1.000 ! spec=13Cn...5deg, no=1203, id=4393, vol=1.863000e+04
assign (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   55 and name   HA) 3.896 1.898 1.898 weight 1.000 ! spec=13Cn...5deg, no=1203, id=4393, vol=1.863000e+04
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    4 and name  HB1) 6.656 5.538 5.538 weight 1.000 ! spec=13Cn...5deg, no=1229, id=4416, vol=5.745000e+03
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    4 and name  HB1) 6.656 5.538 5.538 weight 1.000 ! spec=13Cn...5deg, no=1229, id=4416, vol=5.745000e+03
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HG1) 6.688 5.591 5.591 weight 1.000 ! spec=13Cn...5deg, no=1232, id=4419, vol=4.653000e+03
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    5 and name  HG1) 6.688 5.591 5.591 weight 1.000 ! spec=13Cn...5deg, no=1232, id=4419, vol=4.653000e+03
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HD2) 4.385 2.404 2.404 weight 1.000 ! spec=13Cn...5deg, no=1234, id=4421, vol=2.160000e+04
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    5 and name  HD2) 4.385 2.404 2.404 weight 1.000 ! spec=13Cn...5deg, no=1234, id=4421, vol=2.160000e+04
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name   HG) 2.008 0.504 0.504 weight 1.000 ! spec=13Cn...5deg, no=1238, id=4424, vol=1.633000e+05
assign (segid "   B" and resid   39 and name  HB2) (segid "   B" and resid   39 and name   HG) 2.008 0.504 0.504 weight 1.000 ! spec=13Cn...5deg, no=1238, id=4424, vol=1.633000e+05
assign (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   95 and name  HE2) 3.036 1.152 1.152 weight 1.000 ! spec=13Cn...5deg, no=1251, id=4436, vol=1.000000e+05
assign (segid "   B" and resid   95 and name  HG2) (segid "   B" and resid   95 and name  HE2) 3.036 1.152 1.152 weight 1.000 ! spec=13Cn...5deg, no=1251, id=4436, vol=1.000000e+05
assign (segid "   A" and resid   95 and name  HE2) (segid "   A" and resid   95 and name  HB2) 5.835 4.257 4.257 weight 1.000 ! spec=13Cn...5deg, no=1254, id=4439, vol=1.128000e+04
assign (segid "   B" and resid   95 and name  HE2) (segid "   B" and resid   95 and name  HB2) 5.835 4.257 4.257 weight 1.000 ! spec=13Cn...5deg, no=1254, id=4439, vol=1.128000e+04
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name  HB2) 3.588 1.609 1.609 weight 1.000 ! spec=13Cn...5deg, no=1259, id=4443, vol=1.203000e+05
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name  HB2) 3.588 1.609 1.609 weight 1.000 ! spec=13Cn...5deg, no=1259, id=4443, vol=1.203000e+05
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name  HG1) 4.435 2.459 2.459 weight 1.000 ! spec=13Cn...5deg, no=1262, id=4445, vol=2.841000e+04
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name  HG1) 4.435 2.459 2.459 weight 1.000 ! spec=13Cn...5deg, no=1262, id=4445, vol=2.841000e+04
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name  HD1) 1.331 1.331 4.669 weight 1.000 ! spec=13Cn...5deg, no=1273, id=4453, vol=3.077000e+06
assign (segid "   B" and resid   74 and name  HB2) (segid "   B" and resid   74 and name  HD1) 1.331 1.331 4.669 weight 1.000 ! spec=13Cn...5deg, no=1273, id=4453, vol=3.077000e+06
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name  HD1) 2.639 0.871 0.871 weight 1.000 ! spec=13Cn...5deg, no=1276, id=4456, vol=2.067000e+05
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name  HD1) 2.639 0.871 0.871 weight 1.000 ! spec=13Cn...5deg, no=1276, id=4456, vol=2.067000e+05
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   73 and name   HA) 3.141 1.233 1.233 weight 1.000 ! spec=13Cn...5deg, no=1285, id=4465, vol=4.338000e+04
assign (segid "   B" and resid   73 and name  HB2) (segid "   B" and resid   73 and name   HA) 3.141 1.233 1.233 weight 1.000 ! spec=13Cn...5deg, no=1285, id=4465, vol=4.338000e+04
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid   28 and name  HB2) 1.694 0.359 0.359 weight 1.000 ! spec=13Cn...5deg, no=1292, id=4472, vol=1.116000e+05
    or (segid "   A" and resid  102 and name HG22) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid  102 and name HG22) (segid "   A" and resid   28 and name  HB3)
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid   28 and name  HB3)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid   28 and name  HB3)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid   28 and name  HB2) 1.694 0.359 0.359 weight 1.000 ! spec=13Cn...5deg, no=1292, id=4472, vol=1.116000e+05
    or (segid "   B" and resid  102 and name HG22) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid  102 and name HG22) (segid "   B" and resid   28 and name  HB3)
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid   28 and name  HB2)
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid   28 and name  HB3)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid   28 and name  HB2)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid   28 and name  HB3)
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid  102 and name HG22) 2.815 0.990 0.990 weight 1.000 ! spec=13Cn...5deg, no=1293, id=4473, vol=3.154000e+04
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid  102 and name HG21)
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid  102 and name HG23)
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid  102 and name HG22) 2.815 0.990 0.990 weight 1.000 ! spec=13Cn...5deg, no=1293, id=4473, vol=3.154000e+04
    or (segid "   B" and resid   30 and name   HA) (segid "   B" and resid  102 and name HG21)
    or (segid "   B" and resid   30 and name   HA) (segid "   B" and resid  102 and name HG23)
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid  102 and name HG11) 2.616 0.856 0.856 weight 1.000 ! spec=13Cn...5deg, no=1298, id=4478, vol=7.581000e+04
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid  102 and name HG11)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid  102 and name HG11)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid  102 and name HG11) 2.616 0.856 0.856 weight 1.000 ! spec=13Cn...5deg, no=1298, id=4478, vol=7.581000e+04
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid  102 and name HG11)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid  102 and name HG11)
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid  101 and name   HA) 3.549 1.575 1.575 weight 1.000 ! spec=13Cn...5deg, no=1301, id=4481, vol=3.645000e+04
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid  101 and name   HA)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid  101 and name   HA)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid  101 and name   HA) 3.549 1.575 1.575 weight 1.000 ! spec=13Cn...5deg, no=1301, id=4481, vol=3.645000e+04
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid  101 and name   HA)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid  101 and name   HA)
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid  111 and name HG22) 4.848 2.938 2.938 weight 1.000 ! spec=13Cn...5deg, no=1309, id=4488, vol=1.768000e+04
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid  111 and name HG23)
assign (segid "   B" and resid   77 and name   HA) (segid "   B" and resid  111 and name HG22) 4.848 2.938 2.938 weight 1.000 ! spec=13Cn...5deg, no=1309, id=4488, vol=1.768000e+04
    or (segid "   B" and resid   77 and name   HA) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid   77 and name   HA) (segid "   B" and resid  111 and name HG23)
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name  HB1) 1.840 0.423 0.423 weight 1.000 ! spec=13Cn...5deg, no=1312, id=4489, vol=1.874000e+05
assign (segid "   B" and resid   75 and name  HB2) (segid "   B" and resid   75 and name  HB1) 1.840 0.423 0.423 weight 1.000 ! spec=13Cn...5deg, no=1312, id=4489, vol=1.874000e+05
assign (segid "   A" and resid  108 and name  HB1) (segid "   A" and resid  108 and name  HB2) 2.165 0.586 0.586 weight 1.000 ! spec=13Cn...5deg, no=1320, id=4495, vol=8.458000e+04
assign (segid "   B" and resid  108 and name  HB1) (segid "   B" and resid  108 and name  HB2) 2.165 0.586 0.586 weight 1.000 ! spec=13Cn...5deg, no=1320, id=4495, vol=8.458000e+04
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   26 and name   HA) 3.223 1.299 1.299 weight 1.000 ! spec=13Cn...5deg, no=1328, id=4500, vol=2.818000e+04
assign (segid "   B" and resid   38 and name   HB) (segid "   B" and resid   26 and name   HA) 3.223 1.299 1.299 weight 1.000 ! spec=13Cn...5deg, no=1328, id=4500, vol=2.818000e+04
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   39 and name   HN) 4.595 2.639 2.639 weight 1.000 ! spec=13Cn...5deg, no=1330, id=4502, vol=7.454000e+03
assign (segid "   B" and resid   38 and name   HB) (segid "   B" and resid   39 and name   HN) 4.595 2.639 2.639 weight 1.000 ! spec=13Cn...5deg, no=1330, id=4502, vol=7.454000e+03
assign (segid "   A" and resid   51 and name  HG1) (segid "   A" and resid   51 and name HE22) 5.730 4.104 4.104 weight 1.000 ! spec=13Cn...5deg, no=1332, id=4503, vol=4.506000e+03
assign (segid "   B" and resid   51 and name  HG1) (segid "   B" and resid   51 and name HE22) 5.730 4.104 4.104 weight 1.000 ! spec=13Cn...5deg, no=1332, id=4503, vol=4.506000e+03
assign (segid "   A" and resid  118 and name  HB2) (segid "   A" and resid  118 and name  HD1) 5.829 4.247 4.247 weight 1.000 ! spec=13Cn...5deg, no=1341, id=4510, vol=8.488000e+03
assign (segid "   B" and resid  118 and name  HB2) (segid "   B" and resid  118 and name  HD1) 5.829 4.247 4.247 weight 1.000 ! spec=13Cn...5deg, no=1341, id=4510, vol=8.488000e+03
assign (segid "   A" and resid  118 and name  HG1) (segid "   A" and resid  118 and name  HB2) 2.007 0.503 0.503 weight 1.000 ! spec=13Cn...5deg, no=1343, id=4512, vol=5.003000e+05
assign (segid "   B" and resid  118 and name  HG1) (segid "   B" and resid  118 and name  HB2) 2.007 0.503 0.503 weight 1.000 ! spec=13Cn...5deg, no=1343, id=4512, vol=5.003000e+05
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HD2) 3.186 1.269 1.269 weight 1.000 ! spec=13Cn...5deg, no=1349, id=4517, vol=1.473000e+04
assign (segid "   B" and resid   25 and name  HE2) (segid "   B" and resid   25 and name  HD2) 3.186 1.269 1.269 weight 1.000 ! spec=13Cn...5deg, no=1349, id=4517, vol=1.473000e+04
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   89 and name   HN) 3.624 1.641 1.641 weight 1.000 ! spec=13Cn...5deg, no=1362, id=4528, vol=6.693000e+03
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   89 and name   HN)
    or (segid "   A" and resid   89 and name  HB3) (segid "   A" and resid   89 and name   HN)
assign (segid "   B" and resid   89 and name  HB2) (segid "   B" and resid   89 and name   HN) 3.624 1.641 1.641 weight 1.000 ! spec=13Cn...5deg, no=1362, id=4528, vol=6.693000e+03
    or (segid "   B" and resid   89 and name  HB1) (segid "   B" and resid   89 and name   HN)
    or (segid "   B" and resid   89 and name  HB3) (segid "   B" and resid   89 and name   HN)
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   89 and name   HA) 3.276 1.341 1.341 weight 1.000 ! spec=13Cn...5deg, no=1363, id=4529, vol=7.102000e+03
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   89 and name   HA)
    or (segid "   A" and resid   89 and name  HB3) (segid "   A" and resid   89 and name   HA)
assign (segid "   B" and resid   89 and name  HB2) (segid "   B" and resid   89 and name   HA) 3.276 1.341 1.341 weight 1.000 ! spec=13Cn...5deg, no=1363, id=4529, vol=7.102000e+03
    or (segid "   B" and resid   89 and name  HB1) (segid "   B" and resid   89 and name   HA)
    or (segid "   B" and resid   89 and name  HB3) (segid "   B" and resid   89 and name   HA)
assign (segid "   A" and resid  115 and name  HD2) (segid "   A" and resid  115 and name   HA) 4.652 2.705 2.705 weight 1.000 ! spec=13Cn...5deg, no=1372, id=4535, vol=3.477000e+04
assign (segid "   B" and resid  115 and name  HD2) (segid "   B" and resid  115 and name   HA) 4.652 2.705 2.705 weight 1.000 ! spec=13Cn...5deg, no=1372, id=4535, vol=3.477000e+04
assign (segid "   A" and resid  115 and name  HD2) (segid "   A" and resid  115 and name  HB1) 2.178 2.178 3.822 weight 1.000 ! spec=13Cn...5deg, no=1373, id=4536, vol=2.411000e+05
assign (segid "   B" and resid  115 and name  HD2) (segid "   B" and resid  115 and name  HB1) 2.178 2.178 3.822 weight 1.000 ! spec=13Cn...5deg, no=1373, id=4536, vol=2.411000e+05
assign (segid "   A" and resid  115 and name  HD2) (segid "   A" and resid  115 and name  HB2) 1.426 1.426 4.574 weight 1.000 ! spec=13Cn...5deg, no=1376, id=4539, vol=2.690000e+06
assign (segid "   B" and resid  115 and name  HD2) (segid "   B" and resid  115 and name  HB2) 1.426 1.426 4.574 weight 1.000 ! spec=13Cn...5deg, no=1376, id=4539, vol=2.690000e+06
assign (segid "   A" and resid   34 and name  HD2) (segid "   A" and resid   34 and name  HE2) 2.726 0.929 0.929 weight 1.000 ! spec=13Cn...5deg, no=1402, id=4560, vol=6.917000e+04
assign (segid "   B" and resid   34 and name  HD2) (segid "   B" and resid   34 and name  HE2) 2.726 0.929 0.929 weight 1.000 ! spec=13Cn...5deg, no=1402, id=4560, vol=6.917000e+04
assign (segid "   A" and resid   34 and name  HE2) (segid "   A" and resid   34 and name  HG1) 3.046 1.160 1.160 weight 1.000 ! spec=13Cn...5deg, no=1403, id=4561, vol=5.476000e+04
assign (segid "   B" and resid   34 and name  HE2) (segid "   B" and resid   34 and name  HG1) 3.046 1.160 1.160 weight 1.000 ! spec=13Cn...5deg, no=1403, id=4561, vol=5.476000e+04
assign (segid "   A" and resid   34 and name  HE2) (segid "   A" and resid   34 and name  HG2) 3.266 1.333 1.333 weight 1.000 ! spec=13Cn...5deg, no=1404, id=4562, vol=4.338000e+04
assign (segid "   B" and resid   34 and name  HE2) (segid "   B" and resid   34 and name  HG2) 3.266 1.333 1.333 weight 1.000 ! spec=13Cn...5deg, no=1404, id=4562, vol=4.338000e+04
assign (segid "   A" and resid   34 and name  HE2) (segid "   A" and resid   34 and name  HB1) 5.788 4.188 4.188 weight 1.000 ! spec=13Cn...5deg, no=1405, id=4563, vol=9.947000e+03
assign (segid "   B" and resid   34 and name  HE2) (segid "   B" and resid   34 and name  HB1) 5.788 4.188 4.188 weight 1.000 ! spec=13Cn...5deg, no=1405, id=4563, vol=9.947000e+03
assign (segid "   A" and resid   34 and name  HE2) (segid "   A" and resid   34 and name  HB2) 5.304 3.517 3.517 weight 1.000 ! spec=13Cn...5deg, no=1406, id=4564, vol=2.227000e+04
assign (segid "   B" and resid   34 and name  HE2) (segid "   B" and resid   34 and name  HB2) 5.304 3.517 3.517 weight 1.000 ! spec=13Cn...5deg, no=1406, id=4564, vol=2.227000e+04
assign (segid "   A" and resid   34 and name  HE2) (segid "   A" and resid   34 and name  HE1) 1.384 1.384 4.616 weight 1.000 ! spec=13Cn...5deg, no=1407, id=4565, vol=4.501000e+05
assign (segid "   B" and resid   34 and name  HE2) (segid "   B" and resid   34 and name  HE1) 1.384 1.384 4.616 weight 1.000 ! spec=13Cn...5deg, no=1407, id=4565, vol=4.501000e+05
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid  100 and name  HG1) 2.200 0.605 0.605 weight 1.000 ! spec=13Cn...5deg, no=1415, id=4572, vol=1.851000e+05
assign (segid "   B" and resid  100 and name  HB2) (segid "   B" and resid  100 and name  HG1) 2.200 0.605 0.605 weight 1.000 ! spec=13Cn...5deg, no=1415, id=4572, vol=1.851000e+05
assign (segid "   A" and resid  100 and name  HG1) (segid "   A" and resid  100 and name  HB1) 2.114 0.559 0.559 weight 1.000 ! spec=13Cn...5deg, no=1417, id=4574, vol=1.887000e+05
assign (segid "   B" and resid  100 and name  HG1) (segid "   B" and resid  100 and name  HB1) 2.114 0.559 0.559 weight 1.000 ! spec=13Cn...5deg, no=1417, id=4574, vol=1.887000e+05
assign (segid "   A" and resid  100 and name  HG1) (segid "   A" and resid  100 and name  HG2) 1.152 1.152 4.848 weight 1.000 ! spec=13Cn...5deg, no=1420, id=4577, vol=1.559000e+06
assign (segid "   B" and resid  100 and name  HG1) (segid "   B" and resid  100 and name  HG2) 1.152 1.152 4.848 weight 1.000 ! spec=13Cn...5deg, no=1420, id=4577, vol=1.559000e+06
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid   99 and name  HE3) 6.497 5.276 5.276 weight 1.000 ! spec=13Cn...5deg, no=1456, id=4607, vol=4.631000e+03
assign (segid "   B" and resid   99 and name  HB1) (segid "   B" and resid   99 and name  HE3) 6.497 5.276 5.276 weight 1.000 ! spec=13Cn...5deg, no=1456, id=4607, vol=4.631000e+03
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    6 and name HG12) 4.769 2.843 2.843 weight 1.000 ! spec=13Cn...5deg, no=1480, id=4628, vol=2.455000e+04
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    6 and name HG13)
assign (segid "   B" and resid    8 and name   HA) (segid "   B" and resid    6 and name HG12) 4.769 2.843 2.843 weight 1.000 ! spec=13Cn...5deg, no=1480, id=4628, vol=2.455000e+04
    or (segid "   B" and resid    8 and name   HA) (segid "   B" and resid    6 and name HG11)
    or (segid "   B" and resid    8 and name   HA) (segid "   B" and resid    6 and name HG13)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    6 and name   HB) 1.736 0.377 0.377 weight 1.000 ! spec=13Cn...5deg, no=1481, id=4629, vol=1.627000e+05
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    6 and name   HB)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    6 and name   HB)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    6 and name   HB) 1.736 0.377 0.377 weight 1.000 ! spec=13Cn...5deg, no=1481, id=4629, vol=1.627000e+05
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    6 and name   HB)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    6 and name   HB)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid   10 and name  HA2) 4.453 2.478 2.478 weight 1.000 ! spec=13Cn...5deg, no=1483, id=4631, vol=2.362000e+04
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid   10 and name  HA2)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid   10 and name  HA2)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid   10 and name  HA2) 4.453 2.478 2.478 weight 1.000 ! spec=13Cn...5deg, no=1483, id=4631, vol=2.362000e+04
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid   10 and name  HA2)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid   10 and name  HA2)
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   25 and name   HA) 4.153 2.156 2.156 weight 1.000 ! spec=13Cn...5deg, no=1507, id=4654, vol=2.700000e+04
assign (segid "   B" and resid   24 and name   HA) (segid "   B" and resid   25 and name   HA) 4.153 2.156 2.156 weight 1.000 ! spec=13Cn...5deg, no=1507, id=4654, vol=2.700000e+04
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   86 and name  HD1) 5.056 3.196 3.196 weight 1.000 ! spec=13Cn...5deg, no=1531, id=4676, vol=6.589000e+03
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   86 and name  HD1)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   86 and name  HD1)
assign (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   86 and name  HD1) 5.056 3.196 3.196 weight 1.000 ! spec=13Cn...5deg, no=1531, id=4676, vol=6.589000e+03
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   86 and name  HD1)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   86 and name  HD1)
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HG2) 5.234 3.424 3.424 weight 1.000 ! spec=13Cn...5deg, no=1534, id=4678, vol=7.056000e+03
assign (segid "   B" and resid  103 and name   HA) (segid "   B" and resid  103 and name  HG2) 5.234 3.424 3.424 weight 1.000 ! spec=13Cn...5deg, no=1534, id=4678, vol=7.056000e+03
assign (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   26 and name   HA) 2.545 0.809 0.809 weight 1.000 ! spec=13Cn...5deg, no=1542, id=4685, vol=1.418000e+05
assign (segid "   B" and resid   26 and name   HB) (segid "   B" and resid   26 and name   HA) 2.545 0.809 0.809 weight 1.000 ! spec=13Cn...5deg, no=1542, id=4685, vol=1.418000e+05
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid   76 and name   HA) 4.182 2.187 2.187 weight 1.000 ! spec=13Cn...5deg, no=1549, id=4690, vol=2.767000e+04
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid   76 and name   HA)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid   76 and name   HA)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid   76 and name   HA) 4.182 2.187 2.187 weight 1.000 ! spec=13Cn...5deg, no=1549, id=4690, vol=2.767000e+04
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid   76 and name   HA)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid   76 and name   HA)
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid   76 and name  HD1) 4.668 2.723 2.723 weight 1.000 ! spec=13Cn...5deg, no=1554, id=4695, vol=7.738000e+03
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid   76 and name  HD1)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid   76 and name  HD1)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid   76 and name  HD1) 4.668 2.723 2.723 weight 1.000 ! spec=13Cn...5deg, no=1554, id=4695, vol=7.738000e+03
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid   76 and name  HD1)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid   76 and name  HD1)
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name   HA) 2.455 0.754 0.754 weight 1.000 ! spec=13Cn...5deg, no=1570, id=4710, vol=9.474000e+04
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name   HA) 2.455 0.754 0.754 weight 1.000 ! spec=13Cn...5deg, no=1570, id=4710, vol=9.474000e+04
assign (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  105 and name  HB2) 2.593 0.841 0.841 weight 1.000 ! spec=13Cn...5deg, no=1579, id=4719, vol=2.407000e+04
assign (segid "   B" and resid  105 and name  HB1) (segid "   B" and resid  105 and name  HB2) 2.593 0.841 0.841 weight 1.000 ! spec=13Cn...5deg, no=1579, id=4719, vol=2.407000e+04
assign (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  105 and name   HA) 4.177 2.181 2.181 weight 1.000 ! spec=13Cn...5deg, no=1580, id=4720, vol=1.112000e+04
assign (segid "   B" and resid  105 and name  HB1) (segid "   B" and resid  105 and name   HA) 4.177 2.181 2.181 weight 1.000 ! spec=13Cn...5deg, no=1580, id=4720, vol=1.112000e+04
assign (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   41 and name  HB1) 1.684 0.354 0.354 weight 1.000 ! spec=13Cn...5deg, no=1613, id=4744, vol=2.039000e+05
assign (segid "   B" and resid   41 and name  HB2) (segid "   B" and resid   41 and name  HB1) 1.684 0.354 0.354 weight 1.000 ! spec=13Cn...5deg, no=1613, id=4744, vol=2.039000e+05
assign (segid "   A" and resid  103 and name  HD2) (segid "   A" and resid  103 and name  HG2) 2.985 1.114 1.114 weight 1.000 ! spec=13Cn...5deg, no=1661, id=4778, vol=5.071000e+04
assign (segid "   B" and resid  103 and name  HD2) (segid "   B" and resid  103 and name  HG2) 2.985 1.114 1.114 weight 1.000 ! spec=13Cn...5deg, no=1661, id=4778, vol=5.071000e+04
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  103 and name  HD2) 3.141 1.233 1.233 weight 1.000 ! spec=13Cn...5deg, no=1662, id=4779, vol=5.999000e+04
assign (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid  103 and name  HD2) 3.141 1.233 1.233 weight 1.000 ! spec=13Cn...5deg, no=1662, id=4779, vol=5.999000e+04
assign (segid "   A" and resid  103 and name  HD2) (segid "   A" and resid  103 and name  HD1) 2.027 0.514 0.514 weight 1.000 ! spec=13Cn...5deg, no=1663, id=4780, vol=7.681000e+04
assign (segid "   B" and resid  103 and name  HD2) (segid "   B" and resid  103 and name  HD1) 2.027 0.514 0.514 weight 1.000 ! spec=13Cn...5deg, no=1663, id=4780, vol=7.681000e+04
assign (segid "   A" and resid  103 and name  HD2) (segid "   A" and resid  103 and name  HG1) 2.585 0.835 0.835 weight 1.000 ! spec=13Cn...5deg, no=1664, id=4781, vol=6.854000e+04
assign (segid "   B" and resid  103 and name  HD2) (segid "   B" and resid  103 and name  HG1) 2.585 0.835 0.835 weight 1.000 ! spec=13Cn...5deg, no=1664, id=4781, vol=6.854000e+04
assign (segid "   A" and resid  106 and name   HB) (segid "   A" and resid  106 and name HG21) 2.191 0.600 0.600 weight 1.000 ! spec=13Cn...5deg, no=1668, id=4783, vol=8.124000e+04
    or (segid "   A" and resid  106 and name   HB) (segid "   A" and resid  106 and name HG22)
    or (segid "   A" and resid  106 and name   HB) (segid "   A" and resid  106 and name HG23)
assign (segid "   B" and resid  106 and name   HB) (segid "   B" and resid  106 and name HG21) 2.191 0.600 0.600 weight 1.000 ! spec=13Cn...5deg, no=1668, id=4783, vol=8.124000e+04
    or (segid "   B" and resid  106 and name   HB) (segid "   B" and resid  106 and name HG22)
    or (segid "   B" and resid  106 and name   HB) (segid "   B" and resid  106 and name HG23)
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   65 and name  HB2) 4.081 2.082 2.082 weight 1.000 ! spec=13Cn...5deg, no=1687, id=4800, vol=8.176000e+04
assign (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   65 and name  HB2) 4.081 2.082 2.082 weight 1.000 ! spec=13Cn...5deg, no=1687, id=4800, vol=8.176000e+04
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   68 and name   HN) 5.476 3.748 3.748 weight 1.000 ! spec=13Cn...5deg, no=1689, id=4802, vol=4.881000e+03
assign (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   68 and name   HN) 5.476 3.748 3.748 weight 1.000 ! spec=13Cn...5deg, no=1689, id=4802, vol=4.881000e+03
assign (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name HG22) 3.647 1.662 1.662 weight 1.000 ! spec=13Cn...5deg, no=1701, id=4813, vol=2.555000e+04
    or (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name HG21)
    or (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name HG23)
assign (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  109 and name HG22) 3.647 1.662 1.662 weight 1.000 ! spec=13Cn...5deg, no=1701, id=4813, vol=2.555000e+04
    or (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  109 and name HG21)
    or (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  109 and name HG23)
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   27 and name   HA) 5.327 3.547 3.547 weight 1.000 ! spec=13Cn...5deg, no=1726, id=4837, vol=6.556000e+03
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   27 and name   HA)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   27 and name   HA)
assign (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   27 and name   HA) 5.327 3.547 3.547 weight 1.000 ! spec=13Cn...5deg, no=1726, id=4837, vol=6.556000e+03
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   27 and name   HA)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   27 and name   HA)
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   15 and name   HA) 3.923 1.924 1.924 weight 1.000 ! spec=13Cn...5deg, no=1769, id=4878, vol=1.205000e+04
assign (segid "   B" and resid   15 and name  HB1) (segid "   B" and resid   15 and name   HA) 3.923 1.924 1.924 weight 1.000 ! spec=13Cn...5deg, no=1769, id=4878, vol=1.205000e+04
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid  110 and name   HN) 5.126 3.284 3.284 weight 1.000 ! spec=13Cn...5deg, no=1773, id=4882, vol=6.605000e+03
assign (segid "   B" and resid   15 and name  HB1) (segid "   B" and resid  110 and name   HN) 5.126 3.284 3.284 weight 1.000 ! spec=13Cn...5deg, no=1773, id=4882, vol=6.605000e+03
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name  HB1) 1.660 0.344 0.344 weight 1.000 ! spec=13Cn...5deg, no=1777, id=4886, vol=4.930000e+05
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid    8 and name  HB1) 1.660 0.344 0.344 weight 1.000 ! spec=13Cn...5deg, no=1777, id=4886, vol=4.930000e+05
assign (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name   HG) 3.515 1.545 1.545 weight 1.000 ! spec=13Cn...5deg, no=1778, id=4887, vol=2.381000e+04
assign (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name   HG) 3.515 1.545 1.545 weight 1.000 ! spec=13Cn...5deg, no=1778, id=4887, vol=2.381000e+04
assign (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name   HG) 3.010 1.133 1.133 weight 1.000 ! spec=13Cn...5deg, no=1783, id=4891, vol=1.941000e+04
assign (segid "   B" and resid  112 and name  HB2) (segid "   B" and resid  112 and name   HG) 3.010 1.133 1.133 weight 1.000 ! spec=13Cn...5deg, no=1783, id=4891, vol=1.941000e+04
assign (segid "   A" and resid  103 and name  HG2) (segid "   A" and resid  103 and name  HD1) 3.190 1.272 1.272 weight 1.000 ! spec=13Cn...5deg, no=1791, id=4899, vol=2.770000e+04
assign (segid "   B" and resid  103 and name  HG2) (segid "   B" and resid  103 and name  HD1) 3.190 1.272 1.272 weight 1.000 ! spec=13Cn...5deg, no=1791, id=4899, vol=2.770000e+04
assign (segid "   A" and resid  103 and name  HD1) (segid "   A" and resid  103 and name  HG1) 3.305 1.366 1.366 weight 1.000 ! spec=13Cn...5deg, no=1793, id=4901, vol=4.043000e+04
assign (segid "   B" and resid  103 and name  HD1) (segid "   B" and resid  103 and name  HG1) 3.305 1.366 1.366 weight 1.000 ! spec=13Cn...5deg, no=1793, id=4901, vol=4.043000e+04
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name  HE1) 5.162 3.330 3.330 weight 1.000 ! spec=13Cn...5deg, no=1801, id=4908, vol=1.757000e+04
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   54 and name  HE1) 5.162 3.330 3.330 weight 1.000 ! spec=13Cn...5deg, no=1801, id=4908, vol=1.757000e+04
assign (segid "   A" and resid  118 and name  HG1) (segid "   A" and resid  118 and name  HB1) 3.298 1.360 1.360 weight 1.000 ! spec=13Cn...5deg, no=1804, id=4911, vol=8.921000e+04
assign (segid "   B" and resid  118 and name  HG1) (segid "   B" and resid  118 and name  HB1) 3.298 1.360 1.360 weight 1.000 ! spec=13Cn...5deg, no=1804, id=4911, vol=8.921000e+04
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   45 and name   HA) 5.109 3.262 3.262 weight 1.000 ! spec=13Cn...5deg, no=1819, id=4926, vol=1.393000e+04
assign (segid "   B" and resid   46 and name  HB2) (segid "   B" and resid   45 and name   HA) 5.109 3.262 3.262 weight 1.000 ! spec=13Cn...5deg, no=1819, id=4926, vol=1.393000e+04
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HZ3) 5.778 4.172 4.172 weight 1.000 ! spec=13Cn...5deg, no=1830, id=4936, vol=9.658000e+03
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HZ3) 5.778 4.172 4.172 weight 1.000 ! spec=13Cn...5deg, no=1830, id=4936, vol=9.658000e+03
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   54 and name  HD1) 6.803 5.784 5.784 weight 1.000 ! spec=13Cn...5deg, no=1833, id=4939, vol=5.608000e+03
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   54 and name  HD1) 6.803 5.784 5.784 weight 1.000 ! spec=13Cn...5deg, no=1833, id=4939, vol=5.608000e+03
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   54 and name   HA) 2.671 0.891 0.891 weight 1.000 ! spec=13Cn...5deg, no=1836, id=4942, vol=7.135000e+04
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   54 and name   HA) 2.671 0.891 0.891 weight 1.000 ! spec=13Cn...5deg, no=1836, id=4942, vol=7.135000e+04
assign (segid "   A" and resid    6 and name   HB) (segid "   A" and resid    4 and name  HD2) 6.156 4.737 4.737 weight 1.000 ! spec=13Cn...5deg, no=1842, id=4948, vol=4.835000e+03
assign (segid "   B" and resid    6 and name   HB) (segid "   B" and resid    4 and name  HD2) 6.156 4.737 4.737 weight 1.000 ! spec=13Cn...5deg, no=1842, id=4948, vol=4.835000e+03
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name   HB) 3.111 1.210 1.210 weight 1.000 ! spec=13Cn...5deg, no=1851, id=4955, vol=3.590000e+04
assign (segid "   B" and resid   71 and name   HA) (segid "   B" and resid   71 and name   HB) 3.111 1.210 1.210 weight 1.000 ! spec=13Cn...5deg, no=1851, id=4955, vol=3.590000e+04
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name HG12) 3.149 1.240 1.240 weight 1.000 ! spec=13Cn...5deg, no=1854, id=4958, vol=4.763000e+04
assign (segid "   B" and resid   71 and name   HA) (segid "   B" and resid   71 and name HG12) 3.149 1.240 1.240 weight 1.000 ! spec=13Cn...5deg, no=1854, id=4958, vol=4.763000e+04
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  101 and name  HB1) 1.503 0.282 0.282 weight 1.000 ! spec=13Cn...5deg, no=1871, id=4970, vol=5.803000e+05
assign (segid "   B" and resid  101 and name  HB2) (segid "   B" and resid  101 and name  HB1) 1.503 0.282 0.282 weight 1.000 ! spec=13Cn...5deg, no=1871, id=4970, vol=5.803000e+05
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  101 and name   HA) 4.283 2.293 2.293 weight 1.000 ! spec=13Cn...5deg, no=1872, id=4971, vol=1.176000e+04
assign (segid "   B" and resid  101 and name  HB2) (segid "   B" and resid  101 and name   HA) 4.283 2.293 2.293 weight 1.000 ! spec=13Cn...5deg, no=1872, id=4971, vol=1.176000e+04
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  101 and name   HZ) 4.740 2.809 2.809 weight 1.000 ! spec=13Cn...5deg, no=1880, id=4977, vol=1.677000e+04
assign (segid "   B" and resid  101 and name  HB2) (segid "   B" and resid  101 and name   HZ) 4.740 2.809 2.809 weight 1.000 ! spec=13Cn...5deg, no=1880, id=4977, vol=1.677000e+04
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    8 and name  HD2) 4.596 2.641 2.641 weight 1.000 ! spec=13Cn...5deg, no=1886, id=4983, vol=1.532000e+04
assign (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    8 and name  HD2) 4.596 2.641 2.641 weight 1.000 ! spec=13Cn...5deg, no=1886, id=4983, vol=1.532000e+04
assign (segid "   A" and resid  115 and name  HG1) (segid "   A" and resid  115 and name  HB1) 4.745 2.815 2.815 weight 1.000 ! spec=13Cn...5deg, no=1892, id=4989, vol=5.239000e+03
assign (segid "   B" and resid  115 and name  HG1) (segid "   B" and resid  115 and name  HB1) 4.745 2.815 2.815 weight 1.000 ! spec=13Cn...5deg, no=1892, id=4989, vol=5.239000e+03
assign (segid "   A" and resid  115 and name  HG1) (segid "   A" and resid  115 and name  HD2) 3.936 1.937 1.937 weight 1.000 ! spec=13Cn...5deg, no=1895, id=4992, vol=7.636000e+03
assign (segid "   B" and resid  115 and name  HG1) (segid "   B" and resid  115 and name  HD2) 3.936 1.937 1.937 weight 1.000 ! spec=13Cn...5deg, no=1895, id=4992, vol=7.636000e+03
assign (segid "   A" and resid  115 and name  HG1) (segid "   A" and resid  115 and name  HB2) 3.307 1.367 1.367 weight 1.000 ! spec=13Cn...5deg, no=1896, id=4993, vol=1.766000e+04
assign (segid "   B" and resid  115 and name  HG1) (segid "   B" and resid  115 and name  HB2) 3.307 1.367 1.367 weight 1.000 ! spec=13Cn...5deg, no=1896, id=4993, vol=1.766000e+04
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  111 and name HG22) 3.426 1.467 1.467 weight 1.000 ! spec=13Cn...5deg, no=1899, id=4996, vol=1.763000e+04
    or (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  111 and name HG23)
assign (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  111 and name HG22) 3.426 1.467 1.467 weight 1.000 ! spec=13Cn...5deg, no=1899, id=4996, vol=1.763000e+04
    or (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  111 and name HG23)
assign (segid "   A" and resid  111 and name   HB) (segid "   A" and resid  111 and name HG22) 1.860 0.433 0.433 weight 1.000 ! spec=13Cn...5deg, no=1904, id=5001, vol=8.883000e+04
    or (segid "   A" and resid  111 and name   HB) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  111 and name   HB) (segid "   A" and resid  111 and name HG23)
assign (segid "   B" and resid  111 and name   HB) (segid "   B" and resid  111 and name HG22) 1.860 0.433 0.433 weight 1.000 ! spec=13Cn...5deg, no=1904, id=5001, vol=8.883000e+04
    or (segid "   B" and resid  111 and name   HB) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  111 and name   HB) (segid "   B" and resid  111 and name HG23)
assign (segid "   A" and resid  104 and name   HB) (segid "   A" and resid  104 and name HG22) 2.090 0.546 0.546 weight 1.000 ! spec=13Cn...5deg, no=1909, id=5006, vol=7.081000e+04
    or (segid "   A" and resid  104 and name   HB) (segid "   A" and resid  104 and name HG21)
    or (segid "   A" and resid  104 and name   HB) (segid "   A" and resid  104 and name HG23)
assign (segid "   B" and resid  104 and name   HB) (segid "   B" and resid  104 and name HG22) 2.090 0.546 0.546 weight 1.000 ! spec=13Cn...5deg, no=1909, id=5006, vol=7.081000e+04
    or (segid "   B" and resid  104 and name   HB) (segid "   B" and resid  104 and name HG21)
    or (segid "   B" and resid  104 and name   HB) (segid "   B" and resid  104 and name HG23)
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name  HE1) 4.979 3.099 3.099 weight 1.000 ! spec=13Cn...5deg, no=1915, id=5008, vol=1.643000e+04
assign (segid "   B" and resid   53 and name  HB1) (segid "   B" and resid   53 and name  HE1) 4.979 3.099 3.099 weight 1.000 ! spec=13Cn...5deg, no=1915, id=5008, vol=1.643000e+04
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name  HB2) 1.731 0.375 0.375 weight 1.000 ! spec=13Cn...5deg, no=1940, id=5025, vol=2.960000e+05
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    7 and name  HB2) 1.731 0.375 0.375 weight 1.000 ! spec=13Cn...5deg, no=1940, id=5025, vol=2.960000e+05
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name  HB1) 1.224 1.224 4.776 weight 1.000 ! spec=13Cn...5deg, no=1944, id=5029, vol=2.674000e+06
assign (segid "   B" and resid   13 and name  HB2) (segid "   B" and resid   13 and name  HB1) 1.224 1.224 4.776 weight 1.000 ! spec=13Cn...5deg, no=1944, id=5029, vol=2.674000e+06
assign (segid "   A" and resid   99 and name  HB2) (segid "   A" and resid   99 and name   HA) 3.731 1.740 1.740 weight 1.000 ! spec=13Cn...5deg, no=1946, id=5031, vol=9.067000e+03
assign (segid "   B" and resid   99 and name  HB2) (segid "   B" and resid   99 and name   HA) 3.731 1.740 1.740 weight 1.000 ! spec=13Cn...5deg, no=1946, id=5031, vol=9.067000e+03
assign (segid "   A" and resid   99 and name  HB2) (segid "   A" and resid   99 and name  HB1) 1.471 0.270 0.270 weight 1.000 ! spec=13Cn...5deg, no=1947, id=5032, vol=9.002000e+05
assign (segid "   B" and resid   99 and name  HB2) (segid "   B" and resid   99 and name  HB1) 1.471 0.270 0.270 weight 1.000 ! spec=13Cn...5deg, no=1947, id=5032, vol=9.002000e+05
assign (segid "   A" and resid  102 and name HG12) (segid "   A" and resid  102 and name HG11) 1.587 0.315 0.315 weight 1.000 ! spec=13Cn...5deg, no=1955, id=5038, vol=1.031000e+05
assign (segid "   B" and resid  102 and name HG12) (segid "   B" and resid  102 and name HG11) 1.587 0.315 0.315 weight 1.000 ! spec=13Cn...5deg, no=1955, id=5038, vol=1.031000e+05
assign (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  102 and name HG11) 2.487 0.773 0.773 weight 1.000 ! spec=13Cn...5deg, no=1956, id=5039, vol=2.796000e+04
assign (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  102 and name HG11) 2.487 0.773 0.773 weight 1.000 ! spec=13Cn...5deg, no=1956, id=5039, vol=2.796000e+04
assign (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name HG22) 1.435 1.435 4.565 weight 1.000 ! spec=13Cn...5deg, no=1967, id=5048, vol=2.045000e+06
    or (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name HG22) 1.435 1.435 4.565 weight 1.000 ! spec=13Cn...5deg, no=1967, id=5048, vol=2.045000e+06
    or (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HG21) 2.339 0.684 0.684 weight 1.000 ! spec=13Cn...5deg, no=1971, id=5051, vol=9.037000e+04
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HG23)
assign (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   37 and name HG21) 2.339 0.684 0.684 weight 1.000 ! spec=13Cn...5deg, no=1971, id=5051, vol=9.037000e+04
    or (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   37 and name HG22)
    or (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   37 and name HG23)
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name  HB1) 2.623 0.860 0.860 weight 1.000 ! spec=13Cn...5deg, no=1983, id=5063, vol=1.895000e+05
assign (segid "   B" and resid    5 and name  HG1) (segid "   B" and resid    5 and name  HB1) 2.623 0.860 0.860 weight 1.000 ! spec=13Cn...5deg, no=1983, id=5063, vol=1.895000e+05
assign (segid "   A" and resid  106 and name   HB) (segid "   A" and resid  106 and name   HA) 3.512 1.542 1.542 weight 1.000 ! spec=13Cn...5deg, no=2009, id=5087, vol=1.511000e+04
assign (segid "   B" and resid  106 and name   HB) (segid "   B" and resid  106 and name   HA) 3.512 1.542 1.542 weight 1.000 ! spec=13Cn...5deg, no=2009, id=5087, vol=1.511000e+04
assign (segid "   A" and resid   88 and name  HE2) (segid "   A" and resid   88 and name   HN) 6.477 5.244 5.244 weight 1.000 ! spec=13Cn...5deg, no=2025, id=5101, vol=8.988000e+03
assign (segid "   B" and resid   88 and name  HE2) (segid "   B" and resid   88 and name   HN) 6.477 5.244 5.244 weight 1.000 ! spec=13Cn...5deg, no=2025, id=5101, vol=8.988000e+03
assign (segid "   A" and resid  111 and name HG22) (segid "   A" and resid  111 and name HG12) 1.568 1.568 4.432 weight 1.000 ! spec=13Cn...5deg, no=2036, id=5109, vol=2.180000e+05
    or (segid "   A" and resid  111 and name HG22) (segid "   A" and resid  111 and name HG11)
    or (segid "   A" and resid  111 and name HG22) (segid "   A" and resid  111 and name HG13)
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid  111 and name HG12)
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid  111 and name HG11)
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid  111 and name HG13)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid  111 and name HG12)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid  111 and name HG11)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid  111 and name HG13)
assign (segid "   B" and resid  111 and name HG22) (segid "   B" and resid  111 and name HG12) 1.568 1.568 4.432 weight 1.000 ! spec=13Cn...5deg, no=2036, id=5109, vol=2.180000e+05
    or (segid "   B" and resid  111 and name HG22) (segid "   B" and resid  111 and name HG11)
    or (segid "   B" and resid  111 and name HG22) (segid "   B" and resid  111 and name HG13)
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid  111 and name HG12)
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid  111 and name HG11)
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid  111 and name HG13)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid  111 and name HG12)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid  111 and name HG11)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid  111 and name HG13)
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   63 and name  HB2) 1.501 1.501 4.499 weight 1.000 ! spec=13Cn...5deg, no=2054, id=5124, vol=1.216000e+06
assign (segid "   B" and resid   63 and name  HG2) (segid "   B" and resid   63 and name  HB2) 1.501 1.501 4.499 weight 1.000 ! spec=13Cn...5deg, no=2054, id=5124, vol=1.216000e+06
assign (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name HG22) 1.959 0.480 0.480 weight 1.000 ! spec=13Cn...5deg, no=2069, id=5137, vol=6.454000e+04
    or (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name HG21)
    or (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name HG23)
assign (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   36 and name HG22) 1.959 0.480 0.480 weight 1.000 ! spec=13Cn...5deg, no=2069, id=5137, vol=6.454000e+04
    or (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   36 and name HG21)
    or (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   36 and name HG23)
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   44 and name   HN) 5.336 3.559 3.559 weight 1.000 ! spec=13Cn...5deg, no=2076, id=5144, vol=1.488000e+04
assign (segid "   B" and resid   47 and name  HB1) (segid "   B" and resid   44 and name   HN) 5.336 3.559 3.559 weight 1.000 ! spec=13Cn...5deg, no=2076, id=5144, vol=1.488000e+04
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   49 and name  HE1) 5.456 3.721 3.721 weight 1.000 ! spec=13Cn...5deg, no=2078, id=5146, vol=9.102000e+03
assign (segid "   B" and resid   47 and name  HB1) (segid "   B" and resid   49 and name  HE1) 5.456 3.721 3.721 weight 1.000 ! spec=13Cn...5deg, no=2078, id=5146, vol=9.102000e+03
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   44 and name   HB) 5.099 3.250 3.250 weight 1.000 ! spec=13Cn...5deg, no=2079, id=5147, vol=1.423000e+04
assign (segid "   B" and resid   47 and name  HB1) (segid "   B" and resid   44 and name   HB) 5.099 3.250 3.250 weight 1.000 ! spec=13Cn...5deg, no=2079, id=5147, vol=1.423000e+04
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid  100 and name  HG2) 3.137 1.230 1.230 weight 1.000 ! spec=13Cn...5deg, no=2088, id=5155, vol=7.435000e+04
assign (segid "   B" and resid  100 and name  HB2) (segid "   B" and resid  100 and name  HG2) 3.137 1.230 1.230 weight 1.000 ! spec=13Cn...5deg, no=2088, id=5155, vol=7.435000e+04
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name   HA) 3.550 1.576 1.576 weight 1.000 ! spec=13Cn...5deg, no=2096, id=5162, vol=8.579000e+03
assign (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid   76 and name   HA) 3.550 1.576 1.576 weight 1.000 ! spec=13Cn...5deg, no=2096, id=5162, vol=8.579000e+03
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   28 and name   HA) 3.853 1.855 1.855 weight 1.000 ! spec=13Cn...5deg, no=2103, id=5167, vol=1.502000e+04
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   28 and name   HA)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   28 and name   HA) 3.853 1.855 1.855 weight 1.000 ! spec=13Cn...5deg, no=2103, id=5167, vol=1.502000e+04
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   28 and name   HA)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   28 and name   HA)
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid  102 and name HD12) 1.515 1.515 4.485 weight 1.000 ! spec=13Cn...5deg, no=2104, id=5168, vol=6.090000e+04
    or (segid "   A" and resid   38 and name HG22) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid   38 and name HG22) (segid "   A" and resid  102 and name HD13)
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid  102 and name HD12)
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid  102 and name HD13)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid  102 and name HD12)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid  102 and name HD13)
assign (segid "   B" and resid   38 and name HG22) (segid "   B" and resid  102 and name HD12) 1.515 1.515 4.485 weight 1.000 ! spec=13Cn...5deg, no=2104, id=5168, vol=6.090000e+04
    or (segid "   B" and resid   38 and name HG22) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid   38 and name HG22) (segid "   B" and resid  102 and name HD13)
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid  102 and name HD12)
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid  102 and name HD13)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid  102 and name HD12)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid  102 and name HD13)
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   38 and name HG12) 1.798 1.798 4.202 weight 1.000 ! spec=13Cn...5deg, no=2109, id=5173, vol=5.745000e+04
    or (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   38 and name HG11)
    or (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   38 and name HG13)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   38 and name HG12)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   38 and name HG11)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   38 and name HG13)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   38 and name HG12)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   38 and name HG11)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   38 and name HG13)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   38 and name HG12) 1.798 1.798 4.202 weight 1.000 ! spec=13Cn...5deg, no=2109, id=5173, vol=5.745000e+04
    or (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   38 and name HG11)
    or (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   38 and name HG13)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   38 and name HG12)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   38 and name HG11)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   38 and name HG13)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   38 and name HG12)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   38 and name HG11)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   38 and name HG13)
assign (segid "   A" and resid  102 and name HG11) (segid "   A" and resid  102 and name HD12) 1.895 0.449 0.449 weight 1.000 ! spec=13Cn...5deg, no=2111, id=5175, vol=8.433000e+04
    or (segid "   A" and resid  102 and name HG11) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  102 and name HG11) (segid "   A" and resid  102 and name HD13)
assign (segid "   B" and resid  102 and name HG11) (segid "   B" and resid  102 and name HD12) 1.895 0.449 0.449 weight 1.000 ! spec=13Cn...5deg, no=2111, id=5175, vol=8.433000e+04
    or (segid "   B" and resid  102 and name HG11) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  102 and name HG11) (segid "   B" and resid  102 and name HD13)
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name HD12) 4.503 2.535 2.535 weight 1.000 ! spec=13Cn...5deg, no=2112, id=5176, vol=1.398000e+04
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name HD13)
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name HD12) 4.503 2.535 2.535 weight 1.000 ! spec=13Cn...5deg, no=2112, id=5176, vol=1.398000e+04
    or (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name HD13)
assign (segid "   A" and resid  116 and name  HB2) (segid "   A" and resid  117 and name   HA) 3.195 1.276 1.276 weight 1.000 ! spec=13Cn...5deg, no=2126, id=5189, vol=7.390000e+04
    or (segid "   A" and resid  116 and name  HB1) (segid "   A" and resid  117 and name   HA)
    or (segid "   A" and resid  116 and name  HB3) (segid "   A" and resid  117 and name   HA)
assign (segid "   B" and resid  116 and name  HB2) (segid "   B" and resid  117 and name   HA) 3.195 1.276 1.276 weight 1.000 ! spec=13Cn...5deg, no=2126, id=5189, vol=7.390000e+04
    or (segid "   B" and resid  116 and name  HB1) (segid "   B" and resid  117 and name   HA)
    or (segid "   B" and resid  116 and name  HB3) (segid "   B" and resid  117 and name   HA)
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name  HG2) 4.292 2.303 2.303 weight 1.000 ! spec=13Cn...5deg, no=2147, id=5210, vol=2.025000e+04
assign (segid "   B" and resid   51 and name   HA) (segid "   B" and resid   51 and name  HG2) 4.292 2.303 2.303 weight 1.000 ! spec=13Cn...5deg, no=2147, id=5210, vol=2.025000e+04
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   69 and name  HG1) 1.638 1.638 4.362 weight 1.000 ! spec=13Cn...5deg, no=2156, id=5217, vol=7.672000e+05
assign (segid "   B" and resid   69 and name  HB2) (segid "   B" and resid   69 and name  HG1) 1.638 1.638 4.362 weight 1.000 ! spec=13Cn...5deg, no=2156, id=5217, vol=7.672000e+05
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   49 and name   HN) 7.062 6.234 6.234 weight 1.000 ! spec=13Cn...5deg, no=2165, id=5223, vol=4.898000e+03
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   49 and name   HN) 7.062 6.234 6.234 weight 1.000 ! spec=13Cn...5deg, no=2165, id=5223, vol=4.898000e+03
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    4 and name   HA) 5.140 3.303 3.303 weight 1.000 ! spec=13Cn...5deg, no=2189, id=5244, vol=2.667000e+04
assign (segid "   B" and resid    5 and name  HB2) (segid "   B" and resid    4 and name   HA) 5.140 3.303 3.303 weight 1.000 ! spec=13Cn...5deg, no=2189, id=5244, vol=2.667000e+04
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name   HA) 3.280 1.345 1.345 weight 1.000 ! spec=13Cn...5deg, no=2227, id=5273, vol=2.510000e+04
assign (segid "   B" and resid   75 and name  HB2) (segid "   B" and resid   75 and name   HA) 3.280 1.345 1.345 weight 1.000 ! spec=13Cn...5deg, no=2227, id=5273, vol=2.510000e+04
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    9 and name  HB2) 1.549 0.300 0.300 weight 1.000 ! spec=13Cn...5deg, no=2234, id=5279, vol=4.160000e+05
assign (segid "   B" and resid    9 and name  HB1) (segid "   B" and resid    9 and name  HB2) 1.549 0.300 0.300 weight 1.000 ! spec=13Cn...5deg, no=2234, id=5279, vol=4.160000e+05
assign (segid "   A" and resid   39 and name HD22) (segid "   A" and resid   39 and name HD12) 1.125 1.125 4.875 weight 1.000 ! spec=13Cn...5deg, no=2247, id=5292, vol=1.744000e+06
    or (segid "   A" and resid   39 and name HD22) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   39 and name HD22) (segid "   A" and resid   39 and name HD13)
    or (segid "   A" and resid   39 and name HD21) (segid "   A" and resid   39 and name HD12)
    or (segid "   A" and resid   39 and name HD21) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   39 and name HD21) (segid "   A" and resid   39 and name HD13)
    or (segid "   A" and resid   39 and name HD23) (segid "   A" and resid   39 and name HD12)
    or (segid "   A" and resid   39 and name HD23) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   39 and name HD23) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   39 and name HD22) (segid "   B" and resid   39 and name HD12) 1.125 1.125 4.875 weight 1.000 ! spec=13Cn...5deg, no=2247, id=5292, vol=1.744000e+06
    or (segid "   B" and resid   39 and name HD22) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   39 and name HD22) (segid "   B" and resid   39 and name HD13)
    or (segid "   B" and resid   39 and name HD21) (segid "   B" and resid   39 and name HD12)
    or (segid "   B" and resid   39 and name HD21) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   39 and name HD21) (segid "   B" and resid   39 and name HD13)
    or (segid "   B" and resid   39 and name HD23) (segid "   B" and resid   39 and name HD12)
    or (segid "   B" and resid   39 and name HD23) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   39 and name HD23) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    2 and name   HA) 2.899 1.051 1.051 weight 1.000 ! spec=13Cn...5deg, no=2259, id=5303, vol=9.088000e+04
assign (segid "   B" and resid    2 and name  HB2) (segid "   B" and resid    2 and name   HA) 2.899 1.051 1.051 weight 1.000 ! spec=13Cn...5deg, no=2259, id=5303, vol=9.088000e+04
assign (segid "   A" and resid   69 and name  HG1) (segid "   A" and resid   69 and name  HG2) 1.673 0.350 0.350 weight 1.000 ! spec=13Cn...5deg, no=2285, id=5321, vol=1.658000e+05
assign (segid "   B" and resid   69 and name  HG1) (segid "   B" and resid   69 and name  HG2) 1.673 0.350 0.350 weight 1.000 ! spec=13Cn...5deg, no=2285, id=5321, vol=1.658000e+05
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   44 and name   HN) 6.025 4.538 4.538 weight 1.000 ! spec=13Cn...5deg, no=2304, id=5338, vol=5.592000e+03
assign (segid "   B" and resid   49 and name   HA) (segid "   B" and resid   44 and name   HN) 6.025 4.538 4.538 weight 1.000 ! spec=13Cn...5deg, no=2304, id=5338, vol=5.592000e+03
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   49 and name  HE1) 6.372 5.075 5.075 weight 1.000 ! spec=13Cn...5deg, no=2306, id=5340, vol=5.070000e+03
assign (segid "   B" and resid   49 and name   HA) (segid "   B" and resid   49 and name  HE1) 6.372 5.075 5.075 weight 1.000 ! spec=13Cn...5deg, no=2306, id=5340, vol=5.070000e+03
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   97 and name   HA) 2.263 0.640 0.640 weight 1.000 ! spec=13Cn...5deg, no=2309, id=5343, vol=4.718000e+04
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   97 and name   HA)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   97 and name   HA)
assign (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   97 and name   HA) 2.263 0.640 0.640 weight 1.000 ! spec=13Cn...5deg, no=2309, id=5343, vol=4.718000e+04
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   97 and name   HA)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   97 and name   HA)
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   92 and name   HA) 2.871 1.030 1.030 weight 1.000 ! spec=13Cn...5deg, no=2312, id=5346, vol=4.737000e+04
assign (segid "   B" and resid   97 and name   HA) (segid "   B" and resid   92 and name   HA) 2.871 1.030 1.030 weight 1.000 ! spec=13Cn...5deg, no=2312, id=5346, vol=4.737000e+04
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  104 and name HG11) 1.948 0.474 0.474 weight 1.000 ! spec=13Cn...5deg, no=2313, id=5347, vol=8.214000e+04
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  104 and name HG11)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  104 and name HG11)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  104 and name HG11) 1.948 0.474 0.474 weight 1.000 ! spec=13Cn...5deg, no=2313, id=5347, vol=8.214000e+04
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  104 and name HG11)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  104 and name HG11)
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  104 and name HG12) 1.859 0.432 0.432 weight 1.000 ! spec=13Cn...5deg, no=2316, id=5350, vol=1.044000e+05
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  104 and name HG12)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  104 and name HG12)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  104 and name HG12) 1.859 0.432 0.432 weight 1.000 ! spec=13Cn...5deg, no=2316, id=5350, vol=1.044000e+05
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  104 and name HG12)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  104 and name HG12)
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid   87 and name   HB) 3.166 1.253 1.253 weight 1.000 ! spec=13Cn...5deg, no=2317, id=5351, vol=2.066000e+04
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid   87 and name   HB)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid   87 and name   HB)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid   87 and name   HB) 3.166 1.253 1.253 weight 1.000 ! spec=13Cn...5deg, no=2317, id=5351, vol=2.066000e+04
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid   87 and name   HB)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid   87 and name   HB)
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    9 and name  HG1) 3.581 1.603 1.603 weight 1.000 ! spec=13Cn...5deg, no=2324, id=5358, vol=4.088000e+04
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    9 and name  HG1)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    9 and name  HG1)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    9 and name  HG1) 3.581 1.603 1.603 weight 1.000 ! spec=13Cn...5deg, no=2324, id=5358, vol=4.088000e+04
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    9 and name  HG1)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    9 and name  HG1)
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  103 and name  HG1) 2.913 1.061 1.061 weight 1.000 ! spec=13Cn...5deg, no=2329, id=5362, vol=1.127000e+05
assign (segid "   B" and resid  103 and name  HB2) (segid "   B" and resid  103 and name  HG1) 2.913 1.061 1.061 weight 1.000 ! spec=13Cn...5deg, no=2329, id=5362, vol=1.127000e+05
assign (segid "   A" and resid  103 and name  HG2) (segid "   A" and resid  103 and name  HG1) 1.351 1.351 4.649 weight 1.000 ! spec=13Cn...5deg, no=2331, id=5363, vol=6.540000e+05
assign (segid "   B" and resid  103 and name  HG2) (segid "   B" and resid  103 and name  HG1) 1.351 1.351 4.649 weight 1.000 ! spec=13Cn...5deg, no=2331, id=5363, vol=6.540000e+05
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   86 and name  HE1) 5.797 4.201 4.201 weight 1.000 ! spec=13Cn...5deg, no=2351, id=5376, vol=5.978000e+03
assign (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   86 and name  HE1) 5.797 4.201 4.201 weight 1.000 ! spec=13Cn...5deg, no=2351, id=5376, vol=5.978000e+03
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   50 and name  HD1) 1.836 0.421 0.421 weight 1.000 ! spec=13Cn...5deg, no=2361, id=5381, vol=1.434000e+05
assign (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   50 and name  HD1) 1.836 0.421 0.421 weight 1.000 ! spec=13Cn...5deg, no=2361, id=5381, vol=1.434000e+05
assign (segid "   A" and resid  118 and name  HG1) (segid "   A" and resid  118 and name  HG2) 1.762 0.388 0.388 weight 1.000 ! spec=13Cn...5deg, no=2367, id=5386, vol=2.005000e+05
assign (segid "   B" and resid  118 and name  HG1) (segid "   B" and resid  118 and name  HG2) 1.762 0.388 0.388 weight 1.000 ! spec=13Cn...5deg, no=2367, id=5386, vol=2.005000e+05
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name  HB2) 1.010 1.010 4.990 weight 1.000 ! spec=13Cn...5deg, no=2377, id=5394, vol=2.400000e+06
assign (segid "   B" and resid   25 and name  HB1) (segid "   B" and resid   25 and name  HB2) 1.010 1.010 4.990 weight 1.000 ! spec=13Cn...5deg, no=2377, id=5394, vol=2.400000e+06
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    9 and name   HA) 4.002 2.002 2.002 weight 1.000 ! spec=13Cn...5deg, no=2390, id=5404, vol=4.056000e+04
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    9 and name   HA)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    9 and name   HA)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    9 and name   HA) 4.002 2.002 2.002 weight 1.000 ! spec=13Cn...5deg, no=2390, id=5404, vol=4.056000e+04
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    9 and name   HA)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    9 and name   HA)
assign (segid "   A" and resid  115 and name  HG1) (segid "   A" and resid  115 and name  HG2) 2.194 0.602 0.602 weight 1.000 ! spec=13Cn...5deg, no=2400, id=5414, vol=3.054000e+04
assign (segid "   B" and resid  115 and name  HG1) (segid "   B" and resid  115 and name  HG2) 2.194 0.602 0.602 weight 1.000 ! spec=13Cn...5deg, no=2400, id=5414, vol=3.054000e+04
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   92 and name   HA) 4.042 2.042 2.042 weight 1.000 ! spec=13Cn...5deg, no=2403, id=5417, vol=3.104000e+04
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   92 and name   HA)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   92 and name   HA)
assign (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   92 and name   HA) 4.042 2.042 2.042 weight 1.000 ! spec=13Cn...5deg, no=2403, id=5417, vol=3.104000e+04
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   92 and name   HA)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   92 and name   HA)
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   39 and name HD22) 3.602 1.622 1.622 weight 1.000 ! spec=13Cn...5deg, no=2407, id=5421, vol=4.531000e+04
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   39 and name HD23)
assign (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   39 and name HD22) 3.602 1.622 1.622 weight 1.000 ! spec=13Cn...5deg, no=2407, id=5421, vol=4.531000e+04
    or (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   39 and name HD23)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name HG22) 2.637 0.869 0.869 weight 1.000 ! spec=13Cn...5deg, no=2418, id=5431, vol=6.890000e+04
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name HG23)
assign (segid "   B" and resid   18 and name   HA) (segid "   B" and resid   18 and name HG22) 2.637 0.869 0.869 weight 1.000 ! spec=13Cn...5deg, no=2418, id=5431, vol=6.890000e+04
    or (segid "   B" and resid   18 and name   HA) (segid "   B" and resid   18 and name HG21)
    or (segid "   B" and resid   18 and name   HA) (segid "   B" and resid   18 and name HG23)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HG22) 1.017 1.017 4.983 weight 1.000 ! spec=13Cn...5deg, no=2420, id=5433, vol=3.081000e+06
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HG23)
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HG22)
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HG23)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   18 and name HG22)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   18 and name HG23)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   18 and name HG22) 1.017 1.017 4.983 weight 1.000 ! spec=13Cn...5deg, no=2420, id=5433, vol=3.081000e+06
    or (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   18 and name HG21)
    or (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   18 and name HG23)
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   18 and name HG22)
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   18 and name HG21)
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   18 and name HG23)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   18 and name HG22)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   18 and name HG21)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   18 and name HG23)
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG22) 1.574 1.574 4.426 weight 1.000 ! spec=13Cn...5deg, no=2421, id=5434, vol=2.214000e+05
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG23)
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   18 and name HG22) 1.574 1.574 4.426 weight 1.000 ! spec=13Cn...5deg, no=2421, id=5434, vol=2.214000e+05
    or (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   18 and name HG21)
    or (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   18 and name HG23)
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   11 and name   HA) 4.457 2.483 2.483 weight 1.000 ! spec=13Cn...5deg, no=2423, id=5436, vol=4.881000e+03
assign (segid "   B" and resid   11 and name  HB1) (segid "   B" and resid   11 and name   HA) 4.457 2.483 2.483 weight 1.000 ! spec=13Cn...5deg, no=2423, id=5436, vol=4.881000e+03
assign (segid "   A" and resid   11 and name  HG1) (segid "   A" and resid   11 and name  HB1) 3.093 1.195 1.195 weight 1.000 ! spec=13Cn...5deg, no=2425, id=5438, vol=5.283000e+04
assign (segid "   B" and resid   11 and name  HG1) (segid "   B" and resid   11 and name  HB1) 3.093 1.195 1.195 weight 1.000 ! spec=13Cn...5deg, no=2425, id=5438, vol=5.283000e+04
assign (segid "   A" and resid   11 and name  HG2) (segid "   A" and resid   11 and name  HB1) 4.284 2.295 2.295 weight 1.000 ! spec=13Cn...5deg, no=2426, id=5439, vol=2.115000e+04
assign (segid "   B" and resid   11 and name  HG2) (segid "   B" and resid   11 and name  HB1) 4.284 2.295 2.295 weight 1.000 ! spec=13Cn...5deg, no=2426, id=5439, vol=2.115000e+04
assign (segid "   A" and resid  118 and name   HA) (segid "   A" and resid  118 and name  HG1) 3.611 1.630 1.630 weight 1.000 ! spec=13Cn...5deg, no=2440, id=5445, vol=3.659000e+04
assign (segid "   B" and resid  118 and name   HA) (segid "   B" and resid  118 and name  HG1) 3.611 1.630 1.630 weight 1.000 ! spec=13Cn...5deg, no=2440, id=5445, vol=3.659000e+04
assign (segid "   A" and resid   39 and name HD12) (segid "   A" and resid   98 and name   HA) 4.504 2.536 2.536 weight 1.000 ! spec=13Cn...5deg, no=2446, id=5451, vol=9.556000e+03
    or (segid "   A" and resid   39 and name HD11) (segid "   A" and resid   98 and name   HA)
    or (segid "   A" and resid   39 and name HD13) (segid "   A" and resid   98 and name   HA)
assign (segid "   B" and resid   39 and name HD12) (segid "   B" and resid   98 and name   HA) 4.504 2.536 2.536 weight 1.000 ! spec=13Cn...5deg, no=2446, id=5451, vol=9.556000e+03
    or (segid "   B" and resid   39 and name HD11) (segid "   B" and resid   98 and name   HA)
    or (segid "   B" and resid   39 and name HD13) (segid "   B" and resid   98 and name   HA)
assign (segid "   A" and resid   39 and name HD12) (segid "   A" and resid   38 and name   HB) 4.609 2.655 2.655 weight 1.000 ! spec=13Cn...5deg, no=2450, id=5455, vol=1.600000e+04
    or (segid "   A" and resid   39 and name HD11) (segid "   A" and resid   38 and name   HB)
    or (segid "   A" and resid   39 and name HD13) (segid "   A" and resid   38 and name   HB)
assign (segid "   B" and resid   39 and name HD12) (segid "   B" and resid   38 and name   HB) 4.609 2.655 2.655 weight 1.000 ! spec=13Cn...5deg, no=2450, id=5455, vol=1.600000e+04
    or (segid "   B" and resid   39 and name HD11) (segid "   B" and resid   38 and name   HB)
    or (segid "   B" and resid   39 and name HD13) (segid "   B" and resid   38 and name   HB)
assign (segid "   A" and resid   83 and name   HB) (segid "   A" and resid   83 and name   HA) 3.118 1.215 1.215 weight 1.000 ! spec=13Cn...5deg, no=2484, id=5489, vol=3.354000e+04
assign (segid "   B" and resid   83 and name   HB) (segid "   B" and resid   83 and name   HA) 3.118 1.215 1.215 weight 1.000 ! spec=13Cn...5deg, no=2484, id=5489, vol=3.354000e+04
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name   HA) 2.801 0.981 0.981 weight 1.000 ! spec=13Cn...5deg, no=2490, id=5493, vol=5.645000e+04
assign (segid "   B" and resid   37 and name   HB) (segid "   B" and resid   37 and name   HA) 2.801 0.981 0.981 weight 1.000 ! spec=13Cn...5deg, no=2490, id=5493, vol=5.645000e+04
assign (segid "   A" and resid    3 and name   HB) (segid "   A" and resid    3 and name   HA) 2.156 0.581 0.581 weight 1.000 ! spec=13Cn...5deg, no=2524, id=5522, vol=3.311000e+05
assign (segid "   B" and resid    3 and name   HB) (segid "   B" and resid    3 and name   HA) 2.156 0.581 0.581 weight 1.000 ! spec=13Cn...5deg, no=2524, id=5522, vol=3.311000e+05
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   31 and name HG22) 3.154 1.244 1.244 weight 1.000 ! spec=13Cn...5deg, no=2528, id=5526, vol=4.621000e+04
    or (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   31 and name HG22) 3.154 1.244 1.244 weight 1.000 ! spec=13Cn...5deg, no=2528, id=5526, vol=4.621000e+04
    or (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid   31 and name HG12) (segid "   A" and resid   31 and name HG22) 1.342 1.342 4.658 weight 1.000 ! spec=13Cn...5deg, no=2531, id=5529, vol=2.022000e+06
    or (segid "   A" and resid   31 and name HG12) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   31 and name HG12) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   31 and name HG12) (segid "   B" and resid   31 and name HG22) 1.342 1.342 4.658 weight 1.000 ! spec=13Cn...5deg, no=2531, id=5529, vol=2.022000e+06
    or (segid "   B" and resid   31 and name HG12) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   31 and name HG12) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid   31 and name HG11) (segid "   A" and resid   31 and name HG22) 2.616 0.856 0.856 weight 1.000 ! spec=13Cn...5deg, no=2536, id=5534, vol=1.738000e+05
    or (segid "   A" and resid   31 and name HG11) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   31 and name HG11) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   31 and name HG11) (segid "   B" and resid   31 and name HG22) 2.616 0.856 0.856 weight 1.000 ! spec=13Cn...5deg, no=2536, id=5534, vol=1.738000e+05
    or (segid "   B" and resid   31 and name HG11) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   31 and name HG11) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   31 and name HG22) 2.024 0.512 0.512 weight 1.000 ! spec=13Cn...5deg, no=2539, id=5537, vol=9.063000e+04
    or (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   31 and name HG22) 2.024 0.512 0.512 weight 1.000 ! spec=13Cn...5deg, no=2539, id=5537, vol=9.063000e+04
    or (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid  100 and name  HD1) (segid "   A" and resid  100 and name  HB2) 2.380 0.708 0.708 weight 1.000 ! spec=13Cn...5deg, no=2552, id=5547, vol=1.243000e+05
assign (segid "   B" and resid  100 and name  HD1) (segid "   B" and resid  100 and name  HB2) 2.380 0.708 0.708 weight 1.000 ! spec=13Cn...5deg, no=2552, id=5547, vol=1.243000e+05
assign (segid "   A" and resid  100 and name  HD1) (segid "   A" and resid  100 and name  HB1) 4.333 2.347 2.347 weight 1.000 ! spec=13Cn...5deg, no=2554, id=5549, vol=2.900000e+04
assign (segid "   B" and resid  100 and name  HD1) (segid "   B" and resid  100 and name  HB1) 4.333 2.347 2.347 weight 1.000 ! spec=13Cn...5deg, no=2554, id=5549, vol=2.900000e+04
assign (segid "   A" and resid  100 and name  HD1) (segid "   A" and resid  100 and name  HD2) 1.527 0.291 0.291 weight 1.000 ! spec=13Cn...5deg, no=2555, id=5550, vol=3.815000e+05
assign (segid "   B" and resid  100 and name  HD1) (segid "   B" and resid  100 and name  HD2) 1.527 0.291 0.291 weight 1.000 ! spec=13Cn...5deg, no=2555, id=5550, vol=3.815000e+05
assign (segid "   A" and resid  100 and name  HD1) (segid "   A" and resid  100 and name  HG1) 2.554 0.815 0.815 weight 1.000 ! spec=13Cn...5deg, no=2557, id=5552, vol=7.099000e+04
assign (segid "   B" and resid  100 and name  HD1) (segid "   B" and resid  100 and name  HG1) 2.554 0.815 0.815 weight 1.000 ! spec=13Cn...5deg, no=2557, id=5552, vol=7.099000e+04
assign (segid "   A" and resid  100 and name  HD1) (segid "   A" and resid  100 and name  HG2) 2.973 1.105 1.105 weight 1.000 ! spec=13Cn...5deg, no=2558, id=5553, vol=8.651000e+04
assign (segid "   B" and resid  100 and name  HD1) (segid "   B" and resid  100 and name  HG2) 2.973 1.105 1.105 weight 1.000 ! spec=13Cn...5deg, no=2558, id=5553, vol=8.651000e+04
assign (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   58 and name  HB2) 1.345 1.345 4.655 weight 1.000 ! spec=13Cn...5deg, no=2561, id=5556, vol=1.464000e+06
assign (segid "   B" and resid   58 and name  HB1) (segid "   B" and resid   58 and name  HB2) 1.345 1.345 4.655 weight 1.000 ! spec=13Cn...5deg, no=2561, id=5556, vol=1.464000e+06
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    7 and name  HD1) 6.318 4.990 4.990 weight 1.000 ! spec=13Cn...5deg, no=2580, id=5574, vol=5.938000e+03
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    7 and name  HD1) 6.318 4.990 4.990 weight 1.000 ! spec=13Cn...5deg, no=2580, id=5574, vol=5.938000e+03
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   63 and name  HG1) 1.394 1.394 4.606 weight 1.000 ! spec=13Cn...5deg, no=2595, id=5587, vol=5.577000e+05
assign (segid "   B" and resid   63 and name  HG2) (segid "   B" and resid   63 and name  HG1) 1.394 1.394 4.606 weight 1.000 ! spec=13Cn...5deg, no=2595, id=5587, vol=5.577000e+05
assign (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   64 and name HG22) 5.435 3.692 3.692 weight 1.000 ! spec=13Cn...5deg, no=2606, id=5596, vol=1.804000e+04
    or (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   64 and name HG23)
assign (segid "   B" and resid   65 and name  HB2) (segid "   B" and resid   64 and name HG22) 5.435 3.692 3.692 weight 1.000 ! spec=13Cn...5deg, no=2606, id=5596, vol=1.804000e+04
    or (segid "   B" and resid   65 and name  HB2) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   65 and name  HB2) (segid "   B" and resid   64 and name HG23)
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   62 and name   HN) 4.757 2.829 2.829 weight 1.000 ! spec=13Cn...5deg, no=2607, id=5597, vol=2.150000e+04
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   62 and name   HN)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   62 and name   HN)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   62 and name   HN) 4.757 2.829 2.829 weight 1.000 ! spec=13Cn...5deg, no=2607, id=5597, vol=2.150000e+04
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   62 and name   HN)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   62 and name   HN)
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HB1) 1.579 1.579 4.421 weight 1.000 ! spec=13Cn...5deg, no=2615, id=5604, vol=3.985000e+05
assign (segid "   B" and resid   57 and name  HE2) (segid "   B" and resid   57 and name  HB1) 1.579 1.579 4.421 weight 1.000 ! spec=13Cn...5deg, no=2615, id=5604, vol=3.985000e+05
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name   HA) 4.068 2.069 2.069 weight 1.000 ! spec=13Cn...5deg, no=2616, id=5605, vol=5.270000e+04
assign (segid "   B" and resid   57 and name  HE2) (segid "   B" and resid   57 and name   HA) 4.068 2.069 2.069 weight 1.000 ! spec=13Cn...5deg, no=2616, id=5605, vol=5.270000e+04
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HD2) 1.904 1.904 4.096 weight 1.000 ! spec=13Cn...5deg, no=2618, id=5607, vol=3.985000e+05
assign (segid "   B" and resid   57 and name  HE2) (segid "   B" and resid   57 and name  HD2) 1.904 1.904 4.096 weight 1.000 ! spec=13Cn...5deg, no=2618, id=5607, vol=3.985000e+05
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name   HN) 6.301 4.962 4.962 weight 1.000 ! spec=13Cn...5deg, no=2620, id=5609, vol=6.661000e+03
assign (segid "   B" and resid   57 and name  HE2) (segid "   B" and resid   57 and name   HN) 6.301 4.962 4.962 weight 1.000 ! spec=13Cn...5deg, no=2620, id=5609, vol=6.661000e+03
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HD1) 2.529 0.800 0.800 weight 1.000 ! spec=13Cn...5deg, no=2621, id=5610, vol=2.458000e+05
assign (segid "   B" and resid   57 and name  HE2) (segid "   B" and resid   57 and name  HD1) 2.529 0.800 0.800 weight 1.000 ! spec=13Cn...5deg, no=2621, id=5610, vol=2.458000e+05
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   71 and name HG12) 2.919 1.065 1.065 weight 1.000 ! spec=13Cn...5deg, no=2653, id=5639, vol=8.238000e+03
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   71 and name HG12)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   71 and name HG12)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   71 and name HG12) 2.919 1.065 1.065 weight 1.000 ! spec=13Cn...5deg, no=2653, id=5639, vol=8.238000e+03
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   71 and name HG12)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   71 and name HG12)
assign (segid "   A" and resid   71 and name HG12) (segid "   A" and resid   71 and name   HB) 2.692 0.906 0.906 weight 1.000 ! spec=13Cn...5deg, no=2654, id=5640, vol=3.550000e+04
assign (segid "   B" and resid   71 and name HG12) (segid "   B" and resid   71 and name   HB) 2.692 0.906 0.906 weight 1.000 ! spec=13Cn...5deg, no=2654, id=5640, vol=3.550000e+04
assign (segid "   A" and resid  108 and name  HB2) (segid "   A" and resid  108 and name   HA) 4.400 2.420 2.420 weight 1.000 ! spec=13Cnoesy, no=11, id=5, vol=3.480000e+02
assign (segid "   B" and resid  108 and name  HB2) (segid "   B" and resid  108 and name   HA) 4.400 2.420 2.420 weight 1.000 ! spec=13Cnoesy, no=11, id=5, vol=3.480000e+02
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name  HG1) 1.446 0.261 0.261 weight 1.000 ! spec=13Cnoesy, no=23, id=11, vol=3.777000e+04
assign (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    9 and name  HG1) 1.446 0.261 0.261 weight 1.000 ! spec=13Cnoesy, no=23, id=11, vol=3.777000e+04
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name  HB1) 3.315 1.374 1.374 weight 1.000 ! spec=13Cnoesy, no=25, id=13, vol=2.957000e+03
assign (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    9 and name  HB1) 3.315 1.374 1.374 weight 1.000 ! spec=13Cnoesy, no=25, id=13, vol=2.957000e+03
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name  HB2) 2.610 0.851 0.851 weight 1.000 ! spec=13Cnoesy, no=26, id=14, vol=3.427000e+03
assign (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    9 and name  HB2) 2.610 0.851 0.851 weight 1.000 ! spec=13Cnoesy, no=26, id=14, vol=3.427000e+03
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name  HE2) 2.549 0.812 0.812 weight 1.000 ! spec=13Cnoesy, no=27, id=15, vol=3.058000e+03
    or (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name  HE1)
    or (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name  HE3)
assign (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    9 and name  HE2) 2.549 0.812 0.812 weight 1.000 ! spec=13Cnoesy, no=27, id=15, vol=3.058000e+03
    or (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    9 and name  HE1)
    or (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    9 and name  HE3)
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name HG11) 4.001 2.001 2.001 weight 1.000 ! spec=13Cnoesy, no=34, id=21, vol=5.644000e+02
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name HG11) 4.001 2.001 2.001 weight 1.000 ! spec=13Cnoesy, no=34, id=21, vol=5.644000e+02
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name HG12) 3.915 1.916 1.916 weight 1.000 ! spec=13Cnoesy, no=37, id=24, vol=6.141000e+02
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name HG12) 3.915 1.916 1.916 weight 1.000 ! spec=13Cnoesy, no=37, id=24, vol=6.141000e+02
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid   31 and name   HN) 4.607 2.653 2.653 weight 1.000 ! spec=13Cnoesy, no=38, id=25, vol=2.476000e+02
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid   31 and name   HN) 4.607 2.653 2.653 weight 1.000 ! spec=13Cnoesy, no=38, id=25, vol=2.476000e+02
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name  HB1) 2.565 0.823 0.823 weight 1.000 ! spec=13Cnoesy, no=39, id=26, vol=6.090000e+03
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name  HB1) 2.565 0.823 0.823 weight 1.000 ! spec=13Cnoesy, no=39, id=26, vol=6.090000e+03
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name  HD2) 2.343 0.686 0.686 weight 1.000 ! spec=13Cnoesy, no=42, id=29, vol=6.090000e+03
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name  HD2) 2.343 0.686 0.686 weight 1.000 ! spec=13Cnoesy, no=42, id=29, vol=6.090000e+03
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name   HA) 5.634 3.968 3.968 weight 1.000 ! spec=13Cnoesy, no=45, id=32, vol=8.909000e+02
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name   HA) 5.634 3.968 3.968 weight 1.000 ! spec=13Cnoesy, no=45, id=32, vol=8.909000e+02
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name  HG2) 2.124 0.564 0.564 weight 1.000 ! spec=13Cnoesy, no=46, id=33, vol=7.988000e+03
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name  HG2) 2.124 0.564 0.564 weight 1.000 ! spec=13Cnoesy, no=46, id=33, vol=7.988000e+03
assign (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   32 and name  HB2) 2.416 0.730 0.730 weight 1.000 ! spec=13Cnoesy, no=62, id=47, vol=3.078000e+03
assign (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name  HB2) 2.416 0.730 0.730 weight 1.000 ! spec=13Cnoesy, no=62, id=47, vol=3.078000e+03
assign (segid "   A" and resid   71 and name HG12) (segid "   A" and resid   71 and name HG22) 2.100 0.551 0.551 weight 1.000 ! spec=13Cnoesy, no=63, id=48, vol=4.460000e+03
    or (segid "   A" and resid   71 and name HG12) (segid "   A" and resid   71 and name HG21)
    or (segid "   A" and resid   71 and name HG12) (segid "   A" and resid   71 and name HG23)
assign (segid "   B" and resid   71 and name HG12) (segid "   B" and resid   71 and name HG22) 2.100 0.551 0.551 weight 1.000 ! spec=13Cnoesy, no=63, id=48, vol=4.460000e+03
    or (segid "   B" and resid   71 and name HG12) (segid "   B" and resid   71 and name HG21)
    or (segid "   B" and resid   71 and name HG12) (segid "   B" and resid   71 and name HG23)
assign (segid "   A" and resid   71 and name HG12) (segid "   A" and resid   71 and name HG11) 1.628 0.331 0.331 weight 1.000 ! spec=13Cnoesy, no=65, id=50, vol=5.375000e+03
assign (segid "   B" and resid   71 and name HG12) (segid "   B" and resid   71 and name HG11) 1.628 0.331 0.331 weight 1.000 ! spec=13Cnoesy, no=65, id=50, vol=5.375000e+03
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name  HB2) 3.679 1.692 1.692 weight 1.000 ! spec=13Cnoesy, no=67, id=52, vol=7.035000e+02
assign (segid "   B" and resid   51 and name   HA) (segid "   B" and resid   51 and name  HB2) 3.679 1.692 1.692 weight 1.000 ! spec=13Cnoesy, no=67, id=52, vol=7.035000e+02
assign (segid "   A" and resid   33 and name  HA2) (segid "   A" and resid   33 and name  HA1) 2.296 0.659 0.659 weight 1.000 ! spec=13Cnoesy, no=69, id=53, vol=3.443000e+03
assign (segid "   B" and resid   33 and name  HA2) (segid "   B" and resid   33 and name  HA1) 2.296 0.659 0.659 weight 1.000 ! spec=13Cnoesy, no=69, id=53, vol=3.443000e+03
assign (segid "   A" and resid  113 and name  HB2) (segid "   A" and resid   77 and name   HA) 6.785 5.755 5.755 weight 1.000 ! spec=13Cnoesy, no=78, id=61, vol=4.969000e+02
assign (segid "   B" and resid  113 and name  HB2) (segid "   B" and resid   77 and name   HA) 6.785 5.755 5.755 weight 1.000 ! spec=13Cnoesy, no=78, id=61, vol=4.969000e+02
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HB1) 2.237 0.626 0.626 weight 1.000 ! spec=13Cnoesy, no=81, id=64, vol=5.480000e+03
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name  HB1) 2.237 0.626 0.626 weight 1.000 ! spec=13Cnoesy, no=81, id=64, vol=5.480000e+03
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HG1) 1.670 0.349 0.349 weight 1.000 ! spec=13Cnoesy, no=83, id=66, vol=9.613000e+03
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name  HG1) 1.670 0.349 0.349 weight 1.000 ! spec=13Cnoesy, no=83, id=66, vol=9.613000e+03
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HB2) 2.941 1.081 1.081 weight 1.000 ! spec=13Cnoesy, no=87, id=70, vol=3.355000e+03
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name  HB2) 2.941 1.081 1.081 weight 1.000 ! spec=13Cnoesy, no=87, id=70, vol=3.355000e+03
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   30 and name   HA) 3.652 1.667 1.667 weight 1.000 ! spec=13Cnoesy, no=89, id=72, vol=3.957000e+02
assign (segid "   B" and resid   30 and name  HB1) (segid "   B" and resid   30 and name   HA) 3.652 1.667 1.667 weight 1.000 ! spec=13Cnoesy, no=89, id=72, vol=3.957000e+02
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   30 and name  HB2) 2.454 0.753 0.753 weight 1.000 ! spec=13Cnoesy, no=90, id=73, vol=7.527000e+02
assign (segid "   B" and resid   30 and name  HB1) (segid "   B" and resid   30 and name  HB2) 2.454 0.753 0.753 weight 1.000 ! spec=13Cnoesy, no=90, id=73, vol=7.527000e+02
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name   HA) 3.353 1.405 1.405 weight 1.000 ! spec=13Cnoesy, no=92, id=75, vol=1.254000e+03
assign (segid "   B" and resid   49 and name  HB1) (segid "   B" and resid   49 and name   HA) 3.353 1.405 1.405 weight 1.000 ! spec=13Cnoesy, no=92, id=75, vol=1.254000e+03
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name  HE1) 5.395 3.638 3.638 weight 1.000 ! spec=13Cnoesy, no=96, id=79, vol=4.189000e+02
assign (segid "   B" and resid   49 and name  HB1) (segid "   B" and resid   49 and name  HE1) 5.395 3.638 3.638 weight 1.000 ! spec=13Cnoesy, no=96, id=79, vol=4.189000e+02
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name  HB2) 3.063 1.173 1.173 weight 1.000 ! spec=13Cnoesy, no=99, id=82, vol=2.406000e+03
assign (segid "   B" and resid   93 and name   HA) (segid "   B" and resid   93 and name  HB2) 3.063 1.173 1.173 weight 1.000 ! spec=13Cnoesy, no=99, id=82, vol=2.406000e+03
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name   HB) 3.096 1.198 1.198 weight 1.000 ! spec=13Cnoesy, no=101, id=84, vol=1.350000e+03
assign (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   85 and name   HB) 3.096 1.198 1.198 weight 1.000 ! spec=13Cnoesy, no=101, id=84, vol=1.350000e+03
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name  HG1) 4.493 2.523 2.523 weight 1.000 ! spec=13Cnoesy, no=108, id=88, vol=5.089000e+02
assign (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   85 and name  HG1) 4.493 2.523 2.523 weight 1.000 ! spec=13Cnoesy, no=108, id=88, vol=5.089000e+02
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name  HB1) 3.280 1.345 1.345 weight 1.000 ! spec=13Cnoesy, no=117, id=96, vol=1.394000e+03
assign (segid "   B" and resid   41 and name   HA) (segid "   B" and resid   41 and name  HB1) 3.280 1.345 1.345 weight 1.000 ! spec=13Cnoesy, no=117, id=96, vol=1.394000e+03
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   40 and name   HN) 4.846 2.935 2.935 weight 1.000 ! spec=13Cnoesy, no=118, id=97, vol=7.768000e+02
assign (segid "   B" and resid   41 and name   HA) (segid "   B" and resid   40 and name   HN) 4.846 2.935 2.935 weight 1.000 ! spec=13Cnoesy, no=118, id=97, vol=7.768000e+02
assign (segid "   A" and resid   70 and name  HA2) (segid "   A" and resid   71 and name   HA) 5.022 3.153 3.153 weight 1.000 ! spec=13Cnoesy, no=123, id=99, vol=3.635000e+02
assign (segid "   B" and resid   70 and name  HA2) (segid "   B" and resid   71 and name   HA) 5.022 3.153 3.153 weight 1.000 ! spec=13Cnoesy, no=123, id=99, vol=3.635000e+02
assign (segid "   A" and resid   70 and name  HA2) (segid "   A" and resid   70 and name  HA1) 2.712 0.919 0.919 weight 1.000 ! spec=13Cnoesy, no=124, id=100, vol=1.162000e+03
assign (segid "   B" and resid   70 and name  HA2) (segid "   B" and resid   70 and name  HA1) 2.712 0.919 0.919 weight 1.000 ! spec=13Cnoesy, no=124, id=100, vol=1.162000e+03
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid   29 and name HG21) 3.915 1.916 1.916 weight 1.000 ! spec=13Cnoesy, no=135, id=105, vol=2.281000e+03
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid   29 and name HG23)
assign (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid   29 and name HG21) 3.915 1.916 1.916 weight 1.000 ! spec=13Cnoesy, no=135, id=105, vol=2.281000e+03
    or (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid   29 and name HG22)
    or (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid   29 and name HG23)
assign (segid "   A" and resid  116 and name   HA) (segid "   A" and resid  116 and name  HB2) 1.875 0.439 0.439 weight 1.000 ! spec=13Cnoesy, no=139, id=109, vol=1.427000e+04
    or (segid "   A" and resid  116 and name   HA) (segid "   A" and resid  116 and name  HB1)
    or (segid "   A" and resid  116 and name   HA) (segid "   A" and resid  116 and name  HB3)
assign (segid "   B" and resid  116 and name   HA) (segid "   B" and resid  116 and name  HB2) 1.875 0.439 0.439 weight 1.000 ! spec=13Cnoesy, no=139, id=109, vol=1.427000e+04
    or (segid "   B" and resid  116 and name   HA) (segid "   B" and resid  116 and name  HB1)
    or (segid "   B" and resid  116 and name   HA) (segid "   B" and resid  116 and name  HB3)
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   73 and name  HB1) 2.122 0.563 0.563 weight 1.000 ! spec=13Cnoesy, no=140, id=110, vol=3.852000e+03
assign (segid "   B" and resid   73 and name  HB2) (segid "   B" and resid   73 and name  HB1) 2.122 0.563 0.563 weight 1.000 ! spec=13Cnoesy, no=140, id=110, vol=3.852000e+03
assign (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name   HA) 3.260 1.328 1.328 weight 1.000 ! spec=13Cnoesy, no=145, id=115, vol=6.472000e+02
assign (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name   HA) 3.260 1.328 1.328 weight 1.000 ! spec=13Cnoesy, no=145, id=115, vol=6.472000e+02
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name HD12) 4.493 2.523 2.523 weight 1.000 ! spec=13Cnoesy, no=146, id=116, vol=4.656000e+02
    or (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name HD11)
    or (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name HD13)
assign (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name HD12) 4.493 2.523 2.523 weight 1.000 ! spec=13Cnoesy, no=146, id=116, vol=4.656000e+02
    or (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name HD11)
    or (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name HD13)
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name   HG) 3.709 1.720 1.720 weight 1.000 ! spec=13Cnoesy, no=147, id=117, vol=5.765000e+02
assign (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name   HG) 3.709 1.720 1.720 weight 1.000 ! spec=13Cnoesy, no=147, id=117, vol=5.765000e+02
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name   HN) 3.668 1.681 1.681 weight 1.000 ! spec=13Cnoesy, no=148, id=118, vol=4.457000e+02
assign (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name   HN) 3.668 1.681 1.681 weight 1.000 ! spec=13Cnoesy, no=148, id=118, vol=4.457000e+02
assign (segid "   A" and resid   92 and name HG21) (segid "   A" and resid   92 and name   HA) 3.378 1.426 1.426 weight 1.000 ! spec=13Cnoesy, no=160, id=126, vol=1.617000e+03
    or (segid "   A" and resid   92 and name HG22) (segid "   A" and resid   92 and name   HA)
    or (segid "   A" and resid   92 and name HG23) (segid "   A" and resid   92 and name   HA)
assign (segid "   B" and resid   92 and name HG21) (segid "   B" and resid   92 and name   HA) 3.378 1.426 1.426 weight 1.000 ! spec=13Cnoesy, no=160, id=126, vol=1.617000e+03
    or (segid "   B" and resid   92 and name HG22) (segid "   B" and resid   92 and name   HA)
    or (segid "   B" and resid   92 and name HG23) (segid "   B" and resid   92 and name   HA)
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name  HD2) 4.694 2.754 2.754 weight 1.000 ! spec=13Cnoesy, no=166, id=132, vol=4.606000e+02
assign (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   84 and name  HD2) 4.694 2.754 2.754 weight 1.000 ! spec=13Cnoesy, no=166, id=132, vol=4.606000e+02
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   83 and name HG21) 4.181 2.185 2.185 weight 1.000 ! spec=13Cnoesy, no=167, id=133, vol=7.346000e+02
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   83 and name HG22)
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   83 and name HG23)
assign (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   83 and name HG21) 4.181 2.185 2.185 weight 1.000 ! spec=13Cnoesy, no=167, id=133, vol=7.346000e+02
    or (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   83 and name HG22)
    or (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   83 and name HG23)
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name  HB1) 3.586 1.608 1.608 weight 1.000 ! spec=13Cnoesy, no=168, id=134, vol=6.603000e+02
assign (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   84 and name  HB1) 3.586 1.608 1.608 weight 1.000 ! spec=13Cnoesy, no=168, id=134, vol=6.603000e+02
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name  HB2) 3.638 1.655 1.655 weight 1.000 ! spec=13Cnoesy, no=170, id=136, vol=6.271000e+02
assign (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   84 and name  HB2) 3.638 1.655 1.655 weight 1.000 ! spec=13Cnoesy, no=170, id=136, vol=6.271000e+02
assign (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name HG11) 2.887 1.042 1.042 weight 1.000 ! spec=13Cnoesy, no=174, id=140, vol=1.288000e+03
assign (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name HG11) 2.887 1.042 1.042 weight 1.000 ! spec=13Cnoesy, no=174, id=140, vol=1.288000e+03
assign (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name HG12) 3.306 1.366 1.366 weight 1.000 ! spec=13Cnoesy, no=175, id=141, vol=1.459000e+03
assign (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name HG12) 3.306 1.366 1.366 weight 1.000 ! spec=13Cnoesy, no=175, id=141, vol=1.459000e+03
assign (segid "   A" and resid   31 and name   HB) (segid "   A" and resid  101 and name  HB2) 3.146 1.238 1.238 weight 1.000 ! spec=13Cnoesy, no=177, id=143, vol=7.668000e+02
assign (segid "   B" and resid   31 and name   HB) (segid "   B" and resid  101 and name  HB2) 3.146 1.238 1.238 weight 1.000 ! spec=13Cnoesy, no=177, id=143, vol=7.668000e+02
assign (segid "   A" and resid   31 and name   HB) (segid "   A" and resid  103 and name   HA) 4.488 2.518 2.518 weight 1.000 ! spec=13Cnoesy, no=179, id=145, vol=4.370000e+02
assign (segid "   B" and resid   31 and name   HB) (segid "   B" and resid  103 and name   HA) 4.488 2.518 2.518 weight 1.000 ! spec=13Cnoesy, no=179, id=145, vol=4.370000e+02
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   48 and name HG22) 2.749 0.944 0.944 weight 1.000 ! spec=13Cnoesy, no=203, id=165, vol=1.784000e+03
    or (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   48 and name HG21)
    or (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   48 and name HG23)
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   48 and name HG22) 2.749 0.944 0.944 weight 1.000 ! spec=13Cnoesy, no=203, id=165, vol=1.784000e+03
    or (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   48 and name HG21)
    or (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   48 and name HG23)
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   66 and name  HB2) 2.839 1.007 1.007 weight 1.000 ! spec=13Cnoesy, no=206, id=168, vol=3.608000e+03
assign (segid "   B" and resid   66 and name   HA) (segid "   B" and resid   66 and name  HB2) 2.839 1.007 1.007 weight 1.000 ! spec=13Cnoesy, no=206, id=168, vol=3.608000e+03
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   66 and name  HB1) 3.182 1.266 1.266 weight 1.000 ! spec=13Cnoesy, no=209, id=171, vol=2.708000e+03
assign (segid "   B" and resid   66 and name   HA) (segid "   B" and resid   66 and name  HB1) 3.182 1.266 1.266 weight 1.000 ! spec=13Cnoesy, no=209, id=171, vol=2.708000e+03
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name  HG2) 2.778 0.965 0.965 weight 1.000 ! spec=13Cnoesy, no=210, id=172, vol=4.415000e+03
assign (segid "   B" and resid   95 and name  HB2) (segid "   B" and resid   95 and name  HG2) 2.778 0.965 0.965 weight 1.000 ! spec=13Cnoesy, no=210, id=172, vol=4.415000e+03
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name  HG2) 2.476 0.766 0.766 weight 1.000 ! spec=13Cnoesy, no=223, id=184, vol=3.475000e+03
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   74 and name  HG2) 2.476 0.766 0.766 weight 1.000 ! spec=13Cnoesy, no=223, id=184, vol=3.475000e+03
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  104 and name   HA) 3.967 1.967 1.967 weight 1.000 ! spec=13Cnoesy, no=242, id=200, vol=1.702000e+03
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  104 and name   HA)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  104 and name   HA)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  104 and name   HA) 3.967 1.967 1.967 weight 1.000 ! spec=13Cnoesy, no=242, id=200, vol=1.702000e+03
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  104 and name   HA)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  104 and name   HA)
assign (segid "   A" and resid    9 and name  HG1) (segid "   A" and resid    9 and name  HB1) 2.710 0.918 0.918 weight 1.000 ! spec=13Cnoesy, no=245, id=202, vol=3.005000e+03
assign (segid "   B" and resid    9 and name  HG1) (segid "   B" and resid    9 and name  HB1) 2.710 0.918 0.918 weight 1.000 ! spec=13Cnoesy, no=245, id=202, vol=3.005000e+03
assign (segid "   A" and resid    9 and name  HG1) (segid "   A" and resid    9 and name  HB2) 3.257 1.326 1.326 weight 1.000 ! spec=13Cnoesy, no=246, id=203, vol=3.182000e+03
assign (segid "   B" and resid    9 and name  HG1) (segid "   B" and resid    9 and name  HB2) 3.257 1.326 1.326 weight 1.000 ! spec=13Cnoesy, no=246, id=203, vol=3.182000e+03
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name   HA) 3.106 1.206 1.206 weight 1.000 ! spec=13Cnoesy, no=249, id=206, vol=2.281000e+03
assign (segid "   B" and resid   24 and name  HB1) (segid "   B" and resid   24 and name   HA) 3.106 1.206 1.206 weight 1.000 ! spec=13Cnoesy, no=249, id=206, vol=2.281000e+03
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name  HB2) 2.269 0.643 0.643 weight 1.000 ! spec=13Cnoesy, no=252, id=209, vol=5.094000e+03
assign (segid "   B" and resid   24 and name  HB1) (segid "   B" and resid   24 and name  HB2) 2.269 0.643 0.643 weight 1.000 ! spec=13Cnoesy, no=252, id=209, vol=5.094000e+03
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HB1) 5.428 3.684 3.684 weight 1.000 ! spec=13Cnoesy, no=256, id=213, vol=4.163000e+02
assign (segid "   B" and resid   25 and name  HE2) (segid "   B" and resid   25 and name  HB1) 5.428 3.684 3.684 weight 1.000 ! spec=13Cnoesy, no=256, id=213, vol=4.163000e+02
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HB2) 5.592 3.909 3.909 weight 1.000 ! spec=13Cnoesy, no=258, id=214, vol=4.748000e+02
assign (segid "   B" and resid   25 and name  HE2) (segid "   B" and resid   25 and name  HB2) 5.592 3.909 3.909 weight 1.000 ! spec=13Cnoesy, no=258, id=214, vol=4.748000e+02
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HG2) 4.364 2.381 2.381 weight 1.000 ! spec=13Cnoesy, no=261, id=216, vol=6.593000e+02
assign (segid "   B" and resid   25 and name  HE2) (segid "   B" and resid   25 and name  HG2) 4.364 2.381 2.381 weight 1.000 ! spec=13Cnoesy, no=261, id=216, vol=6.593000e+02
assign (segid "   A" and resid  115 and name  HD2) (segid "   A" and resid  115 and name  HG2) 2.297 0.660 0.660 weight 1.000 ! spec=13Cnoesy, no=263, id=217, vol=7.704000e+03
assign (segid "   B" and resid  115 and name  HD2) (segid "   B" and resid  115 and name  HG2) 2.297 0.660 0.660 weight 1.000 ! spec=13Cnoesy, no=263, id=217, vol=7.704000e+03
assign (segid "   A" and resid  115 and name  HD2) (segid "   A" and resid  115 and name  HD1) 1.590 0.316 0.316 weight 1.000 ! spec=13Cnoesy, no=264, id=218, vol=1.048000e+04
assign (segid "   B" and resid  115 and name  HD2) (segid "   B" and resid  115 and name  HD1) 1.590 0.316 0.316 weight 1.000 ! spec=13Cnoesy, no=264, id=218, vol=1.048000e+04
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid   30 and name   HA) 3.530 1.558 1.558 weight 1.000 ! spec=13Cnoesy, no=277, id=222, vol=6.261000e+02
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid   30 and name   HA) 3.530 1.558 1.558 weight 1.000 ! spec=13Cnoesy, no=277, id=222, vol=6.261000e+02
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   87 and name   HA) 2.475 0.765 0.765 weight 1.000 ! spec=13Cnoesy, no=290, id=232, vol=3.343000e+03
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   87 and name   HA)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   87 and name   HA)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   87 and name   HA) 2.475 0.765 0.765 weight 1.000 ! spec=13Cnoesy, no=290, id=232, vol=3.343000e+03
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   87 and name   HA)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   87 and name   HA)
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid  104 and name HD12) 1.653 0.341 0.341 weight 1.000 ! spec=13Cnoesy, no=294, id=235, vol=3.013000e+03
    or (segid "   A" and resid   87 and name HG12) (segid "   A" and resid  104 and name HD11)
    or (segid "   A" and resid   87 and name HG12) (segid "   A" and resid  104 and name HD13)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid  104 and name HD12)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid  104 and name HD11)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid  104 and name HD13)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid  104 and name HD12)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid  104 and name HD11)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid  104 and name HD13)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid  104 and name HD12) 1.653 0.341 0.341 weight 1.000 ! spec=13Cnoesy, no=294, id=235, vol=3.013000e+03
    or (segid "   B" and resid   87 and name HG12) (segid "   B" and resid  104 and name HD11)
    or (segid "   B" and resid   87 and name HG12) (segid "   B" and resid  104 and name HD13)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid  104 and name HD12)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid  104 and name HD11)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid  104 and name HD13)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid  104 and name HD12)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid  104 and name HD11)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid  104 and name HD13)
assign (segid "   A" and resid   73 and name  HB1) (segid "   A" and resid   73 and name   HA) 3.445 1.484 1.484 weight 1.000 ! spec=13Cnoesy, no=299, id=240, vol=1.700000e+03
assign (segid "   B" and resid   73 and name  HB1) (segid "   B" and resid   73 and name   HA) 3.445 1.484 1.484 weight 1.000 ! spec=13Cnoesy, no=299, id=240, vol=1.700000e+03
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HB1) 3.837 1.840 1.840 weight 1.000 ! spec=13Cnoesy, no=305, id=246, vol=9.577000e+02
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HB1) 3.837 1.840 1.840 weight 1.000 ! spec=13Cnoesy, no=305, id=246, vol=9.577000e+02
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HB2) 2.964 1.098 1.098 weight 1.000 ! spec=13Cnoesy, no=307, id=248, vol=1.623000e+03
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HB2) 2.964 1.098 1.098 weight 1.000 ! spec=13Cnoesy, no=307, id=248, vol=1.623000e+03
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   20 and name   HN) 4.521 2.555 2.555 weight 1.000 ! spec=13Cnoesy, no=308, id=249, vol=5.544000e+02
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   20 and name   HN) 4.521 2.555 2.555 weight 1.000 ! spec=13Cnoesy, no=308, id=249, vol=5.544000e+02
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HE3) 3.569 1.592 1.592 weight 1.000 ! spec=13Cnoesy, no=309, id=250, vol=9.961000e+02
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HE3) 3.569 1.592 1.592 weight 1.000 ! spec=13Cnoesy, no=309, id=250, vol=9.961000e+02
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   20 and name   HB) 4.331 2.345 2.345 weight 1.000 ! spec=13Cnoesy, no=310, id=251, vol=3.640000e+02
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   20 and name   HB) 4.331 2.345 2.345 weight 1.000 ! spec=13Cnoesy, no=310, id=251, vol=3.640000e+02
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HD1) 4.085 2.086 2.086 weight 1.000 ! spec=13Cnoesy, no=311, id=252, vol=1.171000e+03
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name  HD1) 4.085 2.086 2.086 weight 1.000 ! spec=13Cnoesy, no=311, id=252, vol=1.171000e+03
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   68 and name  HB2) 4.773 2.848 2.848 weight 1.000 ! spec=13Cnoesy, no=313, id=254, vol=6.301000e+02
assign (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   68 and name  HB2) 4.773 2.848 2.848 weight 1.000 ! spec=13Cnoesy, no=313, id=254, vol=6.301000e+02
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name   HA) 3.391 1.437 1.437 weight 1.000 ! spec=13Cnoesy, no=316, id=257, vol=6.311000e+02
assign (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   14 and name   HA) 3.391 1.437 1.437 weight 1.000 ! spec=13Cnoesy, no=316, id=257, vol=6.311000e+02
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   15 and name   HA) 4.464 2.491 2.491 weight 1.000 ! spec=13Cnoesy, no=320, id=260, vol=2.729000e+02
assign (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   15 and name   HA) 4.464 2.491 2.491 weight 1.000 ! spec=13Cnoesy, no=320, id=260, vol=2.729000e+02
assign (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   95 and name  HB1) 2.294 0.658 0.658 weight 1.000 ! spec=13Cnoesy, no=326, id=265, vol=6.147000e+03
assign (segid "   B" and resid   95 and name  HG2) (segid "   B" and resid   95 and name  HB1) 2.294 0.658 0.658 weight 1.000 ! spec=13Cnoesy, no=326, id=265, vol=6.147000e+03
assign (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name  HB2) 3.563 1.587 1.587 weight 1.000 ! spec=13Cnoesy, no=329, id=268, vol=5.267000e+02
assign (segid "   B" and resid  100 and name   HA) (segid "   B" and resid  100 and name  HB2) 3.563 1.587 1.587 weight 1.000 ! spec=13Cnoesy, no=329, id=268, vol=5.267000e+02
assign (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   90 and name   HG) 2.647 0.876 0.876 weight 1.000 ! spec=13Cnoesy, no=339, id=274, vol=5.822000e+02
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   90 and name   HG)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   90 and name   HG)
assign (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   90 and name   HG) 2.647 0.876 0.876 weight 1.000 ! spec=13Cnoesy, no=339, id=274, vol=5.822000e+02
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   90 and name   HG)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   90 and name   HG)
assign (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   42 and name HG22) 3.255 1.325 1.325 weight 1.000 ! spec=13Cnoesy, no=341, id=276, vol=1.519000e+03
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   42 and name HG23)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   42 and name HG22)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   42 and name HG23)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   42 and name HG22)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   42 and name HG23)
assign (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   42 and name HG22) 3.255 1.325 1.325 weight 1.000 ! spec=13Cnoesy, no=341, id=276, vol=1.519000e+03
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   42 and name HG23)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   42 and name HG22)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   42 and name HG23)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   42 and name HG22)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   42 and name HG23)
assign (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   39 and name HD12) 2.036 0.518 0.518 weight 1.000 ! spec=13Cnoesy, no=342, id=277, vol=2.100000e+03
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   39 and name HD13)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   39 and name HD12)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   39 and name HD13)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   39 and name HD12)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   39 and name HD12) 2.036 0.518 0.518 weight 1.000 ! spec=13Cnoesy, no=342, id=277, vol=2.100000e+03
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   39 and name HD13)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   39 and name HD12)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   39 and name HD13)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   39 and name HD12)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   39 and name HD22) 3.271 1.337 1.337 weight 1.000 ! spec=13Cnoesy, no=343, id=278, vol=1.382000e+03
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   39 and name HD23)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   39 and name HD22)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   39 and name HD23)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   39 and name HD22)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   39 and name HD23)
assign (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   39 and name HD22) 3.271 1.337 1.337 weight 1.000 ! spec=13Cnoesy, no=343, id=278, vol=1.382000e+03
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   39 and name HD23)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   39 and name HD22)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   39 and name HD23)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   39 and name HD22)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   39 and name HD23)
assign (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   68 and name  HB1) 2.533 0.802 0.802 weight 1.000 ! spec=13Cnoesy, no=346, id=281, vol=9.080000e+02
assign (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid   68 and name  HB1) 2.533 0.802 0.802 weight 1.000 ! spec=13Cnoesy, no=346, id=281, vol=9.080000e+02
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    5 and name  HD1) 4.380 2.398 2.398 weight 1.000 ! spec=13Cnoesy, no=352, id=286, vol=1.744000e+03
assign (segid "   B" and resid    4 and name  HB1) (segid "   B" and resid    5 and name  HD1) 4.380 2.398 2.398 weight 1.000 ! spec=13Cnoesy, no=352, id=286, vol=1.744000e+03
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name   HA) 2.883 1.039 1.039 weight 1.000 ! spec=13Cnoesy, no=355, id=289, vol=2.652000e+03
assign (segid "   B" and resid    4 and name  HB1) (segid "   B" and resid    4 and name   HA) 2.883 1.039 1.039 weight 1.000 ! spec=13Cnoesy, no=355, id=289, vol=2.652000e+03
assign (segid "   A" and resid  117 and name HG21) (segid "   A" and resid  117 and name   HB) 2.033 0.516 0.516 weight 1.000 ! spec=13Cnoesy, no=356, id=290, vol=6.492000e+03
    or (segid "   A" and resid  117 and name HG22) (segid "   A" and resid  117 and name   HB)
    or (segid "   A" and resid  117 and name HG23) (segid "   A" and resid  117 and name   HB)
assign (segid "   B" and resid  117 and name HG21) (segid "   B" and resid  117 and name   HB) 2.033 0.516 0.516 weight 1.000 ! spec=13Cnoesy, no=356, id=290, vol=6.492000e+03
    or (segid "   B" and resid  117 and name HG22) (segid "   B" and resid  117 and name   HB)
    or (segid "   B" and resid  117 and name HG23) (segid "   B" and resid  117 and name   HB)
assign (segid "   A" and resid  117 and name HG21) (segid "   A" and resid  118 and name   HN) 4.123 2.125 2.125 weight 1.000 ! spec=13Cnoesy, no=357, id=291, vol=1.773000e+03
    or (segid "   A" and resid  117 and name HG22) (segid "   A" and resid  118 and name   HN)
    or (segid "   A" and resid  117 and name HG23) (segid "   A" and resid  118 and name   HN)
assign (segid "   B" and resid  117 and name HG21) (segid "   B" and resid  118 and name   HN) 4.123 2.125 2.125 weight 1.000 ! spec=13Cnoesy, no=357, id=291, vol=1.773000e+03
    or (segid "   B" and resid  117 and name HG22) (segid "   B" and resid  118 and name   HN)
    or (segid "   B" and resid  117 and name HG23) (segid "   B" and resid  118 and name   HN)
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   18 and name HG12) 4.094 2.095 2.095 weight 1.000 ! spec=13Cnoesy, no=374, id=302, vol=1.332000e+03
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   18 and name HG13)
assign (segid "   B" and resid   17 and name  HB1) (segid "   B" and resid   18 and name HG12) 4.094 2.095 2.095 weight 1.000 ! spec=13Cnoesy, no=374, id=302, vol=1.332000e+03
    or (segid "   B" and resid   17 and name  HB1) (segid "   B" and resid   18 and name HG11)
    or (segid "   B" and resid   17 and name  HB1) (segid "   B" and resid   18 and name HG13)
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid  108 and name  HB1) 4.504 2.536 2.536 weight 1.000 ! spec=13Cnoesy, no=377, id=305, vol=5.061000e+02
assign (segid "   B" and resid   17 and name  HB1) (segid "   B" and resid  108 and name  HB1) 4.504 2.536 2.536 weight 1.000 ! spec=13Cnoesy, no=377, id=305, vol=5.061000e+02
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG12) 2.208 0.609 0.609 weight 1.000 ! spec=13Cnoesy, no=378, id=306, vol=2.227000e+03
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG13)
assign (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   14 and name HG12) 2.208 0.609 0.609 weight 1.000 ! spec=13Cnoesy, no=378, id=306, vol=2.227000e+03
    or (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   14 and name HG11)
    or (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   14 and name HG13)
assign (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   14 and name HG12) 4.367 2.384 2.384 weight 1.000 ! spec=13Cnoesy, no=379, id=307, vol=9.535000e+02
    or (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   14 and name HG13)
assign (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid   14 and name HG12) 4.367 2.384 2.384 weight 1.000 ! spec=13Cnoesy, no=379, id=307, vol=9.535000e+02
    or (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid   14 and name HG11)
    or (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid   14 and name HG13)
assign (segid "   A" and resid   14 and name HG12) (segid "   A" and resid   69 and name   HN) 4.083 2.084 2.084 weight 1.000 ! spec=13Cnoesy, no=381, id=308, vol=6.814000e+02
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid   69 and name   HN)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid   69 and name   HN)
assign (segid "   B" and resid   14 and name HG12) (segid "   B" and resid   69 and name   HN) 4.083 2.084 2.084 weight 1.000 ! spec=13Cnoesy, no=381, id=308, vol=6.814000e+02
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid   69 and name   HN)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid   69 and name   HN)
assign (segid "   A" and resid   14 and name HG12) (segid "   A" and resid   15 and name  HB1) 4.305 2.316 2.316 weight 1.000 ! spec=13Cnoesy, no=385, id=312, vol=9.620000e+02
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid   15 and name  HB1)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid   15 and name  HB1)
assign (segid "   B" and resid   14 and name HG12) (segid "   B" and resid   15 and name  HB1) 4.305 2.316 2.316 weight 1.000 ! spec=13Cnoesy, no=385, id=312, vol=9.620000e+02
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid   15 and name  HB1)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid   15 and name  HB1)
assign (segid "   A" and resid   14 and name HG12) (segid "   A" and resid  110 and name  HB1) 3.205 1.284 1.284 weight 1.000 ! spec=13Cnoesy, no=387, id=314, vol=2.816000e+03
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid  110 and name  HB1)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid  110 and name  HB1)
assign (segid "   B" and resid   14 and name HG12) (segid "   B" and resid  110 and name  HB1) 3.205 1.284 1.284 weight 1.000 ! spec=13Cnoesy, no=387, id=314, vol=2.816000e+03
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid  110 and name  HB1)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid  110 and name  HB1)
assign (segid "   A" and resid  115 and name   HA) (segid "   A" and resid  115 and name  HG2) 4.471 2.499 2.499 weight 1.000 ! spec=13Cnoesy, no=390, id=316, vol=4.354000e+02
assign (segid "   B" and resid  115 and name   HA) (segid "   B" and resid  115 and name  HG2) 4.471 2.499 2.499 weight 1.000 ! spec=13Cnoesy, no=390, id=316, vol=4.354000e+02
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    2 and name   HN) 5.284 3.490 3.490 weight 1.000 ! spec=13Cnoesy, no=403, id=324, vol=3.696000e+02
assign (segid "   B" and resid    2 and name  HB2) (segid "   B" and resid    2 and name   HN) 5.284 3.490 3.490 weight 1.000 ! spec=13Cnoesy, no=403, id=324, vol=3.696000e+02
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name  HD2) 2.551 0.814 0.814 weight 1.000 ! spec=13Cnoesy, no=404, id=325, vol=7.522000e+03
assign (segid "   B" and resid   95 and name  HB2) (segid "   B" and resid   95 and name  HD2) 2.551 0.814 0.814 weight 1.000 ! spec=13Cnoesy, no=404, id=325, vol=7.522000e+03
assign (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   95 and name  HD2) 1.795 1.795 4.205 weight 1.000 ! spec=13Cnoesy, no=405, id=326, vol=2.462000e+04
assign (segid "   B" and resid   95 and name  HG2) (segid "   B" and resid   95 and name  HD2) 1.795 1.795 4.205 weight 1.000 ! spec=13Cnoesy, no=405, id=326, vol=2.462000e+04
assign (segid "   A" and resid   95 and name  HD2) (segid "   A" and resid   95 and name   HN) 4.691 2.750 2.750 weight 1.000 ! spec=13Cnoesy, no=406, id=327, vol=1.178000e+03
assign (segid "   B" and resid   95 and name  HD2) (segid "   B" and resid   95 and name   HN) 4.691 2.750 2.750 weight 1.000 ! spec=13Cnoesy, no=406, id=327, vol=1.178000e+03
assign (segid "   A" and resid   95 and name  HD2) (segid "   A" and resid   95 and name   HA) 4.405 2.425 2.425 weight 1.000 ! spec=13Cnoesy, no=410, id=330, vol=2.432000e+03
assign (segid "   B" and resid   95 and name  HD2) (segid "   B" and resid   95 and name   HA) 4.405 2.425 2.425 weight 1.000 ! spec=13Cnoesy, no=410, id=330, vol=2.432000e+03
assign (segid "   A" and resid   95 and name  HD2) (segid "   A" and resid   95 and name  HE1) 1.897 0.450 0.450 weight 1.000 ! spec=13Cnoesy, no=411, id=331, vol=1.773000e+04
assign (segid "   B" and resid   95 and name  HD2) (segid "   B" and resid   95 and name  HE1) 1.897 0.450 0.450 weight 1.000 ! spec=13Cnoesy, no=411, id=331, vol=1.773000e+04
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   63 and name  HD1) 3.333 1.389 1.389 weight 1.000 ! spec=13Cnoesy, no=415, id=333, vol=5.409000e+02
assign (segid "   B" and resid   63 and name  HG2) (segid "   B" and resid   63 and name  HD1) 3.333 1.389 1.389 weight 1.000 ! spec=13Cnoesy, no=415, id=333, vol=5.409000e+02
assign (segid "   A" and resid   63 and name  HD1) (segid "   A" and resid   63 and name  HG1) 3.718 1.728 1.728 weight 1.000 ! spec=13Cnoesy, no=416, id=334, vol=6.783000e+02
assign (segid "   B" and resid   63 and name  HD1) (segid "   B" and resid   63 and name  HG1) 3.718 1.728 1.728 weight 1.000 ! spec=13Cnoesy, no=416, id=334, vol=6.783000e+02
assign (segid "   A" and resid   63 and name  HD1) (segid "   A" and resid   63 and name  HB2) 4.882 2.979 2.979 weight 1.000 ! spec=13Cnoesy, no=420, id=336, vol=6.783000e+02
assign (segid "   B" and resid   63 and name  HD1) (segid "   B" and resid   63 and name  HB2) 4.882 2.979 2.979 weight 1.000 ! spec=13Cnoesy, no=420, id=336, vol=6.783000e+02
assign (segid "   A" and resid   63 and name  HD1) (segid "   A" and resid   63 and name   HA) 5.163 3.332 3.332 weight 1.000 ! spec=13Cnoesy, no=423, id=338, vol=3.857000e+02
assign (segid "   B" and resid   63 and name  HD1) (segid "   B" and resid   63 and name   HA) 5.163 3.332 3.332 weight 1.000 ! spec=13Cnoesy, no=423, id=338, vol=3.857000e+02
assign (segid "   A" and resid   65 and name   HA) (segid "   A" and resid   65 and name  HG2) 2.929 1.072 1.072 weight 1.000 ! spec=13Cnoesy, no=425, id=340, vol=4.957000e+03
assign (segid "   B" and resid   65 and name   HA) (segid "   B" and resid   65 and name  HG2) 2.929 1.072 1.072 weight 1.000 ! spec=13Cnoesy, no=425, id=340, vol=4.957000e+03
assign (segid "   A" and resid   65 and name  HG2) (segid "   A" and resid   65 and name  HB2) 2.165 0.586 0.586 weight 1.000 ! spec=13Cnoesy, no=426, id=341, vol=1.838000e+04
assign (segid "   B" and resid   65 and name  HG2) (segid "   B" and resid   65 and name  HB2) 2.165 0.586 0.586 weight 1.000 ! spec=13Cnoesy, no=426, id=341, vol=1.838000e+04
assign (segid "   A" and resid   65 and name  HG2) (segid "   A" and resid   62 and name  HB2) 5.479 3.752 3.752 weight 1.000 ! spec=13Cnoesy, no=428, id=342, vol=3.449000e+02
assign (segid "   B" and resid   65 and name  HG2) (segid "   B" and resid   62 and name  HB2) 5.479 3.752 3.752 weight 1.000 ! spec=13Cnoesy, no=428, id=342, vol=3.449000e+02
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG12) 1.512 1.512 4.488 weight 1.000 ! spec=13Cnoesy, no=430, id=344, vol=1.423000e+04
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG13)
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   18 and name HG12) 1.512 1.512 4.488 weight 1.000 ! spec=13Cnoesy, no=430, id=344, vol=1.423000e+04
    or (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   18 and name HG11)
    or (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   18 and name HG13)
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name   HA) 2.317 0.671 0.671 weight 1.000 ! spec=13Cnoesy, no=432, id=346, vol=3.568000e+03
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   18 and name   HA) 2.317 0.671 0.671 weight 1.000 ! spec=13Cnoesy, no=432, id=346, vol=3.568000e+03
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   59 and name  HB2) 3.413 1.456 1.456 weight 1.000 ! spec=13Cnoesy, no=443, id=356, vol=4.807000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   59 and name  HB2)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   59 and name  HB2)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   59 and name  HB2) 3.413 1.456 1.456 weight 1.000 ! spec=13Cnoesy, no=443, id=356, vol=4.807000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   59 and name  HB2)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   59 and name  HB2)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   59 and name  HD2) 3.921 1.922 1.922 weight 1.000 ! spec=13Cnoesy, no=445, id=358, vol=1.360000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   59 and name  HD2)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   59 and name  HD2)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   59 and name  HD2) 3.921 1.922 1.922 weight 1.000 ! spec=13Cnoesy, no=445, id=358, vol=1.360000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   59 and name  HD2)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   59 and name  HD2)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name   HA) 2.648 0.877 0.877 weight 1.000 ! spec=13Cnoesy, no=448, id=360, vol=5.737000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   18 and name   HA)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   18 and name   HA) 2.648 0.877 0.877 weight 1.000 ! spec=13Cnoesy, no=448, id=360, vol=5.737000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   18 and name   HA)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   18 and name   HA)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   57 and name  HB2) 1.595 0.318 0.318 weight 1.000 ! spec=13Cnoesy, no=451, id=363, vol=8.658000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   57 and name  HB2)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   57 and name  HB2)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   57 and name  HB2) 1.595 0.318 0.318 weight 1.000 ! spec=13Cnoesy, no=451, id=363, vol=8.658000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   57 and name  HB2)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   57 and name  HB2)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   59 and name  HG1) 2.327 0.677 0.677 weight 1.000 ! spec=13Cnoesy, no=452, id=364, vol=4.824000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   59 and name  HG1)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   59 and name  HG1)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   59 and name  HG1) 2.327 0.677 0.677 weight 1.000 ! spec=13Cnoesy, no=452, id=364, vol=4.824000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   59 and name  HG1)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   59 and name  HG1)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   59 and name  HB1) 2.266 2.266 3.734 weight 1.000 ! spec=13Cnoesy, no=454, id=366, vol=4.750000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   59 and name  HB1)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   59 and name  HB1)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   59 and name  HB1) 2.266 2.266 3.734 weight 1.000 ! spec=13Cnoesy, no=454, id=366, vol=4.750000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   59 and name  HB1)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   59 and name  HB1)
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name  HB2) 2.376 0.705 0.705 weight 1.000 ! spec=13Cnoesy, no=456, id=368, vol=1.465000e+03
assign (segid "   B" and resid   17 and name  HB1) (segid "   B" and resid   17 and name  HB2) 2.376 0.705 0.705 weight 1.000 ! spec=13Cnoesy, no=456, id=368, vol=1.465000e+03
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   17 and name  HB2) 4.718 2.782 2.782 weight 1.000 ! spec=13Cnoesy, no=457, id=369, vol=1.412000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   17 and name  HB2)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   17 and name  HB2)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   17 and name  HB2) 4.718 2.782 2.782 weight 1.000 ! spec=13Cnoesy, no=457, id=369, vol=1.412000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   17 and name  HB2)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   17 and name  HB2)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name   HA) 3.616 1.634 1.634 weight 1.000 ! spec=13Cnoesy, no=458, id=370, vol=8.040000e+02
assign (segid "   B" and resid   17 and name  HB2) (segid "   B" and resid   17 and name   HA) 3.616 1.634 1.634 weight 1.000 ! spec=13Cnoesy, no=458, id=370, vol=8.040000e+02
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid  108 and name  HB1) 5.868 4.304 4.304 weight 1.000 ! spec=13Cnoesy, no=459, id=371, vol=3.354000e+02
assign (segid "   B" and resid   17 and name  HB2) (segid "   B" and resid  108 and name  HB1) 5.868 4.304 4.304 weight 1.000 ! spec=13Cnoesy, no=459, id=371, vol=3.354000e+02
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   36 and name   HA) 2.569 0.825 0.825 weight 1.000 ! spec=13Cnoesy, no=460, id=372, vol=2.897000e+03
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name   HA)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   36 and name   HA)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name   HA) 2.569 0.825 0.825 weight 1.000 ! spec=13Cnoesy, no=460, id=372, vol=2.897000e+03
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name   HA)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   36 and name   HA)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   91 and name   HB) 3.184 1.267 1.267 weight 1.000 ! spec=13Cnoesy, no=463, id=375, vol=2.316000e+03
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   91 and name   HB)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   91 and name   HB)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   91 and name   HB) 3.184 1.267 1.267 weight 1.000 ! spec=13Cnoesy, no=463, id=375, vol=2.316000e+03
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   91 and name   HB)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   91 and name   HB)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   29 and name   HN) 4.225 2.231 2.231 weight 1.000 ! spec=13Cnoesy, no=464, id=376, vol=6.392000e+02
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   29 and name   HN)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   29 and name   HN) 4.225 2.231 2.231 weight 1.000 ! spec=13Cnoesy, no=464, id=376, vol=6.392000e+02
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   29 and name   HN)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   29 and name   HN)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   30 and name   HA) 3.652 1.667 1.667 weight 1.000 ! spec=13Cnoesy, no=466, id=378, vol=1.374000e+03
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   30 and name   HA)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   30 and name   HA)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   30 and name   HA) 3.652 1.667 1.667 weight 1.000 ! spec=13Cnoesy, no=466, id=378, vol=1.374000e+03
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   30 and name   HA)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   30 and name   HA)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   35 and name  HB2) 4.012 2.012 2.012 weight 1.000 ! spec=13Cnoesy, no=469, id=381, vol=9.293000e+02
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   35 and name  HB2)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   35 and name  HB2)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   35 and name  HB2) 4.012 2.012 2.012 weight 1.000 ! spec=13Cnoesy, no=469, id=381, vol=9.293000e+02
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   35 and name  HB2)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   35 and name  HB2)
assign (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name   HA) 3.094 1.197 1.197 weight 1.000 ! spec=13Cnoesy, no=477, id=388, vol=1.199000e+03
assign (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name   HA) 3.094 1.197 1.197 weight 1.000 ! spec=13Cnoesy, no=477, id=388, vol=1.199000e+03
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HG11) 2.921 1.066 1.066 weight 1.000 ! spec=13Cnoesy, no=480, id=391, vol=1.712000e+03
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name HG11) 2.921 1.066 1.066 weight 1.000 ! spec=13Cnoesy, no=480, id=391, vol=1.712000e+03
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HG12) 3.651 1.667 1.667 weight 1.000 ! spec=13Cnoesy, no=481, id=392, vol=1.573000e+03
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name HG12) 3.651 1.667 1.667 weight 1.000 ! spec=13Cnoesy, no=481, id=392, vol=1.573000e+03
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HG22) 3.454 1.491 1.491 weight 1.000 ! spec=13Cnoesy, no=482, id=393, vol=1.813000e+03
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name HG22) 3.454 1.491 1.491 weight 1.000 ! spec=13Cnoesy, no=482, id=393, vol=1.813000e+03
    or (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   32 and name  HB2) 5.147 3.311 3.311 weight 1.000 ! spec=13Cnoesy, no=484, id=394, vol=4.407000e+02
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   32 and name  HB2) 5.147 3.311 3.311 weight 1.000 ! spec=13Cnoesy, no=484, id=394, vol=4.407000e+02
assign (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   81 and name HG21) 3.348 1.401 1.401 weight 1.000 ! spec=13Cnoesy, no=489, id=396, vol=9.677000e+02
    or (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   81 and name HG22)
    or (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   81 and name HG23)
assign (segid "   B" and resid   81 and name   HA) (segid "   B" and resid   81 and name HG21) 3.348 1.401 1.401 weight 1.000 ! spec=13Cnoesy, no=489, id=396, vol=9.677000e+02
    or (segid "   B" and resid   81 and name   HA) (segid "   B" and resid   81 and name HG22)
    or (segid "   B" and resid   81 and name   HA) (segid "   B" and resid   81 and name HG23)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   20 and name HG12) 1.311 1.311 4.689 weight 1.000 ! spec=13Cnoesy, no=510, id=406, vol=1.611000e+04
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   20 and name HG11)
    or (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   20 and name HG13)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   20 and name HG12)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   20 and name HG11)
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   20 and name HG13)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   20 and name HG12)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   20 and name HG11)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   20 and name HG13)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   20 and name HG12) 1.311 1.311 4.689 weight 1.000 ! spec=13Cnoesy, no=510, id=406, vol=1.611000e+04
    or (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   20 and name HG11)
    or (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   20 and name HG13)
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   20 and name HG12)
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   20 and name HG11)
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   20 and name HG13)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   20 and name HG12)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   20 and name HG11)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   20 and name HG13)
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   22 and name HG22) 3.781 1.787 1.787 weight 1.000 ! spec=13Cnoesy, no=511, id=407, vol=1.844000e+03
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   22 and name HG23)
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   22 and name HG22) 3.781 1.787 1.787 weight 1.000 ! spec=13Cnoesy, no=511, id=407, vol=1.844000e+03
    or (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   22 and name HG21)
    or (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   22 and name HG23)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name   HB) 1.859 0.432 0.432 weight 1.000 ! spec=13Cnoesy, no=513, id=409, vol=4.835000e+03
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name   HB)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name   HB)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   22 and name   HB) 1.859 0.432 0.432 weight 1.000 ! spec=13Cnoesy, no=513, id=409, vol=4.835000e+03
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   22 and name   HB)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   22 and name   HB)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   21 and name  HB2) 4.922 3.028 3.028 weight 1.000 ! spec=13Cnoesy, no=514, id=410, vol=6.432000e+02
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   21 and name  HB2)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   21 and name  HB2) 4.922 3.028 3.028 weight 1.000 ! spec=13Cnoesy, no=514, id=410, vol=6.432000e+02
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   21 and name  HB2)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   21 and name  HB2)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name   HA) 2.409 0.725 0.725 weight 1.000 ! spec=13Cnoesy, no=515, id=411, vol=3.283000e+03
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name   HA)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name   HA)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   22 and name   HA) 2.409 0.725 0.725 weight 1.000 ! spec=13Cnoesy, no=515, id=411, vol=3.283000e+03
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   22 and name   HA)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   22 and name   HA)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   55 and name  HG2) 3.782 1.787 1.787 weight 1.000 ! spec=13Cnoesy, no=517, id=413, vol=9.904000e+02
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   55 and name  HG2)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   55 and name  HG2)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   55 and name  HG2) 3.782 1.787 1.787 weight 1.000 ! spec=13Cnoesy, no=517, id=413, vol=9.904000e+02
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   55 and name  HG2)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   55 and name  HG2)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   55 and name  HG1) 2.572 0.827 0.827 weight 1.000 ! spec=13Cnoesy, no=518, id=414, vol=1.664000e+03
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   55 and name  HG1)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   55 and name  HG1)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   55 and name  HG1) 2.572 0.827 0.827 weight 1.000 ! spec=13Cnoesy, no=518, id=414, vol=1.664000e+03
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   55 and name  HG1)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   55 and name  HG1)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   20 and name   HB) 2.321 0.673 0.673 weight 1.000 ! spec=13Cnoesy, no=520, id=416, vol=2.449000e+03
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   20 and name   HB)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   20 and name   HB)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   20 and name   HB) 2.321 0.673 0.673 weight 1.000 ! spec=13Cnoesy, no=520, id=416, vol=2.449000e+03
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   20 and name   HB)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   20 and name   HB)
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name   HB) 2.938 1.079 1.079 weight 1.000 ! spec=13Cnoesy, no=524, id=419, vol=1.039000e+03
assign (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   91 and name   HB) 2.938 1.079 1.079 weight 1.000 ! spec=13Cnoesy, no=524, id=419, vol=1.039000e+03
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name HG21) 2.720 0.925 0.925 weight 1.000 ! spec=13Cnoesy, no=526, id=421, vol=1.716000e+03
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name HG22)
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name HG23)
assign (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   91 and name HG21) 2.720 0.925 0.925 weight 1.000 ! spec=13Cnoesy, no=526, id=421, vol=1.716000e+03
    or (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   91 and name HG22)
    or (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   91 and name HG23)
assign (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  110 and name  HB1) 5.431 3.686 3.686 weight 1.000 ! spec=13Cnoesy, no=538, id=432, vol=6.085000e+02
assign (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  110 and name  HB1) 5.431 3.686 3.686 weight 1.000 ! spec=13Cnoesy, no=538, id=432, vol=6.085000e+02
assign (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name  HG1) 4.814 2.896 2.896 weight 1.000 ! spec=13Cnoesy, no=542, id=436, vol=7.678000e+02
assign (segid "   B" and resid  100 and name   HA) (segid "   B" and resid  100 and name  HG1) 4.814 2.896 2.896 weight 1.000 ! spec=13Cnoesy, no=542, id=436, vol=7.678000e+02
assign (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   58 and name   HN) 5.078 3.224 3.224 weight 1.000 ! spec=13Cnoesy, no=551, id=442, vol=3.771000e+02
assign (segid "   B" and resid   58 and name  HB1) (segid "   B" and resid   58 and name   HN) 5.078 3.224 3.224 weight 1.000 ! spec=13Cnoesy, no=551, id=442, vol=3.771000e+02
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name  HD2) 3.465 1.501 1.501 weight 1.000 ! spec=13Cnoesy, no=579, id=461, vol=1.599000e+03
assign (segid "   B" and resid   59 and name  HB2) (segid "   B" and resid   59 and name  HD2) 3.465 1.501 1.501 weight 1.000 ! spec=13Cnoesy, no=579, id=461, vol=1.599000e+03
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name  HB1) 1.683 0.354 0.354 weight 1.000 ! spec=13Cnoesy, no=585, id=466, vol=8.033000e+03
assign (segid "   B" and resid   59 and name  HB2) (segid "   B" and resid   59 and name  HB1) 1.683 0.354 0.354 weight 1.000 ! spec=13Cnoesy, no=585, id=466, vol=8.033000e+03
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name   HZ) 4.607 2.653 2.653 weight 1.000 ! spec=13Cnoesy, no=586, id=467, vol=7.557000e+02
assign (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   86 and name   HZ) 4.607 2.653 2.653 weight 1.000 ! spec=13Cnoesy, no=586, id=467, vol=7.557000e+02
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name  HB2) 2.599 0.844 0.844 weight 1.000 ! spec=13Cnoesy, no=593, id=473, vol=1.192000e+03
assign (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   86 and name  HB2) 2.599 0.844 0.844 weight 1.000 ! spec=13Cnoesy, no=593, id=473, vol=1.192000e+03
assign (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  105 and name   HN) 3.329 1.385 1.385 weight 1.000 ! spec=13Cnoesy, no=594, id=474, vol=1.020000e+03
assign (segid "   B" and resid  105 and name   HA) (segid "   B" and resid  105 and name   HN) 3.329 1.385 1.385 weight 1.000 ! spec=13Cnoesy, no=594, id=474, vol=1.020000e+03
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name  HB1) 3.928 1.929 1.929 weight 1.000 ! spec=13Cnoesy, no=599, id=476, vol=6.221000e+02
assign (segid "   B" and resid   80 and name   HA) (segid "   B" and resid   80 and name  HB1) 3.928 1.929 1.929 weight 1.000 ! spec=13Cnoesy, no=599, id=476, vol=6.221000e+02
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid  110 and name   HA) 3.380 1.428 1.428 weight 1.000 ! spec=13Cnoesy, no=601, id=478, vol=8.582000e+02
assign (segid "   B" and resid   80 and name   HA) (segid "   B" and resid  110 and name   HA) 3.380 1.428 1.428 weight 1.000 ! spec=13Cnoesy, no=601, id=478, vol=8.582000e+02
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name  HB2) 3.349 1.402 1.402 weight 1.000 ! spec=13Cnoesy, no=603, id=480, vol=8.673000e+02
assign (segid "   B" and resid   80 and name   HA) (segid "   B" and resid   80 and name  HB2) 3.349 1.402 1.402 weight 1.000 ! spec=13Cnoesy, no=603, id=480, vol=8.673000e+02
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   22 and name   HB) 4.935 3.044 3.044 weight 1.000 ! spec=13Cnoesy, no=606, id=483, vol=8.040000e+02
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   22 and name   HB) 4.935 3.044 3.044 weight 1.000 ! spec=13Cnoesy, no=606, id=483, vol=8.040000e+02
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name   HA) 3.272 1.338 1.338 weight 1.000 ! spec=13Cnoesy, no=611, id=487, vol=7.738000e+02
assign (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   22 and name   HA) 3.272 1.338 1.338 weight 1.000 ! spec=13Cnoesy, no=611, id=487, vol=7.738000e+02
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   20 and name HG12) 3.383 1.430 1.430 weight 1.000 ! spec=13Cnoesy, no=613, id=489, vol=9.463000e+02
    or (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   20 and name HG11)
    or (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   20 and name HG13)
assign (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   20 and name HG12) 3.383 1.430 1.430 weight 1.000 ! spec=13Cnoesy, no=613, id=489, vol=9.463000e+02
    or (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   20 and name HG11)
    or (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   20 and name HG13)
assign (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   43 and name   HN) 4.331 2.345 2.345 weight 1.000 ! spec=13Cnoesy, no=616, id=492, vol=3.031000e+02
assign (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   43 and name   HN) 4.331 2.345 2.345 weight 1.000 ! spec=13Cnoesy, no=616, id=492, vol=3.031000e+02
assign (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   42 and name   HA) 2.976 1.107 1.107 weight 1.000 ! spec=13Cnoesy, no=617, id=493, vol=6.432000e+02
assign (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   42 and name   HA) 2.976 1.107 1.107 weight 1.000 ! spec=13Cnoesy, no=617, id=493, vol=6.432000e+02
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid  104 and name HD12) 3.921 1.922 1.922 weight 1.000 ! spec=13Cnoesy, no=622, id=498, vol=8.770000e+02
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid  104 and name HD11)
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid  104 and name HD13)
assign (segid "   B" and resid   85 and name   HB) (segid "   B" and resid  104 and name HD12) 3.921 1.922 1.922 weight 1.000 ! spec=13Cnoesy, no=622, id=498, vol=8.770000e+02
    or (segid "   B" and resid   85 and name   HB) (segid "   B" and resid  104 and name HD11)
    or (segid "   B" and resid   85 and name   HB) (segid "   B" and resid  104 and name HD13)
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid  106 and name HG21) 2.151 0.578 0.578 weight 1.000 ! spec=13Cnoesy, no=626, id=501, vol=3.335000e+03
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid  106 and name HG22)
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid  106 and name HG23)
assign (segid "   B" and resid   85 and name   HB) (segid "   B" and resid  106 and name HG21) 2.151 0.578 0.578 weight 1.000 ! spec=13Cnoesy, no=626, id=501, vol=3.335000e+03
    or (segid "   B" and resid   85 and name   HB) (segid "   B" and resid  106 and name HG22)
    or (segid "   B" and resid   85 and name   HB) (segid "   B" and resid  106 and name HG23)
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name  HG1) 3.466 1.502 1.502 weight 1.000 ! spec=13Cnoesy, no=627, id=502, vol=4.507000e+02
assign (segid "   B" and resid   85 and name   HB) (segid "   B" and resid   85 and name  HG1) 3.466 1.502 1.502 weight 1.000 ! spec=13Cnoesy, no=627, id=502, vol=4.507000e+02
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name  HD1) 4.492 2.522 2.522 weight 1.000 ! spec=13Cnoesy, no=635, id=506, vol=3.163000e+02
assign (segid "   B" and resid    5 and name  HG1) (segid "   B" and resid    5 and name  HD1) 4.492 2.522 2.522 weight 1.000 ! spec=13Cnoesy, no=635, id=506, vol=3.163000e+02
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name   HA) 5.032 3.165 3.165 weight 1.000 ! spec=13Cnoesy, no=637, id=508, vol=4.289000e+02
assign (segid "   B" and resid    5 and name  HD1) (segid "   B" and resid    5 and name   HA) 5.032 3.165 3.165 weight 1.000 ! spec=13Cnoesy, no=637, id=508, vol=4.289000e+02
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HG2) 2.353 0.692 0.692 weight 1.000 ! spec=13Cnoesy, no=639, id=510, vol=4.937000e+03
assign (segid "   B" and resid    5 and name  HD1) (segid "   B" and resid    5 and name  HG2) 2.353 0.692 0.692 weight 1.000 ! spec=13Cnoesy, no=639, id=510, vol=4.937000e+03
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HD2) 1.680 0.353 0.353 weight 1.000 ! spec=13Cnoesy, no=640, id=511, vol=1.500000e+04
assign (segid "   B" and resid    5 and name  HD1) (segid "   B" and resid    5 and name  HD2) 1.680 0.353 0.353 weight 1.000 ! spec=13Cnoesy, no=640, id=511, vol=1.500000e+04
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    4 and name   HA) 2.546 0.811 0.811 weight 1.000 ! spec=13Cnoesy, no=643, id=514, vol=4.932000e+03
assign (segid "   B" and resid    5 and name  HD1) (segid "   B" and resid    4 and name   HA) 2.546 0.811 0.811 weight 1.000 ! spec=13Cnoesy, no=643, id=514, vol=4.932000e+03
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   60 and name   HA) 2.729 0.931 0.931 weight 1.000 ! spec=13Cnoesy, no=645, id=516, vol=1.175000e+03
    or (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   60 and name   HA)
    or (segid "   A" and resid   60 and name  HB3) (segid "   A" and resid   60 and name   HA)
assign (segid "   B" and resid   60 and name  HB2) (segid "   B" and resid   60 and name   HA) 2.729 0.931 0.931 weight 1.000 ! spec=13Cnoesy, no=645, id=516, vol=1.175000e+03
    or (segid "   B" and resid   60 and name  HB1) (segid "   B" and resid   60 and name   HA)
    or (segid "   B" and resid   60 and name  HB3) (segid "   B" and resid   60 and name   HA)
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HE2) 2.610 0.851 0.851 weight 1.000 ! spec=13Cnoesy, no=646, id=517, vol=5.327000e+03
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name  HE2) 2.610 0.851 0.851 weight 1.000 ! spec=13Cnoesy, no=646, id=517, vol=5.327000e+03
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   57 and name  HE2) 3.971 1.971 1.971 weight 1.000 ! spec=13Cnoesy, no=647, id=518, vol=2.012000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   57 and name  HE2)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   57 and name  HE2)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   57 and name  HE2) 3.971 1.971 1.971 weight 1.000 ! spec=13Cnoesy, no=647, id=518, vol=2.012000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   57 and name  HE2)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   57 and name  HE2)
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HG1) 3.045 1.159 1.159 weight 1.000 ! spec=13Cnoesy, no=650, id=521, vol=5.110000e+03
assign (segid "   B" and resid   57 and name  HE2) (segid "   B" and resid   57 and name  HG1) 3.045 1.159 1.159 weight 1.000 ! spec=13Cnoesy, no=650, id=521, vol=5.110000e+03
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HB2) 3.540 1.567 1.567 weight 1.000 ! spec=13Cnoesy, no=653, id=524, vol=1.218000e+03
assign (segid "   B" and resid   57 and name  HE2) (segid "   B" and resid   57 and name  HB2) 3.540 1.567 1.567 weight 1.000 ! spec=13Cnoesy, no=653, id=524, vol=1.218000e+03
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name HG11) 2.568 0.825 0.825 weight 1.000 ! spec=13Cnoesy, no=663, id=533, vol=2.438000e+03
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name HG11) 2.568 0.825 0.825 weight 1.000 ! spec=13Cnoesy, no=663, id=533, vol=2.438000e+03
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name HD12) 2.709 0.918 0.918 weight 1.000 ! spec=13Cnoesy, no=666, id=536, vol=1.591000e+03
    or (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name HD11)
    or (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name HD13)
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name HD12) 2.709 0.918 0.918 weight 1.000 ! spec=13Cnoesy, no=666, id=536, vol=1.591000e+03
    or (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name HD11)
    or (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name HD13)
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name HG12) 3.060 1.170 1.170 weight 1.000 ! spec=13Cnoesy, no=667, id=537, vol=1.105000e+03
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name HG12) 3.060 1.170 1.170 weight 1.000 ! spec=13Cnoesy, no=667, id=537, vol=1.105000e+03
assign (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   49 and name   HA) 3.644 1.660 1.660 weight 1.000 ! spec=13Cnoesy, no=677, id=546, vol=1.260000e+03
assign (segid "   B" and resid   49 and name  HB2) (segid "   B" and resid   49 and name   HA) 3.644 1.660 1.660 weight 1.000 ! spec=13Cnoesy, no=677, id=546, vol=1.260000e+03
assign (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   49 and name  HE1) 5.044 3.181 3.181 weight 1.000 ! spec=13Cnoesy, no=681, id=549, vol=6.492000e+02
assign (segid "   B" and resid   49 and name  HB2) (segid "   B" and resid   49 and name  HE1) 5.044 3.181 3.181 weight 1.000 ! spec=13Cnoesy, no=681, id=549, vol=6.492000e+02
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   20 and name HG12) 4.044 2.044 2.044 weight 1.000 ! spec=13Cnoesy, no=703, id=564, vol=8.733000e+02
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   20 and name HG11)
    or (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   20 and name HG13)
assign (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   20 and name HG12) 4.044 2.044 2.044 weight 1.000 ! spec=13Cnoesy, no=703, id=564, vol=8.733000e+02
    or (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   20 and name HG11)
    or (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   20 and name HG13)
assign (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name HG12) 2.627 0.863 0.863 weight 1.000 ! spec=13Cnoesy, no=709, id=570, vol=3.134000e+03
    or (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name HG11)
    or (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name HG13)
assign (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  109 and name HG12) 2.627 0.863 0.863 weight 1.000 ! spec=13Cnoesy, no=709, id=570, vol=3.134000e+03
    or (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  109 and name HG11)
    or (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  109 and name HG13)
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    6 and name   HA) 5.518 3.806 3.806 weight 1.000 ! spec=13Cnoesy, no=719, id=578, vol=4.890000e+02
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    6 and name   HA) 5.518 3.806 3.806 weight 1.000 ! spec=13Cnoesy, no=719, id=578, vol=4.890000e+02
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HB2) 2.898 1.050 1.050 weight 1.000 ! spec=13Cnoesy, no=720, id=579, vol=2.559000e+03
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    5 and name  HB2) 2.898 1.050 1.050 weight 1.000 ! spec=13Cnoesy, no=720, id=579, vol=2.559000e+03
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HG2) 3.783 1.789 1.789 weight 1.000 ! spec=13Cnoesy, no=721, id=580, vol=2.563000e+03
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    5 and name  HG2) 3.783 1.789 1.789 weight 1.000 ! spec=13Cnoesy, no=721, id=580, vol=2.563000e+03
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    6 and name   HB) 3.111 1.210 1.210 weight 1.000 ! spec=13Cnoesy, no=725, id=584, vol=2.563000e+03
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    6 and name   HB) 3.111 1.210 1.210 weight 1.000 ! spec=13Cnoesy, no=725, id=584, vol=2.563000e+03
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    4 and name   HA) 5.026 3.157 3.157 weight 1.000 ! spec=13Cnoesy, no=726, id=585, vol=3.761000e+02
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    4 and name   HA) 5.026 3.157 3.157 weight 1.000 ! spec=13Cnoesy, no=726, id=585, vol=3.761000e+02
assign (segid "   A" and resid   96 and name  HG2) (segid "   A" and resid   96 and name  HB2) 2.219 0.615 0.615 weight 1.000 ! spec=13Cnoesy, no=730, id=589, vol=1.253000e+04
assign (segid "   B" and resid   96 and name  HG2) (segid "   B" and resid   96 and name  HB2) 2.219 0.615 0.615 weight 1.000 ! spec=13Cnoesy, no=730, id=589, vol=1.253000e+04
assign (segid "   A" and resid   96 and name  HG2) (segid "   A" and resid   96 and name  HB1) 2.252 0.634 0.634 weight 1.000 ! spec=13Cnoesy, no=731, id=590, vol=1.221000e+04
assign (segid "   B" and resid   96 and name  HG2) (segid "   B" and resid   96 and name  HB1) 2.252 0.634 0.634 weight 1.000 ! spec=13Cnoesy, no=731, id=590, vol=1.221000e+04
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   78 and name   HA) 3.750 1.758 1.758 weight 1.000 ! spec=13Cnoesy, no=739, id=598, vol=9.208000e+02
assign (segid "   B" and resid   78 and name  HB2) (segid "   B" and resid   78 and name   HA) 3.750 1.758 1.758 weight 1.000 ! spec=13Cnoesy, no=739, id=598, vol=9.208000e+02
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid  112 and name   HG) 4.439 2.463 2.463 weight 1.000 ! spec=13Cnoesy, no=741, id=600, vol=5.331000e+02
assign (segid "   B" and resid   78 and name   HA) (segid "   B" and resid  112 and name   HG) 4.439 2.463 2.463 weight 1.000 ! spec=13Cnoesy, no=741, id=600, vol=5.331000e+02
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   77 and name   HA) 4.438 2.462 2.462 weight 1.000 ! spec=13Cnoesy, no=743, id=602, vol=8.572000e+02
assign (segid "   B" and resid   78 and name   HA) (segid "   B" and resid   77 and name   HA) 4.438 2.462 2.462 weight 1.000 ! spec=13Cnoesy, no=743, id=602, vol=8.572000e+02
assign (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   98 and name  HB2) 2.396 0.717 0.717 weight 1.000 ! spec=13Cnoesy, no=747, id=606, vol=2.479000e+03
    or (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   98 and name  HB1)
    or (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   98 and name  HB3)
assign (segid "   B" and resid   98 and name   HA) (segid "   B" and resid   98 and name  HB2) 2.396 0.717 0.717 weight 1.000 ! spec=13Cnoesy, no=747, id=606, vol=2.479000e+03
    or (segid "   B" and resid   98 and name   HA) (segid "   B" and resid   98 and name  HB1)
    or (segid "   B" and resid   98 and name   HA) (segid "   B" and resid   98 and name  HB3)
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid   77 and name HD22) 6.352 5.043 5.043 weight 1.000 ! spec=13Cnoesy, no=750, id=609, vol=6.191000e+02
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid   77 and name HD22) 6.352 5.043 5.043 weight 1.000 ! spec=13Cnoesy, no=750, id=609, vol=6.191000e+02
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid   77 and name   HN) 3.764 1.771 1.771 weight 1.000 ! spec=13Cnoesy, no=752, id=611, vol=6.442000e+02
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid   77 and name   HN) 3.764 1.771 1.771 weight 1.000 ! spec=13Cnoesy, no=752, id=611, vol=6.442000e+02
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid   76 and name   HA) 3.275 1.341 1.341 weight 1.000 ! spec=13Cnoesy, no=753, id=612, vol=7.135000e+02
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid   76 and name   HA) 3.275 1.341 1.341 weight 1.000 ! spec=13Cnoesy, no=753, id=612, vol=7.135000e+02
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid   76 and name   HN) 3.131 1.225 1.225 weight 1.000 ! spec=13Cnoesy, no=755, id=614, vol=1.892000e+03
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid   76 and name   HN) 3.131 1.225 1.225 weight 1.000 ! spec=13Cnoesy, no=755, id=614, vol=1.892000e+03
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid   77 and name HD21) 6.635 5.503 5.503 weight 1.000 ! spec=13Cnoesy, no=757, id=616, vol=2.889000e+02
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid   77 and name HD21) 6.635 5.503 5.503 weight 1.000 ! spec=13Cnoesy, no=757, id=616, vol=2.889000e+02
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid  115 and name  HB1) 2.037 0.518 0.518 weight 1.000 ! spec=13Cnoesy, no=758, id=617, vol=7.431000e+03
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid  115 and name  HB1) 2.037 0.518 0.518 weight 1.000 ! spec=13Cnoesy, no=758, id=617, vol=7.431000e+03
assign (segid "   A" and resid  114 and name  HD2) (segid "   A" and resid  114 and name  HB2) 3.050 1.163 1.163 weight 1.000 ! spec=13Cnoesy, no=769, id=622, vol=2.313000e+03
assign (segid "   B" and resid  114 and name  HD2) (segid "   B" and resid  114 and name  HB2) 3.050 1.163 1.163 weight 1.000 ! spec=13Cnoesy, no=769, id=622, vol=2.313000e+03
assign (segid "   A" and resid  114 and name  HD2) (segid "   A" and resid  114 and name  HG2) 3.203 1.283 1.283 weight 1.000 ! spec=13Cnoesy, no=770, id=623, vol=2.680000e+03
assign (segid "   B" and resid  114 and name  HD2) (segid "   B" and resid  114 and name  HG2) 3.203 1.283 1.283 weight 1.000 ! spec=13Cnoesy, no=770, id=623, vol=2.680000e+03
assign (segid "   A" and resid  114 and name  HD2) (segid "   A" and resid   75 and name   HA) 5.476 3.749 3.749 weight 1.000 ! spec=13Cnoesy, no=771, id=624, vol=3.625000e+02
assign (segid "   B" and resid  114 and name  HD2) (segid "   B" and resid   75 and name   HA) 5.476 3.749 3.749 weight 1.000 ! spec=13Cnoesy, no=771, id=624, vol=3.625000e+02
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name  HE1) 1.133 1.133 4.867 weight 1.000 ! spec=13Cnoesy, no=773, id=625, vol=7.290000e+04
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name  HE1) 1.133 1.133 4.867 weight 1.000 ! spec=13Cnoesy, no=773, id=625, vol=7.290000e+04
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name  HE1) 2.035 0.518 0.518 weight 1.000 ! spec=13Cnoesy, no=774, id=626, vol=5.729000e+03
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   74 and name  HE1) 2.035 0.518 0.518 weight 1.000 ! spec=13Cnoesy, no=774, id=626, vol=5.729000e+03
assign (segid "   A" and resid   74 and name  HE1) (segid "   A" and resid   74 and name  HD2) 2.807 0.985 0.985 weight 1.000 ! spec=13Cnoesy, no=776, id=628, vol=5.729000e+03
assign (segid "   B" and resid   74 and name  HE1) (segid "   B" and resid   74 and name  HD2) 2.807 0.985 0.985 weight 1.000 ! spec=13Cnoesy, no=776, id=628, vol=5.729000e+03
assign (segid "   A" and resid   74 and name  HE1) (segid "   A" and resid   74 and name  HG1) 3.701 1.712 1.712 weight 1.000 ! spec=13Cnoesy, no=777, id=629, vol=3.653000e+03
assign (segid "   B" and resid   74 and name  HE1) (segid "   B" and resid   74 and name  HG1) 3.701 1.712 1.712 weight 1.000 ! spec=13Cnoesy, no=777, id=629, vol=3.653000e+03
assign (segid "   A" and resid   74 and name  HE1) (segid "   A" and resid   74 and name   HA) 5.418 3.670 3.670 weight 1.000 ! spec=13Cnoesy, no=779, id=631, vol=8.150000e+02
assign (segid "   B" and resid   74 and name  HE1) (segid "   B" and resid   74 and name   HA) 5.418 3.670 3.670 weight 1.000 ! spec=13Cnoesy, no=779, id=631, vol=8.150000e+02
assign (segid "   A" and resid   74 and name  HE1) (segid "   A" and resid   74 and name  HG2) 2.982 1.111 1.111 weight 1.000 ! spec=13Cnoesy, no=780, id=632, vol=4.574000e+03
assign (segid "   B" and resid   74 and name  HE1) (segid "   B" and resid   74 and name  HG2) 2.982 1.111 1.111 weight 1.000 ! spec=13Cnoesy, no=780, id=632, vol=4.574000e+03
assign (segid "   A" and resid   74 and name  HE1) (segid "   A" and resid   74 and name  HD1) 1.773 1.773 4.227 weight 1.000 ! spec=13Cnoesy, no=781, id=633, vol=2.009000e+04
assign (segid "   B" and resid   74 and name  HE1) (segid "   B" and resid   74 and name  HD1) 1.773 1.773 4.227 weight 1.000 ! spec=13Cnoesy, no=781, id=633, vol=2.009000e+04
assign (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   97 and name  HB2) 2.073 0.537 0.537 weight 1.000 ! spec=13Cnoesy, no=782, id=634, vol=2.020000e+03
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   97 and name  HB1)
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   97 and name  HB3)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   97 and name  HB2)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   97 and name  HB1)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   97 and name  HB3)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   97 and name  HB2)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   97 and name  HB1)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   97 and name  HB3)
assign (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   97 and name  HB2) 2.073 0.537 0.537 weight 1.000 ! spec=13Cnoesy, no=782, id=634, vol=2.020000e+03
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   97 and name  HB1)
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   97 and name  HB3)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   97 and name  HB2)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   97 and name  HB1)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   97 and name  HB3)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   97 and name  HB2)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   97 and name  HB1)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   97 and name  HB3)
assign (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   97 and name  HB2) 2.742 2.742 3.258 weight 1.000 ! spec=13Cnoesy, no=783, id=635, vol=3.722000e+03
    or (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   97 and name  HB1)
    or (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   97 and name  HB3)
assign (segid "   B" and resid   98 and name   HA) (segid "   B" and resid   97 and name  HB2) 2.742 2.742 3.258 weight 1.000 ! spec=13Cnoesy, no=783, id=635, vol=3.722000e+03
    or (segid "   B" and resid   98 and name   HA) (segid "   B" and resid   97 and name  HB1)
    or (segid "   B" and resid   98 and name   HA) (segid "   B" and resid   97 and name  HB3)
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   91 and name   HA) 4.155 2.158 2.158 weight 1.000 ! spec=13Cnoesy, no=784, id=636, vol=5.132000e+02
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   91 and name   HA)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   91 and name   HA)
assign (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   91 and name   HA) 4.155 2.158 2.158 weight 1.000 ! spec=13Cnoesy, no=784, id=636, vol=5.132000e+02
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   91 and name   HA)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   91 and name   HA)
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   25 and name   HA) 4.634 2.684 2.684 weight 1.000 ! spec=13Cnoesy, no=796, id=647, vol=1.053000e+03
assign (segid "   B" and resid   25 and name  HD2) (segid "   B" and resid   25 and name   HA) 4.634 2.684 2.684 weight 1.000 ! spec=13Cnoesy, no=796, id=647, vol=1.053000e+03
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    6 and name HG12) 3.680 1.693 1.693 weight 1.000 ! spec=13Cnoesy, no=800, id=650, vol=1.449000e+03
    or (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    6 and name HG13)
assign (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    6 and name HG12) 3.680 1.693 1.693 weight 1.000 ! spec=13Cnoesy, no=800, id=650, vol=1.449000e+03
    or (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    6 and name HG11)
    or (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    6 and name HG13)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    9 and name   HN) 3.333 1.388 1.388 weight 1.000 ! spec=13Cnoesy, no=802, id=652, vol=1.781000e+03
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    9 and name   HN)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    9 and name   HN)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    9 and name   HN) 3.333 1.388 1.388 weight 1.000 ! spec=13Cnoesy, no=802, id=652, vol=1.781000e+03
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    9 and name   HN)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    9 and name   HN)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid   12 and name  HE1) 3.818 1.822 1.822 weight 1.000 ! spec=13Cnoesy, no=804, id=654, vol=1.640000e+03
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid   12 and name  HE1)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid   12 and name  HE1)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid   12 and name  HE1) 3.818 1.822 1.822 weight 1.000 ! spec=13Cnoesy, no=804, id=654, vol=1.640000e+03
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid   12 and name  HE1)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid   12 and name  HE1)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    7 and name  HB2) 4.900 3.001 3.001 weight 1.000 ! spec=13Cnoesy, no=811, id=661, vol=5.111000e+02
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    7 and name  HB2)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    7 and name  HB2)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    7 and name  HB2) 4.900 3.001 3.001 weight 1.000 ! spec=13Cnoesy, no=811, id=661, vol=5.111000e+02
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    7 and name  HB2)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    7 and name  HB2)
assign (segid "   A" and resid  111 and name   HA) (segid "   A" and resid  111 and name   HB) 3.206 1.284 1.284 weight 1.000 ! spec=13Cnoesy, no=812, id=662, vol=7.788000e+02
assign (segid "   B" and resid  111 and name   HA) (segid "   B" and resid  111 and name   HB) 3.206 1.284 1.284 weight 1.000 ! spec=13Cnoesy, no=812, id=662, vol=7.788000e+02
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name  HB1) 2.500 0.781 0.781 weight 1.000 ! spec=13Cnoesy, no=820, id=667, vol=1.005000e+03
assign (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid   76 and name  HB1) 2.500 0.781 0.781 weight 1.000 ! spec=13Cnoesy, no=820, id=667, vol=1.005000e+03
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HB1) 2.983 1.112 1.112 weight 1.000 ! spec=13Cnoesy, no=831, id=677, vol=1.535000e+03
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   34 and name  HB1) 2.983 1.112 1.112 weight 1.000 ! spec=13Cnoesy, no=831, id=677, vol=1.535000e+03
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HE2) 6.292 4.949 4.949 weight 1.000 ! spec=13Cnoesy, no=836, id=682, vol=2.910000e+02
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   34 and name  HE2) 6.292 4.949 4.949 weight 1.000 ! spec=13Cnoesy, no=836, id=682, vol=2.910000e+02
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HB2) 2.989 1.117 1.117 weight 1.000 ! spec=13Cnoesy, no=837, id=683, vol=3.682000e+03
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   34 and name  HB2) 2.989 1.117 1.117 weight 1.000 ! spec=13Cnoesy, no=837, id=683, vol=3.682000e+03
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   46 and name   HN) 2.676 0.895 0.895 weight 1.000 ! spec=13Cnoesy, no=841, id=687, vol=3.687000e+03
assign (segid "   B" and resid   46 and name   HA) (segid "   B" and resid   46 and name   HN) 2.676 0.895 0.895 weight 1.000 ! spec=13Cnoesy, no=841, id=687, vol=3.687000e+03
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name  HB2) 1.681 0.353 0.353 weight 1.000 ! spec=13Cnoesy, no=845, id=690, vol=8.215000e+03
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   74 and name  HB2) 1.681 0.353 0.353 weight 1.000 ! spec=13Cnoesy, no=845, id=690, vol=8.215000e+03
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name  HD2) 3.195 1.276 1.276 weight 1.000 ! spec=13Cnoesy, no=847, id=692, vol=8.215000e+03
assign (segid "   B" and resid   74 and name  HB2) (segid "   B" and resid   74 and name  HD2) 3.195 1.276 1.276 weight 1.000 ! spec=13Cnoesy, no=847, id=692, vol=8.215000e+03
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name  HG2) 3.114 1.212 1.212 weight 1.000 ! spec=13Cnoesy, no=851, id=696, vol=3.756000e+03
assign (segid "   B" and resid   74 and name  HB2) (segid "   B" and resid   74 and name  HG2) 3.114 1.212 1.212 weight 1.000 ! spec=13Cnoesy, no=851, id=696, vol=3.756000e+03
assign (segid "   A" and resid   59 and name  HD2) (segid "   A" and resid   59 and name  HB1) 3.950 1.950 1.950 weight 1.000 ! spec=13Cnoesy, no=862, id=705, vol=1.678000e+03
assign (segid "   B" and resid   59 and name  HD2) (segid "   B" and resid   59 and name  HB1) 3.950 1.950 1.950 weight 1.000 ! spec=13Cnoesy, no=862, id=705, vol=1.678000e+03
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name   HB) 3.320 1.378 1.378 weight 1.000 ! spec=13Cnoesy, no=863, id=706, vol=6.014000e+02
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name   HB) 3.320 1.378 1.378 weight 1.000 ! spec=13Cnoesy, no=863, id=706, vol=6.014000e+02
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid  102 and name   HB) 4.510 2.542 2.542 weight 1.000 ! spec=13Cnoesy, no=864, id=707, vol=4.173000e+02
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid  102 and name   HB) 4.510 2.542 2.542 weight 1.000 ! spec=13Cnoesy, no=864, id=707, vol=4.173000e+02
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   56 and name   HB) 4.447 2.472 2.472 weight 1.000 ! spec=13Cnoesy, no=879, id=720, vol=2.565000e+02
assign (segid "   B" and resid   57 and name   HA) (segid "   B" and resid   56 and name   HB) 4.447 2.472 2.472 weight 1.000 ! spec=13Cnoesy, no=879, id=720, vol=2.565000e+02
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   63 and name  HD2) 4.193 2.197 2.197 weight 1.000 ! spec=13Cnoesy, no=887, id=722, vol=6.134000e+02
assign (segid "   B" and resid   63 and name  HG2) (segid "   B" and resid   63 and name  HD2) 4.193 2.197 2.197 weight 1.000 ! spec=13Cnoesy, no=887, id=722, vol=6.134000e+02
assign (segid "   A" and resid   63 and name  HD1) (segid "   A" and resid   63 and name  HD2) 2.593 0.840 0.840 weight 1.000 ! spec=13Cnoesy, no=888, id=723, vol=9.606000e+02
assign (segid "   B" and resid   63 and name  HD1) (segid "   B" and resid   63 and name  HD2) 2.593 0.840 0.840 weight 1.000 ! spec=13Cnoesy, no=888, id=723, vol=9.606000e+02
assign (segid "   A" and resid   63 and name  HG1) (segid "   A" and resid   63 and name  HD2) 3.154 1.243 1.243 weight 1.000 ! spec=13Cnoesy, no=889, id=724, vol=8.767000e+02
assign (segid "   B" and resid   63 and name  HG1) (segid "   B" and resid   63 and name  HD2) 3.154 1.243 1.243 weight 1.000 ! spec=13Cnoesy, no=889, id=724, vol=8.767000e+02
assign (segid "   A" and resid   63 and name  HD2) (segid "   A" and resid   63 and name  HB2) 4.620 2.669 2.669 weight 1.000 ! spec=13Cnoesy, no=891, id=725, vol=8.767000e+02
assign (segid "   B" and resid   63 and name  HD2) (segid "   B" and resid   63 and name  HB2) 4.620 2.669 2.669 weight 1.000 ! spec=13Cnoesy, no=891, id=725, vol=8.767000e+02
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   90 and name HD12) 3.267 1.334 1.334 weight 1.000 ! spec=13Cnoesy, no=900, id=732, vol=1.308000e+03
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   90 and name HD11)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   90 and name HD13)
assign (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   90 and name HD12) 3.267 1.334 1.334 weight 1.000 ! spec=13Cnoesy, no=900, id=732, vol=1.308000e+03
    or (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   90 and name HD11)
    or (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   90 and name HD13)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG22) 2.915 1.062 1.062 weight 1.000 ! spec=13Cnoesy, no=902, id=734, vol=1.577000e+03
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG23)
assign (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name HG22) 2.915 1.062 1.062 weight 1.000 ! spec=13Cnoesy, no=902, id=734, vol=1.577000e+03
    or (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name HG23)
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name  HG1) 3.091 1.195 1.195 weight 1.000 ! spec=13Cnoesy, no=913, id=743, vol=2.865000e+03
assign (segid "   B" and resid   57 and name  HB1) (segid "   B" and resid   57 and name  HG1) 3.091 1.195 1.195 weight 1.000 ! spec=13Cnoesy, no=913, id=743, vol=2.865000e+03
assign (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   57 and name   HA) 3.670 1.683 1.683 weight 1.000 ! spec=13Cnoesy, no=914, id=744, vol=8.938000e+02
assign (segid "   B" and resid   57 and name  HG1) (segid "   B" and resid   57 and name   HA) 3.670 1.683 1.683 weight 1.000 ! spec=13Cnoesy, no=914, id=744, vol=8.938000e+02
assign (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   57 and name  HD1) 2.609 0.851 0.851 weight 1.000 ! spec=13Cnoesy, no=915, id=745, vol=2.865000e+03
assign (segid "   B" and resid   57 and name  HG1) (segid "   B" and resid   57 and name  HD1) 2.609 0.851 0.851 weight 1.000 ! spec=13Cnoesy, no=915, id=745, vol=2.865000e+03
assign (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   57 and name  HB2) 2.666 0.888 0.888 weight 1.000 ! spec=13Cnoesy, no=916, id=746, vol=1.816000e+03
assign (segid "   B" and resid   57 and name  HG1) (segid "   B" and resid   57 and name  HB2) 2.666 0.888 0.888 weight 1.000 ! spec=13Cnoesy, no=916, id=746, vol=1.816000e+03
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HD2) 2.688 0.903 0.903 weight 1.000 ! spec=13Cnoesy, no=918, id=748, vol=3.784000e+03
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   34 and name  HD2) 2.688 0.903 0.903 weight 1.000 ! spec=13Cnoesy, no=918, id=748, vol=3.784000e+03
assign (segid "   A" and resid   34 and name  HD2) (segid "   A" and resid   34 and name  HB1) 2.286 0.653 0.653 weight 1.000 ! spec=13Cnoesy, no=919, id=749, vol=9.102000e+03
assign (segid "   B" and resid   34 and name  HD2) (segid "   B" and resid   34 and name  HB1) 2.286 0.653 0.653 weight 1.000 ! spec=13Cnoesy, no=919, id=749, vol=9.102000e+03
assign (segid "   A" and resid   34 and name  HD2) (segid "   A" and resid   34 and name  HG1) 1.920 1.920 4.080 weight 1.000 ! spec=13Cnoesy, no=920, id=750, vol=2.565000e+04
assign (segid "   B" and resid   34 and name  HD2) (segid "   B" and resid   34 and name  HG1) 1.920 1.920 4.080 weight 1.000 ! spec=13Cnoesy, no=920, id=750, vol=2.565000e+04
assign (segid "   A" and resid   34 and name  HD2) (segid "   A" and resid   34 and name  HG2) 1.776 1.776 4.224 weight 1.000 ! spec=13Cnoesy, no=921, id=751, vol=2.314000e+04
assign (segid "   B" and resid   34 and name  HD2) (segid "   B" and resid   34 and name  HG2) 1.776 1.776 4.224 weight 1.000 ! spec=13Cnoesy, no=921, id=751, vol=2.314000e+04
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   32 and name   HA) 3.024 1.143 1.143 weight 1.000 ! spec=13Cnoesy, no=929, id=758, vol=1.847000e+03
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name   HA) 3.024 1.143 1.143 weight 1.000 ! spec=13Cnoesy, no=929, id=758, vol=1.847000e+03
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   32 and name  HB2) 2.860 1.023 1.023 weight 1.000 ! spec=13Cnoesy, no=931, id=760, vol=3.327000e+03
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name  HB2) 2.860 1.023 1.023 weight 1.000 ! spec=13Cnoesy, no=931, id=760, vol=3.327000e+03
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   69 and name  HD2) 4.095 2.096 2.096 weight 1.000 ! spec=13Cnoesy, no=937, id=764, vol=1.131000e+03
assign (segid "   B" and resid   69 and name  HB2) (segid "   B" and resid   69 and name  HD2) 4.095 2.096 2.096 weight 1.000 ! spec=13Cnoesy, no=937, id=764, vol=1.131000e+03
assign (segid "   A" and resid   69 and name  HD2) (segid "   A" and resid   69 and name  HB1) 4.223 2.230 2.230 weight 1.000 ! spec=13Cnoesy, no=938, id=765, vol=3.374000e+02
assign (segid "   B" and resid   69 and name  HD2) (segid "   B" and resid   69 and name  HB1) 4.223 2.230 2.230 weight 1.000 ! spec=13Cnoesy, no=938, id=765, vol=3.374000e+02
assign (segid "   A" and resid   69 and name  HD2) (segid "   A" and resid   64 and name HG22) 4.834 2.921 2.921 weight 1.000 ! spec=13Cnoesy, no=941, id=767, vol=5.864000e+02
    or (segid "   A" and resid   69 and name  HD2) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   69 and name  HD2) (segid "   A" and resid   64 and name HG23)
assign (segid "   B" and resid   69 and name  HD2) (segid "   B" and resid   64 and name HG22) 4.834 2.921 2.921 weight 1.000 ! spec=13Cnoesy, no=941, id=767, vol=5.864000e+02
    or (segid "   B" and resid   69 and name  HD2) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   69 and name  HD2) (segid "   B" and resid   64 and name HG23)
assign (segid "   A" and resid   69 and name  HD2) (segid "   A" and resid   69 and name  HG2) 3.091 1.195 1.195 weight 1.000 ! spec=13Cnoesy, no=942, id=768, vol=1.022000e+03
assign (segid "   B" and resid   69 and name  HD2) (segid "   B" and resid   69 and name  HG2) 3.091 1.195 1.195 weight 1.000 ! spec=13Cnoesy, no=942, id=768, vol=1.022000e+03
assign (segid "   A" and resid   69 and name  HD2) (segid "   A" and resid   69 and name  HG1) 3.968 1.968 1.968 weight 1.000 ! spec=13Cnoesy, no=943, id=769, vol=3.123000e+02
assign (segid "   B" and resid   69 and name  HD2) (segid "   B" and resid   69 and name  HG1) 3.968 1.968 1.968 weight 1.000 ! spec=13Cnoesy, no=943, id=769, vol=3.123000e+02
assign (segid "   A" and resid  109 and name HG12) (segid "   A" and resid   82 and name   HA) 4.260 2.268 2.268 weight 1.000 ! spec=13Cnoesy, no=944, id=770, vol=5.942000e+02
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid   82 and name   HA)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid   82 and name   HA)
assign (segid "   B" and resid  109 and name HG12) (segid "   B" and resid   82 and name   HA) 4.260 2.268 2.268 weight 1.000 ! spec=13Cnoesy, no=944, id=770, vol=5.942000e+02
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid   82 and name   HA)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid   82 and name   HA)
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name   HB) 3.121 1.218 1.218 weight 1.000 ! spec=13Cnoesy, no=945, id=771, vol=1.103000e+03
assign (segid "   B" and resid   82 and name   HA) (segid "   B" and resid   82 and name   HB) 3.121 1.218 1.218 weight 1.000 ! spec=13Cnoesy, no=945, id=771, vol=1.103000e+03
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   81 and name   HA) 5.157 3.324 3.324 weight 1.000 ! spec=13Cnoesy, no=950, id=776, vol=8.050000e+02
assign (segid "   B" and resid   82 and name   HB) (segid "   B" and resid   81 and name   HA) 5.157 3.324 3.324 weight 1.000 ! spec=13Cnoesy, no=950, id=776, vol=8.050000e+02
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   50 and name  HB2) 4.729 2.796 2.796 weight 1.000 ! spec=13Cnoesy, no=956, id=782, vol=1.248000e+03
assign (segid "   B" and resid   49 and name   HA) (segid "   B" and resid   50 and name  HB2) 4.729 2.796 2.796 weight 1.000 ! spec=13Cnoesy, no=956, id=782, vol=1.248000e+03
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name  HD1) 3.758 1.766 1.766 weight 1.000 ! spec=13Cnoesy, no=961, id=787, vol=2.273000e+03
assign (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   50 and name  HD1) 3.758 1.766 1.766 weight 1.000 ! spec=13Cnoesy, no=961, id=787, vol=2.273000e+03
assign (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name  HB2) 2.722 0.926 0.926 weight 1.000 ! spec=13Cnoesy, no=964, id=790, vol=5.551000e+02
assign (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name  HB2) 2.722 0.926 0.926 weight 1.000 ! spec=13Cnoesy, no=964, id=790, vol=5.551000e+02
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name  HG2) 3.389 1.436 1.436 weight 1.000 ! spec=13Cnoesy, no=969, id=794, vol=1.895000e+03
assign (segid "   B" and resid   41 and name   HA) (segid "   B" and resid   41 and name  HG2) 3.389 1.436 1.436 weight 1.000 ! spec=13Cnoesy, no=969, id=794, vol=1.895000e+03
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   41 and name  HB2) 2.566 0.823 0.823 weight 1.000 ! spec=13Cnoesy, no=971, id=796, vol=1.197000e+04
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   41 and name  HB2) 2.566 0.823 0.823 weight 1.000 ! spec=13Cnoesy, no=971, id=796, vol=1.197000e+04
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   42 and name   HN) 4.846 2.935 2.935 weight 1.000 ! spec=13Cnoesy, no=974, id=799, vol=1.334000e+03
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   42 and name   HN) 4.846 2.935 2.935 weight 1.000 ! spec=13Cnoesy, no=974, id=799, vol=1.334000e+03
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   40 and name  HB2) 2.508 0.786 0.786 weight 1.000 ! spec=13Cnoesy, no=975, id=800, vol=2.937000e+03
    or (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   40 and name  HB3)
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   40 and name  HB2) 2.508 0.786 0.786 weight 1.000 ! spec=13Cnoesy, no=975, id=800, vol=2.937000e+03
    or (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   40 and name  HB1)
    or (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   40 and name  HB3)
assign (segid "   A" and resid   74 and name  HD2) (segid "   A" and resid   74 and name  HG2) 2.385 0.711 0.711 weight 1.000 ! spec=13Cnoesy, no=987, id=808, vol=6.709000e+03
assign (segid "   B" and resid   74 and name  HD2) (segid "   B" and resid   74 and name  HG2) 2.385 0.711 0.711 weight 1.000 ! spec=13Cnoesy, no=987, id=808, vol=6.709000e+03
assign (segid "   A" and resid    3 and name HG21) (segid "   A" and resid    3 and name   HA) 2.295 0.658 0.658 weight 1.000 ! spec=13Cnoesy, no=990, id=810, vol=7.954000e+03
    or (segid "   A" and resid    3 and name HG22) (segid "   A" and resid    3 and name   HA)
    or (segid "   A" and resid    3 and name HG23) (segid "   A" and resid    3 and name   HA)
assign (segid "   B" and resid    3 and name HG21) (segid "   B" and resid    3 and name   HA) 2.295 0.658 0.658 weight 1.000 ! spec=13Cnoesy, no=990, id=810, vol=7.954000e+03
    or (segid "   B" and resid    3 and name HG22) (segid "   B" and resid    3 and name   HA)
    or (segid "   B" and resid    3 and name HG23) (segid "   B" and resid    3 and name   HA)
assign (segid "   A" and resid    3 and name HG21) (segid "   A" and resid    3 and name   HB) 2.028 0.514 0.514 weight 1.000 ! spec=13Cnoesy, no=991, id=811, vol=8.454000e+03
    or (segid "   A" and resid    3 and name HG22) (segid "   A" and resid    3 and name   HB)
    or (segid "   A" and resid    3 and name HG23) (segid "   A" and resid    3 and name   HB)
assign (segid "   B" and resid    3 and name HG21) (segid "   B" and resid    3 and name   HB) 2.028 0.514 0.514 weight 1.000 ! spec=13Cnoesy, no=991, id=811, vol=8.454000e+03
    or (segid "   B" and resid    3 and name HG22) (segid "   B" and resid    3 and name   HB)
    or (segid "   B" and resid    3 and name HG23) (segid "   B" and resid    3 and name   HB)
assign (segid "   A" and resid    3 and name HG21) (segid "   A" and resid    3 and name   HN) 3.454 1.491 1.491 weight 1.000 ! spec=13Cnoesy, no=992, id=812, vol=1.088000e+03
    or (segid "   A" and resid    3 and name HG22) (segid "   A" and resid    3 and name   HN)
    or (segid "   A" and resid    3 and name HG23) (segid "   A" and resid    3 and name   HN)
assign (segid "   B" and resid    3 and name HG21) (segid "   B" and resid    3 and name   HN) 3.454 1.491 1.491 weight 1.000 ! spec=13Cnoesy, no=992, id=812, vol=1.088000e+03
    or (segid "   B" and resid    3 and name HG22) (segid "   B" and resid    3 and name   HN)
    or (segid "   B" and resid    3 and name HG23) (segid "   B" and resid    3 and name   HN)
assign (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   26 and name HG21) 2.084 0.543 0.543 weight 1.000 ! spec=13Cnoesy, no=993, id=813, vol=7.181000e+03
    or (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   26 and name HG22)
    or (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   26 and name HG23)
assign (segid "   B" and resid   26 and name   HB) (segid "   B" and resid   26 and name HG21) 2.084 0.543 0.543 weight 1.000 ! spec=13Cnoesy, no=993, id=813, vol=7.181000e+03
    or (segid "   B" and resid   26 and name   HB) (segid "   B" and resid   26 and name HG22)
    or (segid "   B" and resid   26 and name   HB) (segid "   B" and resid   26 and name HG23)
assign (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   14 and name HG22) 3.934 1.935 1.935 weight 1.000 ! spec=13Cnoesy, no=1000, id=817, vol=1.101000e+03
    or (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   14 and name HG23)
assign (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid   14 and name HG22) 3.934 1.935 1.935 weight 1.000 ! spec=13Cnoesy, no=1000, id=817, vol=1.101000e+03
    or (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid   14 and name HG21)
    or (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid   14 and name HG23)
assign (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   71 and name HD12) 2.577 2.577 3.423 weight 1.000 ! spec=13Cnoesy, no=1002, id=819, vol=5.592000e+03
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   71 and name HD13)
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   71 and name HD12)
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   71 and name HD13)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   71 and name HD12)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   71 and name HD13)
assign (segid "   B" and resid   14 and name HG22) (segid "   B" and resid   71 and name HD12) 2.577 2.577 3.423 weight 1.000 ! spec=13Cnoesy, no=1002, id=819, vol=5.592000e+03
    or (segid "   B" and resid   14 and name HG22) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid   14 and name HG22) (segid "   B" and resid   71 and name HD13)
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid   71 and name HD12)
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid   71 and name HD13)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid   71 and name HD12)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid   71 and name HD13)
assign (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   14 and name   HA) 3.293 1.356 1.356 weight 1.000 ! spec=13Cnoesy, no=1003, id=820, vol=2.051000e+03
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   14 and name   HA)
assign (segid "   B" and resid   14 and name HG22) (segid "   B" and resid   14 and name   HA) 3.293 1.356 1.356 weight 1.000 ! spec=13Cnoesy, no=1003, id=820, vol=2.051000e+03
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid   14 and name   HA)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid   14 and name   HA)
assign (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   15 and name  HB1) 3.300 1.361 1.361 weight 1.000 ! spec=13Cnoesy, no=1005, id=822, vol=1.324000e+03
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   15 and name  HB1)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   15 and name  HB1)
assign (segid "   B" and resid   14 and name HG22) (segid "   B" and resid   15 and name  HB1) 3.300 1.361 1.361 weight 1.000 ! spec=13Cnoesy, no=1005, id=822, vol=1.324000e+03
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid   15 and name  HB1)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid   15 and name  HB1)
assign (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   13 and name   HA) 4.454 2.480 2.480 weight 1.000 ! spec=13Cnoesy, no=1009, id=825, vol=9.520000e+02
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   13 and name   HA)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   13 and name   HA)
assign (segid "   B" and resid   14 and name HG22) (segid "   B" and resid   13 and name   HA) 4.454 2.480 2.480 weight 1.000 ! spec=13Cnoesy, no=1009, id=825, vol=9.520000e+02
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid   13 and name   HA)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid   13 and name   HA)
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name HG22) 2.698 0.910 0.910 weight 1.000 ! spec=13Cnoesy, no=1014, id=830, vol=1.688000e+03
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name HG21)
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name HG23)
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name HG22) 2.698 0.910 0.910 weight 1.000 ! spec=13Cnoesy, no=1014, id=830, vol=1.688000e+03
    or (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name HG21)
    or (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name HG23)
assign (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  102 and name HG22) 2.142 0.573 0.573 weight 1.000 ! spec=13Cnoesy, no=1017, id=833, vol=2.387000e+03
    or (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  102 and name HG21)
    or (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  102 and name HG23)
assign (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  102 and name HG22) 2.142 0.573 0.573 weight 1.000 ! spec=13Cnoesy, no=1017, id=833, vol=2.387000e+03
    or (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  102 and name HG21)
    or (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  102 and name HG23)
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid   30 and name  HB2) 4.130 2.132 2.132 weight 1.000 ! spec=13Cnoesy, no=1021, id=837, vol=8.401000e+02
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid   30 and name  HB2)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid   30 and name  HB2)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid   30 and name  HB2) 4.130 2.132 2.132 weight 1.000 ! spec=13Cnoesy, no=1021, id=837, vol=8.401000e+02
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid   30 and name  HB2)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid   30 and name  HB2)
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid   28 and name   HA) 4.046 2.046 2.046 weight 1.000 ! spec=13Cnoesy, no=1022, id=838, vol=6.321000e+02
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid   28 and name   HA)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid   28 and name   HA) 4.046 2.046 2.046 weight 1.000 ! spec=13Cnoesy, no=1022, id=838, vol=6.321000e+02
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid   28 and name   HA)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid   28 and name   HA)
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid  102 and name HG12) 2.062 0.532 0.532 weight 1.000 ! spec=13Cnoesy, no=1024, id=840, vol=3.625000e+03
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid  102 and name HG12)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid  102 and name HG12)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid  102 and name HG12) 2.062 0.532 0.532 weight 1.000 ! spec=13Cnoesy, no=1024, id=840, vol=3.625000e+03
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid  102 and name HG12)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid  102 and name HG12)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    6 and name   HA) 2.362 0.698 0.698 weight 1.000 ! spec=13Cnoesy, no=1029, id=844, vol=3.234000e+03
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    6 and name   HA)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    6 and name   HA) 2.362 0.698 0.698 weight 1.000 ! spec=13Cnoesy, no=1029, id=844, vol=3.234000e+03
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    6 and name   HA)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    6 and name   HA)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name HG22) 2.461 0.757 0.757 weight 1.000 ! spec=13Cnoesy, no=1031, id=846, vol=3.307000e+03
    or (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name HG23)
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name HG22) 2.461 0.757 0.757 weight 1.000 ! spec=13Cnoesy, no=1031, id=846, vol=3.307000e+03
    or (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name HG23)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    4 and name  HB2) 4.650 2.703 2.703 weight 1.000 ! spec=13Cnoesy, no=1035, id=849, vol=4.841000e+02
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    4 and name  HB2) 4.650 2.703 2.703 weight 1.000 ! spec=13Cnoesy, no=1035, id=849, vol=4.841000e+02
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    7 and name  HB2) 5.131 3.291 3.291 weight 1.000 ! spec=13Cnoesy, no=1037, id=851, vol=4.841000e+02
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    7 and name  HB2) 5.131 3.291 3.291 weight 1.000 ! spec=13Cnoesy, no=1037, id=851, vol=4.841000e+02
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    9 and name   HA) 4.558 2.596 2.596 weight 1.000 ! spec=13Cnoesy, no=1038, id=852, vol=7.005000e+02
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    9 and name   HA) 4.558 2.596 2.596 weight 1.000 ! spec=13Cnoesy, no=1038, id=852, vol=7.005000e+02
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name   HN) 3.308 1.368 1.368 weight 1.000 ! spec=13Cnoesy, no=1040, id=854, vol=9.762000e+02
assign (segid "   B" and resid   88 and name   HA) (segid "   B" and resid   88 and name   HN) 3.308 1.368 1.368 weight 1.000 ! spec=13Cnoesy, no=1040, id=854, vol=9.762000e+02
assign (segid "   A" and resid  103 and name  HD2) (segid "   A" and resid  103 and name  HB2) 3.474 1.509 1.509 weight 1.000 ! spec=13Cnoesy, no=1042, id=856, vol=2.628000e+03
assign (segid "   B" and resid  103 and name  HD2) (segid "   B" and resid  103 and name  HB2) 3.474 1.509 1.509 weight 1.000 ! spec=13Cnoesy, no=1042, id=856, vol=2.628000e+03
assign (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name HD12) 2.718 0.923 0.923 weight 1.000 ! spec=13Cnoesy, no=1046, id=859, vol=1.654000e+03
    or (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name HD11)
    or (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name HD13)
assign (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name HD12) 2.718 0.923 0.923 weight 1.000 ! spec=13Cnoesy, no=1046, id=859, vol=1.654000e+03
    or (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name HD11)
    or (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name HD13)
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   76 and name  HB2) 3.108 1.207 1.207 weight 1.000 ! spec=13Cnoesy, no=1050, id=862, vol=1.326000e+03
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   76 and name  HB2)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   76 and name  HB2) 3.108 1.207 1.207 weight 1.000 ! spec=13Cnoesy, no=1050, id=862, vol=1.326000e+03
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   76 and name  HB2)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   76 and name  HB2)
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   76 and name  HZ2) 3.698 1.709 1.709 weight 1.000 ! spec=13Cnoesy, no=1053, id=864, vol=5.829000e+02
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   76 and name  HZ2)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   76 and name  HZ2)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   76 and name  HZ2) 3.698 1.709 1.709 weight 1.000 ! spec=13Cnoesy, no=1053, id=864, vol=5.829000e+02
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   76 and name  HZ2)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   76 and name  HZ2)
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid  112 and name   HG) 2.112 0.558 0.558 weight 1.000 ! spec=13Cnoesy, no=1054, id=865, vol=3.110000e+03
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid  112 and name   HG)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid  112 and name   HG)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid  112 and name   HG) 2.112 0.558 0.558 weight 1.000 ! spec=13Cnoesy, no=1054, id=865, vol=3.110000e+03
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid  112 and name   HG)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid  112 and name   HG)
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   71 and name   HA) 3.192 1.274 1.274 weight 1.000 ! spec=13Cnoesy, no=1062, id=868, vol=1.304000e+03
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   71 and name   HA)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   71 and name   HA)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   71 and name   HA) 3.192 1.274 1.274 weight 1.000 ! spec=13Cnoesy, no=1062, id=868, vol=1.304000e+03
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   71 and name   HA)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   71 and name   HA)
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid  111 and name HG22) 3.966 1.967 1.967 weight 1.000 ! spec=13Cnoesy, no=1064, id=870, vol=1.103000e+03
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid  111 and name HG23)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid  111 and name HG22)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid  111 and name HG23)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid  111 and name HG22)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid  111 and name HG23)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid  111 and name HG22) 3.966 1.967 1.967 weight 1.000 ! spec=13Cnoesy, no=1064, id=870, vol=1.103000e+03
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid  111 and name HG23)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid  111 and name HG22)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid  111 and name HG23)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid  111 and name HG22)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid  111 and name HG23)
assign (segid "   A" and resid   70 and name  HA2) (segid "   A" and resid   71 and name HD12) 4.942 3.053 3.053 weight 1.000 ! spec=13Cnoesy, no=1082, id=882, vol=8.371000e+02
    or (segid "   A" and resid   70 and name  HA2) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid   70 and name  HA2) (segid "   A" and resid   71 and name HD13)
assign (segid "   B" and resid   70 and name  HA2) (segid "   B" and resid   71 and name HD12) 4.942 3.053 3.053 weight 1.000 ! spec=13Cnoesy, no=1082, id=882, vol=8.371000e+02
    or (segid "   B" and resid   70 and name  HA2) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid   70 and name  HA2) (segid "   B" and resid   71 and name HD13)
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   71 and name HD12) 4.412 2.433 2.433 weight 1.000 ! spec=13Cnoesy, no=1083, id=883, vol=1.312000e+03
    or (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   71 and name HD13)
assign (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   71 and name HD12) 4.412 2.433 2.433 weight 1.000 ! spec=13Cnoesy, no=1083, id=883, vol=1.312000e+03
    or (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   71 and name HD13)
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   76 and name  HB1) 3.604 1.623 1.623 weight 1.000 ! spec=13Cnoesy, no=1089, id=886, vol=1.152000e+03
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   76 and name  HB1)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   76 and name  HB1) 3.604 1.623 1.623 weight 1.000 ! spec=13Cnoesy, no=1089, id=886, vol=1.152000e+03
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   76 and name  HB1)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   76 and name  HB1)
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   71 and name   HA) 2.354 0.693 0.693 weight 1.000 ! spec=13Cnoesy, no=1092, id=888, vol=3.066000e+03
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   71 and name   HA)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   71 and name   HA)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   71 and name   HA) 2.354 0.693 0.693 weight 1.000 ! spec=13Cnoesy, no=1092, id=888, vol=3.066000e+03
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   71 and name   HA)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   71 and name   HA)
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   70 and name  HA1) 4.185 2.189 2.189 weight 1.000 ! spec=13Cnoesy, no=1094, id=890, vol=7.306000e+02
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   70 and name  HA1)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   70 and name  HA1)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   70 and name  HA1) 4.185 2.189 2.189 weight 1.000 ! spec=13Cnoesy, no=1094, id=890, vol=7.306000e+02
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   70 and name  HA1)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   70 and name  HA1)
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   71 and name HG11) 2.040 0.520 0.520 weight 1.000 ! spec=13Cnoesy, no=1095, id=891, vol=3.818000e+03
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   71 and name HG11)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   71 and name HG11)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   71 and name HG11) 2.040 0.520 0.520 weight 1.000 ! spec=13Cnoesy, no=1095, id=891, vol=3.818000e+03
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   71 and name HG11)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   71 and name HG11)
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    9 and name   HN) 4.821 2.905 2.905 weight 1.000 ! spec=13Cnoesy, no=1097, id=893, vol=2.757000e+02
assign (segid "   B" and resid    9 and name  HB1) (segid "   B" and resid    9 and name   HN) 4.821 2.905 2.905 weight 1.000 ! spec=13Cnoesy, no=1097, id=893, vol=2.757000e+02
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   85 and name   HA) 4.313 2.325 2.325 weight 1.000 ! spec=13Cnoesy, no=1106, id=900, vol=7.135000e+02
assign (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   85 and name   HA) 4.313 2.325 2.325 weight 1.000 ! spec=13Cnoesy, no=1106, id=900, vol=7.135000e+02
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   86 and name   HA) 4.116 2.118 2.118 weight 1.000 ! spec=13Cnoesy, no=1107, id=901, vol=5.409000e+02
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   86 and name   HA)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   86 and name   HA)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   86 and name   HA) 4.116 2.118 2.118 weight 1.000 ! spec=13Cnoesy, no=1107, id=901, vol=5.409000e+02
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   86 and name   HA)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   86 and name   HA)
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name   HA) 3.327 1.384 1.384 weight 1.000 ! spec=13Cnoesy, no=1108, id=902, vol=7.748000e+02
assign (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   86 and name   HA) 3.327 1.384 1.384 weight 1.000 ! spec=13Cnoesy, no=1108, id=902, vol=7.748000e+02
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   86 and name  HB2) 4.214 2.220 2.220 weight 1.000 ! spec=13Cnoesy, no=1115, id=909, vol=4.805000e+02
assign (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   86 and name  HB2) 4.214 2.220 2.220 weight 1.000 ! spec=13Cnoesy, no=1115, id=909, vol=4.805000e+02
assign (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   32 and name  HD2) 1.656 1.656 4.344 weight 1.000 ! spec=13Cnoesy, no=1116, id=910, vol=2.420000e+04
assign (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name  HD2) 1.656 1.656 4.344 weight 1.000 ! spec=13Cnoesy, no=1116, id=910, vol=2.420000e+04
assign (segid "   A" and resid   32 and name  HD2) (segid "   A" and resid   34 and name   HN) 4.740 2.809 2.809 weight 1.000 ! spec=13Cnoesy, no=1118, id=912, vol=8.703000e+02
assign (segid "   B" and resid   32 and name  HD2) (segid "   B" and resid   34 and name   HN) 4.740 2.809 2.809 weight 1.000 ! spec=13Cnoesy, no=1118, id=912, vol=8.703000e+02
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   32 and name  HD2) 2.301 0.662 0.662 weight 1.000 ! spec=13Cnoesy, no=1119, id=913, vol=1.568000e+04
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name  HD2) 2.301 0.662 0.662 weight 1.000 ! spec=13Cnoesy, no=1119, id=913, vol=1.568000e+04
assign (segid "   A" and resid   32 and name  HD2) (segid "   A" and resid   32 and name   HA) 3.065 3.065 2.935 weight 1.000 ! spec=13Cnoesy, no=1120, id=914, vol=4.460000e+03
assign (segid "   B" and resid   32 and name  HD2) (segid "   B" and resid   32 and name   HA) 3.065 3.065 2.935 weight 1.000 ! spec=13Cnoesy, no=1120, id=914, vol=4.460000e+03
assign (segid "   A" and resid   32 and name  HD2) (segid "   A" and resid   31 and name HG22) 3.205 1.284 1.284 weight 1.000 ! spec=13Cnoesy, no=1122, id=916, vol=2.608000e+03
    or (segid "   A" and resid   32 and name  HD2) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   32 and name  HD2) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   32 and name  HD2) (segid "   B" and resid   31 and name HG22) 3.205 1.284 1.284 weight 1.000 ! spec=13Cnoesy, no=1122, id=916, vol=2.608000e+03
    or (segid "   B" and resid   32 and name  HD2) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   32 and name  HD2) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid   32 and name  HD2) (segid "   A" and resid   32 and name  HB2) 1.996 0.498 0.498 weight 1.000 ! spec=13Cnoesy, no=1123, id=917, vol=8.317000e+03
assign (segid "   B" and resid   32 and name  HD2) (segid "   B" and resid   32 and name  HB2) 1.996 0.498 0.498 weight 1.000 ! spec=13Cnoesy, no=1123, id=917, vol=8.317000e+03
assign (segid "   A" and resid   10 and name  HA2) (segid "   A" and resid   11 and name   HA) 4.980 3.099 3.099 weight 1.000 ! spec=13Cnoesy, no=1128, id=922, vol=4.656000e+02
assign (segid "   B" and resid   10 and name  HA2) (segid "   B" and resid   11 and name   HA) 4.980 3.099 3.099 weight 1.000 ! spec=13Cnoesy, no=1128, id=922, vol=4.656000e+02
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HB2) 4.716 2.781 2.781 weight 1.000 ! spec=13Cnoesy, no=1130, id=924, vol=9.421000e+02
assign (segid "   B" and resid    5 and name  HD1) (segid "   B" and resid    5 and name  HB2) 4.716 2.781 2.781 weight 1.000 ! spec=13Cnoesy, no=1130, id=924, vol=9.421000e+02
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name  HD2) 3.667 1.681 1.681 weight 1.000 ! spec=13Cnoesy, no=1134, id=928, vol=1.060000e+03
assign (segid "   B" and resid    5 and name  HB2) (segid "   B" and resid    5 and name  HD2) 3.667 1.681 1.681 weight 1.000 ! spec=13Cnoesy, no=1134, id=928, vol=1.060000e+03
assign (segid "   A" and resid  115 and name  HD1) (segid "   A" and resid   76 and name   HN) 3.041 1.156 1.156 weight 1.000 ! spec=13Cnoesy, no=1140, id=932, vol=1.404000e+03
assign (segid "   B" and resid  115 and name  HD1) (segid "   B" and resid   76 and name   HN) 3.041 1.156 1.156 weight 1.000 ! spec=13Cnoesy, no=1140, id=932, vol=1.404000e+03
assign (segid "   A" and resid  115 and name   HA) (segid "   A" and resid  115 and name  HD1) 6.052 4.578 4.578 weight 1.000 ! spec=13Cnoesy, no=1142, id=934, vol=4.983000e+02
assign (segid "   B" and resid  115 and name   HA) (segid "   B" and resid  115 and name  HD1) 6.052 4.578 4.578 weight 1.000 ! spec=13Cnoesy, no=1142, id=934, vol=4.983000e+02
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid  115 and name  HD1) 1.948 0.474 0.474 weight 1.000 ! spec=13Cnoesy, no=1143, id=935, vol=1.255000e+04
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid  115 and name  HD1) 1.948 0.474 0.474 weight 1.000 ! spec=13Cnoesy, no=1143, id=935, vol=1.255000e+04
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  103 and name   HN) 4.975 3.094 3.094 weight 1.000 ! spec=13Cnoesy, no=1150, id=942, vol=4.028000e+02
assign (segid "   B" and resid  103 and name  HB2) (segid "   B" and resid  103 and name   HN) 4.975 3.094 3.094 weight 1.000 ! spec=13Cnoesy, no=1150, id=942, vol=4.028000e+02
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   65 and name   HN) 3.492 1.524 1.524 weight 1.000 ! spec=13Cnoesy, no=1156, id=947, vol=2.724000e+03
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   65 and name   HN)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   65 and name   HN)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   65 and name   HN) 3.492 1.524 1.524 weight 1.000 ! spec=13Cnoesy, no=1156, id=947, vol=2.724000e+03
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   65 and name   HN)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   65 and name   HN)
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   68 and name   HN) 3.311 3.311 2.689 weight 1.000 ! spec=13Cnoesy, no=1157, id=948, vol=2.724000e+03
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   68 and name   HN)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   68 and name   HN)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   68 and name   HN) 3.311 3.311 2.689 weight 1.000 ! spec=13Cnoesy, no=1157, id=948, vol=2.724000e+03
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   68 and name   HN)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   68 and name   HN)
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG12) 1.883 0.443 0.443 weight 1.000 ! spec=13Cnoesy, no=1158, id=949, vol=6.267000e+03
    or (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG11)
    or (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG13)
assign (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   64 and name HG12) 1.883 0.443 0.443 weight 1.000 ! spec=13Cnoesy, no=1158, id=949, vol=6.267000e+03
    or (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   64 and name HG11)
    or (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   64 and name HG13)
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   64 and name   HA) 2.483 0.771 0.771 weight 1.000 ! spec=13Cnoesy, no=1159, id=950, vol=4.040000e+03
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   64 and name   HA)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   64 and name   HA)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   64 and name   HA) 2.483 0.771 0.771 weight 1.000 ! spec=13Cnoesy, no=1159, id=950, vol=4.040000e+03
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   64 and name   HA)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   64 and name   HA)
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   69 and name   HA) 2.568 0.825 0.825 weight 1.000 ! spec=13Cnoesy, no=1161, id=952, vol=3.226000e+03
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   69 and name   HA)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   69 and name   HA)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   69 and name   HA) 2.568 0.825 0.825 weight 1.000 ! spec=13Cnoesy, no=1161, id=952, vol=3.226000e+03
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   69 and name   HA)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   69 and name   HA)
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   64 and name HG22) 1.602 0.321 0.321 weight 1.000 ! spec=13Cnoesy, no=1162, id=953, vol=1.184000e+04
    or (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   64 and name HG23)
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   64 and name HG23)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   64 and name HG23)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   64 and name HG22) 1.602 0.321 0.321 weight 1.000 ! spec=13Cnoesy, no=1162, id=953, vol=1.184000e+04
    or (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   64 and name HG23)
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   64 and name HG22)
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   64 and name HG23)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   64 and name HG22)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   64 and name HG23)
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   69 and name  HG2) 1.955 0.478 0.478 weight 1.000 ! spec=13Cnoesy, no=1163, id=954, vol=5.102000e+03
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   69 and name  HG2)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   69 and name  HG2)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   69 and name  HG2) 1.955 0.478 0.478 weight 1.000 ! spec=13Cnoesy, no=1163, id=954, vol=5.102000e+03
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   69 and name  HG2)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   69 and name  HG2)
assign (segid "   A" and resid  103 and name  HD1) (segid "   A" and resid  103 and name  HB1) 2.901 1.052 1.052 weight 1.000 ! spec=13Cnoesy, no=1165, id=956, vol=2.977000e+03
assign (segid "   B" and resid  103 and name  HD1) (segid "   B" and resid  103 and name  HB1) 2.901 1.052 1.052 weight 1.000 ! spec=13Cnoesy, no=1165, id=956, vol=2.977000e+03
assign (segid "   A" and resid  103 and name  HD1) (segid "   A" and resid  103 and name  HB2) 2.839 1.007 1.007 weight 1.000 ! spec=13Cnoesy, no=1168, id=957, vol=1.807000e+03
assign (segid "   B" and resid  103 and name  HD1) (segid "   B" and resid  103 and name  HB2) 2.839 1.007 1.007 weight 1.000 ! spec=13Cnoesy, no=1168, id=957, vol=1.807000e+03
assign (segid "   A" and resid  118 and name  HB1) (segid "   A" and resid  118 and name  HG2) 2.216 0.614 0.614 weight 1.000 ! spec=13Cnoesy, no=1173, id=960, vol=1.056000e+04
assign (segid "   B" and resid  118 and name  HB1) (segid "   B" and resid  118 and name  HG2) 2.216 0.614 0.614 weight 1.000 ! spec=13Cnoesy, no=1173, id=960, vol=1.056000e+04
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name  HE1) 2.018 0.509 0.509 weight 1.000 ! spec=13Cnoesy, no=1185, id=967, vol=2.071000e+03
assign (segid "   B" and resid   25 and name  HE2) (segid "   B" and resid   25 and name  HE1) 2.018 0.509 0.509 weight 1.000 ! spec=13Cnoesy, no=1185, id=967, vol=2.071000e+03
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   25 and name  HE1) 3.131 1.225 1.225 weight 1.000 ! spec=13Cnoesy, no=1187, id=968, vol=1.135000e+03
assign (segid "   B" and resid   25 and name  HD2) (segid "   B" and resid   25 and name  HE1) 3.131 1.225 1.225 weight 1.000 ! spec=13Cnoesy, no=1187, id=968, vol=1.135000e+03
assign (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name  HB1) 5.290 3.499 3.499 weight 1.000 ! spec=13Cnoesy, no=1188, id=969, vol=4.400000e+02
assign (segid "   B" and resid   25 and name  HE1) (segid "   B" and resid   25 and name  HB1) 5.290 3.499 3.499 weight 1.000 ! spec=13Cnoesy, no=1188, id=969, vol=4.400000e+02
assign (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name  HG2) 2.798 0.979 0.979 weight 1.000 ! spec=13Cnoesy, no=1190, id=971, vol=1.175000e+03
assign (segid "   B" and resid   25 and name  HE1) (segid "   B" and resid   25 and name  HG2) 2.798 0.979 0.979 weight 1.000 ! spec=13Cnoesy, no=1190, id=971, vol=1.175000e+03
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  102 and name HD12) 2.455 2.455 3.545 weight 1.000 ! spec=13Cnoesy, no=1192, id=973, vol=4.284000e+03
    or (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  102 and name HD13)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  102 and name HD12)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  102 and name HD13)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  102 and name HD12)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  102 and name HD13)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  102 and name HD12) 2.455 2.455 3.545 weight 1.000 ! spec=13Cnoesy, no=1192, id=973, vol=4.284000e+03
    or (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  102 and name HD13)
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  102 and name HD12)
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  102 and name HD13)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  102 and name HD12)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  102 and name HD13)
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid  102 and name HD12) 2.737 2.737 3.263 weight 1.000 ! spec=13Cnoesy, no=1193, id=974, vol=4.011000e+03
    or (segid "   A" and resid   87 and name HG12) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid   87 and name HG12) (segid "   A" and resid  102 and name HD13)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid  102 and name HD12)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid  102 and name HD13)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid  102 and name HD12)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid  102 and name HD13)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid  102 and name HD12) 2.737 2.737 3.263 weight 1.000 ! spec=13Cnoesy, no=1193, id=974, vol=4.011000e+03
    or (segid "   B" and resid   87 and name HG12) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid   87 and name HG12) (segid "   B" and resid  102 and name HD13)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid  102 and name HD12)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid  102 and name HD13)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid  102 and name HD12)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid  102 and name HD13)
assign (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  102 and name HD12) 2.423 0.734 0.734 weight 1.000 ! spec=13Cnoesy, no=1196, id=977, vol=1.963000e+03
    or (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  102 and name HD13)
assign (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  102 and name HD12) 2.423 0.734 0.734 weight 1.000 ! spec=13Cnoesy, no=1196, id=977, vol=1.963000e+03
    or (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  102 and name HD13)
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid  102 and name HD12) 1.902 0.452 0.452 weight 1.000 ! spec=13Cnoesy, no=1197, id=978, vol=5.367000e+03
    or (segid "   A" and resid  102 and name HG22) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  102 and name HG22) (segid "   A" and resid  102 and name HD13)
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid  102 and name HD12)
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid  102 and name HD13)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid  102 and name HD12)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid  102 and name HD11)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid  102 and name HD13)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid  102 and name HD12) 1.902 0.452 0.452 weight 1.000 ! spec=13Cnoesy, no=1197, id=978, vol=5.367000e+03
    or (segid "   B" and resid  102 and name HG22) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  102 and name HG22) (segid "   B" and resid  102 and name HD13)
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid  102 and name HD12)
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid  102 and name HD13)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid  102 and name HD12)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid  102 and name HD11)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid  102 and name HD13)
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   38 and name   HB) 3.260 1.329 1.329 weight 1.000 ! spec=13Cnoesy, no=1200, id=981, vol=8.462000e+02
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   38 and name   HB)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   38 and name   HB)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   38 and name   HB) 3.260 1.329 1.329 weight 1.000 ! spec=13Cnoesy, no=1200, id=981, vol=8.462000e+02
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   38 and name   HB)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   38 and name   HB)
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   25 and name  HE1) 2.884 1.040 1.040 weight 1.000 ! spec=13Cnoesy, no=1201, id=982, vol=8.350000e+02
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   25 and name  HE1)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   25 and name  HE1)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   25 and name  HE1) 2.884 1.040 1.040 weight 1.000 ! spec=13Cnoesy, no=1201, id=982, vol=8.350000e+02
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   25 and name  HE1)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   25 and name  HE1)
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid  102 and name HG12) 1.792 0.401 0.401 weight 1.000 ! spec=13Cnoesy, no=1204, id=985, vol=6.597000e+03
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid  102 and name HG12)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid  102 and name HG12)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid  102 and name HG12) 1.792 0.401 0.401 weight 1.000 ! spec=13Cnoesy, no=1204, id=985, vol=6.597000e+03
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid  102 and name HG12)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid  102 and name HG12)
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   87 and name HG22) 2.439 0.744 0.744 weight 1.000 ! spec=13Cnoesy, no=1205, id=986, vol=3.198000e+03
    or (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   87 and name HG23)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   87 and name HG22)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   87 and name HG23)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   87 and name HG22)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   87 and name HG23)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   87 and name HG22) 2.439 0.744 0.744 weight 1.000 ! spec=13Cnoesy, no=1205, id=986, vol=3.198000e+03
    or (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   87 and name HG23)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   87 and name HG22)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   87 and name HG23)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   87 and name HG22)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   87 and name HG23)
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   28 and name  HB2) 1.481 1.481 4.519 weight 1.000 ! spec=13Cnoesy, no=1206, id=987, vol=6.227000e+03
    or (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   28 and name  HB3)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   28 and name  HB3)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   28 and name  HB3)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   28 and name  HB2) 1.481 1.481 4.519 weight 1.000 ! spec=13Cnoesy, no=1206, id=987, vol=6.227000e+03
    or (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   28 and name  HB3)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   28 and name  HB2)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   28 and name  HB3)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   28 and name  HB2)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   28 and name  HB3)
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  103 and name  HG1) 2.208 0.610 0.610 weight 1.000 ! spec=13Cnoesy, no=1208, id=989, vol=7.147000e+03
assign (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid  103 and name  HG1) 2.208 0.610 0.610 weight 1.000 ! spec=13Cnoesy, no=1208, id=989, vol=7.147000e+03
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   39 and name HD12) 4.057 2.058 2.058 weight 1.000 ! spec=13Cnoesy, no=1224, id=1001, vol=7.618000e+02
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   39 and name HD12) 4.057 2.058 2.058 weight 1.000 ! spec=13Cnoesy, no=1224, id=1001, vol=7.618000e+02
    or (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name HD12) 2.450 0.750 0.750 weight 1.000 ! spec=13Cnoesy, no=1226, id=1003, vol=3.210000e+03
    or (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name HD11)
    or (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name HD13)
assign (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name HD12) 2.450 0.750 0.750 weight 1.000 ! spec=13Cnoesy, no=1226, id=1003, vol=3.210000e+03
    or (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name HD11)
    or (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name HD13)
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HD12) 4.315 2.328 2.328 weight 1.000 ! spec=13Cnoesy, no=1228, id=1004, vol=1.248000e+03
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HD11)
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name HD13)
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name HD12) 4.315 2.328 2.328 weight 1.000 ! spec=13Cnoesy, no=1228, id=1004, vol=1.248000e+03
    or (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name HD11)
    or (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name HD13)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   86 and name   HZ) 4.435 2.458 2.458 weight 1.000 ! spec=13Cnoesy, no=1229, id=1005, vol=6.934000e+02
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   86 and name   HZ)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   86 and name   HZ)
assign (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   86 and name   HZ) 4.435 2.458 2.458 weight 1.000 ! spec=13Cnoesy, no=1229, id=1005, vol=6.934000e+02
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   86 and name   HZ)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   86 and name   HZ)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   86 and name  HB2) 3.833 1.836 1.836 weight 1.000 ! spec=13Cnoesy, no=1230, id=1006, vol=6.331000e+02
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   86 and name  HB2)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   86 and name  HB2)
assign (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   86 and name  HB2) 3.833 1.836 1.836 weight 1.000 ! spec=13Cnoesy, no=1230, id=1006, vol=6.331000e+02
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   86 and name  HB2)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   86 and name  HB2)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   31 and name HG11) 2.100 0.551 0.551 weight 1.000 ! spec=13Cnoesy, no=1234, id=1007, vol=6.227000e+03
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   31 and name HG11)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   31 and name HG11)
assign (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   31 and name HG11) 2.100 0.551 0.551 weight 1.000 ! spec=13Cnoesy, no=1234, id=1007, vol=6.227000e+03
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   31 and name HG11)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   31 and name HG11)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   31 and name HG12) 2.084 0.543 0.543 weight 1.000 ! spec=13Cnoesy, no=1235, id=1008, vol=6.428000e+03
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   31 and name HG12)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   31 and name HG12)
assign (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   31 and name HG12) 2.084 0.543 0.543 weight 1.000 ! spec=13Cnoesy, no=1235, id=1008, vol=6.428000e+03
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   31 and name HG12)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   31 and name HG12)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   31 and name HG22) 1.969 0.485 0.485 weight 1.000 ! spec=13Cnoesy, no=1236, id=1009, vol=7.522000e+03
    or (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   31 and name HG23)
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   31 and name HG22)
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   31 and name HG23)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   31 and name HG22)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   31 and name HG22) 1.969 0.485 0.485 weight 1.000 ! spec=13Cnoesy, no=1236, id=1009, vol=7.522000e+03
    or (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   31 and name HG23)
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   31 and name HG22)
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   31 and name HG23)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   31 and name HG22)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid  101 and name  HB2) 2.834 1.004 1.004 weight 1.000 ! spec=13Cnoesy, no=1237, id=1010, vol=2.375000e+03
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid  101 and name  HB2)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid  101 and name  HB2)
assign (segid "   B" and resid   31 and name HD12) (segid "   B" and resid  101 and name  HB2) 2.834 1.004 1.004 weight 1.000 ! spec=13Cnoesy, no=1237, id=1010, vol=2.375000e+03
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid  101 and name  HB2)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid  101 and name  HB2)
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   63 and name  HD1) 5.252 3.449 3.449 weight 1.000 ! spec=13Cnoesy, no=1240, id=1013, vol=4.656000e+02
assign (segid "   B" and resid   63 and name  HB1) (segid "   B" and resid   63 and name  HD1) 5.252 3.449 3.449 weight 1.000 ! spec=13Cnoesy, no=1240, id=1013, vol=4.656000e+02
assign (segid "   A" and resid   63 and name  HG1) (segid "   A" and resid   63 and name  HB1) 2.506 0.785 0.785 weight 1.000 ! spec=13Cnoesy, no=1241, id=1014, vol=3.086000e+03
assign (segid "   B" and resid   63 and name  HG1) (segid "   B" and resid   63 and name  HB1) 2.506 0.785 0.785 weight 1.000 ! spec=13Cnoesy, no=1241, id=1014, vol=3.086000e+03
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   63 and name  HD2) 3.806 1.811 1.811 weight 1.000 ! spec=13Cnoesy, no=1242, id=1015, vol=8.040000e+02
assign (segid "   B" and resid   63 and name  HB1) (segid "   B" and resid   63 and name  HD2) 3.806 1.811 1.811 weight 1.000 ! spec=13Cnoesy, no=1242, id=1015, vol=8.040000e+02
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   63 and name  HB2) 2.086 0.544 0.544 weight 1.000 ! spec=13Cnoesy, no=1243, id=1016, vol=3.086000e+03
assign (segid "   B" and resid   63 and name  HB1) (segid "   B" and resid   63 and name  HB2) 2.086 0.544 0.544 weight 1.000 ! spec=13Cnoesy, no=1243, id=1016, vol=3.086000e+03
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   63 and name   HA) 2.935 1.077 1.077 weight 1.000 ! spec=13Cnoesy, no=1245, id=1018, vol=1.852000e+03
assign (segid "   B" and resid   63 and name  HB1) (segid "   B" and resid   63 and name   HA) 2.935 1.077 1.077 weight 1.000 ! spec=13Cnoesy, no=1245, id=1018, vol=1.852000e+03
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   35 and name   HA) 3.949 1.950 1.950 weight 1.000 ! spec=13Cnoesy, no=1250, id=1021, vol=1.258000e+03
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   35 and name   HA) 3.949 1.950 1.950 weight 1.000 ! spec=13Cnoesy, no=1250, id=1021, vol=1.258000e+03
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   28 and name   HA) 3.828 1.831 1.831 weight 1.000 ! spec=13Cnoesy, no=1251, id=1022, vol=7.155000e+02
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   28 and name   HA) 3.828 1.831 1.831 weight 1.000 ! spec=13Cnoesy, no=1251, id=1022, vol=7.155000e+02
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   27 and name   HA) 2.622 0.859 0.859 weight 1.000 ! spec=13Cnoesy, no=1256, id=1027, vol=2.937000e+03
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   27 and name   HA) 2.622 0.859 0.859 weight 1.000 ! spec=13Cnoesy, no=1256, id=1027, vol=2.937000e+03
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   38 and name HG22) 4.291 2.302 2.302 weight 1.000 ! spec=13Cnoesy, no=1257, id=1028, vol=7.467000e+02
    or (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   38 and name HG23)
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   38 and name HG22) 4.291 2.302 2.302 weight 1.000 ! spec=13Cnoesy, no=1257, id=1028, vol=7.467000e+02
    or (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   38 and name HG23)
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   35 and name  HB2) 5.606 3.929 3.929 weight 1.000 ! spec=13Cnoesy, no=1258, id=1029, vol=5.601000e+02
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   35 and name  HB2) 5.606 3.929 3.929 weight 1.000 ! spec=13Cnoesy, no=1258, id=1029, vol=5.601000e+02
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   12 and name  HE1) 5.367 3.600 3.600 weight 1.000 ! spec=13Cnoesy, no=1260, id=1030, vol=3.902000e+02
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   12 and name  HE1) 5.367 3.600 3.600 weight 1.000 ! spec=13Cnoesy, no=1260, id=1030, vol=3.902000e+02
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   12 and name   HA) 3.698 1.710 1.710 weight 1.000 ! spec=13Cnoesy, no=1261, id=1031, vol=1.132000e+03
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   12 and name   HA) 3.698 1.710 1.710 weight 1.000 ! spec=13Cnoesy, no=1261, id=1031, vol=1.132000e+03
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   12 and name  HB1) 2.135 0.570 0.570 weight 1.000 ! spec=13Cnoesy, no=1264, id=1033, vol=3.130000e+03
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   12 and name  HB1) 2.135 0.570 0.570 weight 1.000 ! spec=13Cnoesy, no=1264, id=1033, vol=3.130000e+03
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HE1) 2.567 0.824 0.824 weight 1.000 ! spec=13Cnoesy, no=1266, id=1035, vol=3.491000e+03
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name  HE1) 2.567 0.824 0.824 weight 1.000 ! spec=13Cnoesy, no=1266, id=1035, vol=3.491000e+03
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HE1) 1.669 0.348 0.348 weight 1.000 ! spec=13Cnoesy, no=1267, id=1036, vol=7.238000e+03
assign (segid "   B" and resid   57 and name  HE2) (segid "   B" and resid   57 and name  HE1) 1.669 0.348 0.348 weight 1.000 ! spec=13Cnoesy, no=1267, id=1036, vol=7.238000e+03
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   57 and name   HA) 5.350 3.578 3.578 weight 1.000 ! spec=13Cnoesy, no=1268, id=1037, vol=6.572000e+02
assign (segid "   B" and resid   57 and name  HE1) (segid "   B" and resid   57 and name   HA) 5.350 3.578 3.578 weight 1.000 ! spec=13Cnoesy, no=1268, id=1037, vol=6.572000e+02
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   57 and name  HB2) 5.251 3.447 3.447 weight 1.000 ! spec=13Cnoesy, no=1270, id=1039, vol=6.331000e+02
assign (segid "   B" and resid   57 and name  HE1) (segid "   B" and resid   57 and name  HB2) 5.251 3.447 3.447 weight 1.000 ! spec=13Cnoesy, no=1270, id=1039, vol=6.331000e+02
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name  HZ3) 6.211 4.822 4.822 weight 1.000 ! spec=13Cnoesy, no=1276, id=1043, vol=2.686000e+02
assign (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   21 and name  HZ3) 6.211 4.822 4.822 weight 1.000 ! spec=13Cnoesy, no=1276, id=1043, vol=2.686000e+02
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name  HE1) 6.309 4.975 4.975 weight 1.000 ! spec=13Cnoesy, no=1279, id=1046, vol=2.419000e+02
assign (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   21 and name  HE1) 6.309 4.975 4.975 weight 1.000 ! spec=13Cnoesy, no=1279, id=1046, vol=2.419000e+02
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   61 and name  HB2) 5.095 3.245 3.245 weight 1.000 ! spec=13Cnoesy, no=1286, id=1051, vol=7.949000e+02
assign (segid "   B" and resid   79 and name  HB1) (segid "   B" and resid   61 and name  HB2) 5.095 3.245 3.245 weight 1.000 ! spec=13Cnoesy, no=1286, id=1051, vol=7.949000e+02
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   79 and name   HA) 3.263 1.331 1.331 weight 1.000 ! spec=13Cnoesy, no=1288, id=1053, vol=1.326000e+03
assign (segid "   B" and resid   79 and name  HB1) (segid "   B" and resid   79 and name   HA) 3.263 1.331 1.331 weight 1.000 ! spec=13Cnoesy, no=1288, id=1053, vol=1.326000e+03
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   69 and name  HB1) 2.241 0.628 0.628 weight 1.000 ! spec=13Cnoesy, no=1294, id=1056, vol=1.567000e+03
assign (segid "   B" and resid   69 and name  HB2) (segid "   B" and resid   69 and name  HB1) 2.241 0.628 0.628 weight 1.000 ! spec=13Cnoesy, no=1294, id=1056, vol=1.567000e+03
assign (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   69 and name  HG1) 2.731 0.933 0.933 weight 1.000 ! spec=13Cnoesy, no=1298, id=1060, vol=6.605000e+03
assign (segid "   B" and resid   69 and name  HB1) (segid "   B" and resid   69 and name  HG1) 2.731 0.933 0.933 weight 1.000 ! spec=13Cnoesy, no=1298, id=1060, vol=6.605000e+03
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name   HA) 2.887 1.042 1.042 weight 1.000 ! spec=13Cnoesy, no=1307, id=1065, vol=1.714000e+03
assign (segid "   B" and resid    9 and name  HB2) (segid "   B" and resid    9 and name   HA) 2.887 1.042 1.042 weight 1.000 ! spec=13Cnoesy, no=1307, id=1065, vol=1.714000e+03
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   25 and name  HB1) 2.609 0.851 0.851 weight 1.000 ! spec=13Cnoesy, no=1309, id=1066, vol=2.208000e+03
assign (segid "   B" and resid   25 and name  HD2) (segid "   B" and resid   25 and name  HB1) 2.609 0.851 0.851 weight 1.000 ! spec=13Cnoesy, no=1309, id=1066, vol=2.208000e+03
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   25 and name  HB1) 1.874 1.874 4.126 weight 1.000 ! spec=13Cnoesy, no=1310, id=1067, vol=1.318000e+04
assign (segid "   B" and resid   25 and name  HD1) (segid "   B" and resid   25 and name  HB1) 1.874 1.874 4.126 weight 1.000 ! spec=13Cnoesy, no=1310, id=1067, vol=1.318000e+04
assign (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name HD12) 2.494 0.777 0.777 weight 1.000 ! spec=13Cnoesy, no=1319, id=1075, vol=1.559000e+03
    or (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name HD11)
    or (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name HD13)
assign (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name HD12) 2.494 0.777 0.777 weight 1.000 ! spec=13Cnoesy, no=1319, id=1075, vol=1.559000e+03
    or (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name HD11)
    or (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name HD13)
assign (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name HG12) 2.057 0.529 0.529 weight 1.000 ! spec=13Cnoesy, no=1320, id=1076, vol=1.992000e+03
assign (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name HG12) 2.057 0.529 0.529 weight 1.000 ! spec=13Cnoesy, no=1320, id=1076, vol=1.992000e+03
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG21) 3.579 1.601 1.601 weight 1.000 ! spec=13Cnoesy, no=1322, id=1078, vol=1.300000e+03
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG23)
assign (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   85 and name HG21) 3.579 1.601 1.601 weight 1.000 ! spec=13Cnoesy, no=1322, id=1078, vol=1.300000e+03
    or (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   85 and name HG22)
    or (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   85 and name HG23)
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   85 and name HG21) 4.363 2.379 2.379 weight 1.000 ! spec=13Cnoesy, no=1323, id=1079, vol=6.663000e+02
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   85 and name HG23)
assign (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   85 and name HG21) 4.363 2.379 2.379 weight 1.000 ! spec=13Cnoesy, no=1323, id=1079, vol=6.663000e+02
    or (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   85 and name HG22)
    or (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   85 and name HG23)
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name HG21) 2.224 0.618 0.618 weight 1.000 ! spec=13Cnoesy, no=1325, id=1080, vol=2.652000e+03
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name HG23)
assign (segid "   B" and resid   85 and name   HB) (segid "   B" and resid   85 and name HG21) 2.224 0.618 0.618 weight 1.000 ! spec=13Cnoesy, no=1325, id=1080, vol=2.652000e+03
    or (segid "   B" and resid   85 and name   HB) (segid "   B" and resid   85 and name HG22)
    or (segid "   B" and resid   85 and name   HB) (segid "   B" and resid   85 and name HG23)
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   85 and name HG21) 3.690 1.702 1.702 weight 1.000 ! spec=13Cnoesy, no=1327, id=1082, vol=6.422000e+02
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   85 and name HG23)
assign (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   85 and name HG21) 3.690 1.702 1.702 weight 1.000 ! spec=13Cnoesy, no=1327, id=1082, vol=6.422000e+02
    or (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   85 and name HG22)
    or (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   85 and name HG23)
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   87 and name   HA) 2.878 2.878 3.122 weight 1.000 ! spec=13Cnoesy, no=1328, id=1083, vol=2.370000e+03
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   87 and name   HA)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   87 and name   HA)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid   87 and name   HA) 2.878 2.878 3.122 weight 1.000 ! spec=13Cnoesy, no=1328, id=1083, vol=2.370000e+03
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid   87 and name   HA)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid   87 and name   HA)
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid  106 and name   HA) 3.511 1.541 1.541 weight 1.000 ! spec=13Cnoesy, no=1330, id=1085, vol=2.085000e+03
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid  106 and name   HA)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid  106 and name   HA)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid  106 and name   HA) 3.511 1.541 1.541 weight 1.000 ! spec=13Cnoesy, no=1330, id=1085, vol=2.085000e+03
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid  106 and name   HA)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid  106 and name   HA)
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   85 and name  HG1) 3.092 1.195 1.195 weight 1.000 ! spec=13Cnoesy, no=1335, id=1090, vol=1.408000e+03
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   85 and name  HG1)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   85 and name  HG1)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid   85 and name  HG1) 3.092 1.195 1.195 weight 1.000 ! spec=13Cnoesy, no=1335, id=1090, vol=1.408000e+03
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid   85 and name  HG1)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid   85 and name  HG1)
assign (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   58 and name  HB1) 3.590 1.611 1.611 weight 1.000 ! spec=13Cnoesy, no=1337, id=1091, vol=5.544000e+02
assign (segid "   B" and resid   58 and name   HA) (segid "   B" and resid   58 and name  HB1) 3.590 1.611 1.611 weight 1.000 ! spec=13Cnoesy, no=1337, id=1091, vol=5.544000e+02
assign (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   58 and name  HB2) 4.084 2.085 2.085 weight 1.000 ! spec=13Cnoesy, no=1339, id=1092, vol=7.306000e+02
assign (segid "   B" and resid   58 and name   HA) (segid "   B" and resid   58 and name  HB2) 4.084 2.085 2.085 weight 1.000 ! spec=13Cnoesy, no=1339, id=1092, vol=7.306000e+02
assign (segid "   A" and resid    5 and name  HG2) (segid "   A" and resid   12 and name  HE1) 7.697 7.406 7.406 weight 1.000 ! spec=13Cnoesy, no=1347, id=1099, vol=3.560000e+02
assign (segid "   B" and resid    5 and name  HG2) (segid "   B" and resid   12 and name  HE1) 7.697 7.406 7.406 weight 1.000 ! spec=13Cnoesy, no=1347, id=1099, vol=3.560000e+02
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   30 and name   HA) 4.275 2.285 2.285 weight 1.000 ! spec=13Cnoesy, no=1352, id=1103, vol=3.475000e+02
assign (segid "   B" and resid   30 and name  HB2) (segid "   B" and resid   30 and name   HA) 4.275 2.285 2.285 weight 1.000 ! spec=13Cnoesy, no=1352, id=1103, vol=3.475000e+02
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name   HN) 3.991 1.991 1.991 weight 1.000 ! spec=13Cnoesy, no=1380, id=1122, vol=3.671000e+02
assign (segid "   B" and resid   14 and name   HA) (segid "   B" and resid   14 and name   HN) 3.991 1.991 1.991 weight 1.000 ! spec=13Cnoesy, no=1380, id=1122, vol=3.671000e+02
assign (segid "   A" and resid   67 and name  HA2) (segid "   A" and resid   64 and name HG22) 4.313 2.325 2.325 weight 1.000 ! spec=13Cnoesy, no=1383, id=1125, vol=5.381000e+02
    or (segid "   A" and resid   67 and name  HA2) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   67 and name  HA2) (segid "   A" and resid   64 and name HG23)
assign (segid "   B" and resid   67 and name  HA2) (segid "   B" and resid   64 and name HG22) 4.313 2.325 2.325 weight 1.000 ! spec=13Cnoesy, no=1383, id=1125, vol=5.381000e+02
    or (segid "   B" and resid   67 and name  HA2) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   67 and name  HA2) (segid "   B" and resid   64 and name HG23)
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name  HB1) 2.586 0.836 0.836 weight 1.000 ! spec=13Cnoesy, no=1386, id=1128, vol=1.638000e+03
assign (segid "   B" and resid   15 and name  HB2) (segid "   B" and resid   15 and name  HB1) 2.586 0.836 0.836 weight 1.000 ! spec=13Cnoesy, no=1386, id=1128, vol=1.638000e+03
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name   HA) 4.273 2.282 2.282 weight 1.000 ! spec=13Cnoesy, no=1387, id=1129, vol=3.389000e+02
assign (segid "   B" and resid   15 and name  HB2) (segid "   B" and resid   15 and name   HA) 4.273 2.282 2.282 weight 1.000 ! spec=13Cnoesy, no=1387, id=1129, vol=3.389000e+02
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   18 and name   HN) 4.842 2.930 2.930 weight 1.000 ! spec=13Cnoesy, no=1389, id=1131, vol=4.528000e+02
assign (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   18 and name   HN) 4.842 2.930 2.930 weight 1.000 ! spec=13Cnoesy, no=1389, id=1131, vol=4.528000e+02
assign (segid "   A" and resid   56 and name   HB) (segid "   A" and resid   56 and name   HA) 3.632 1.649 1.649 weight 1.000 ! spec=13Cnoesy, no=1391, id=1133, vol=6.914000e+02
assign (segid "   B" and resid   56 and name   HB) (segid "   B" and resid   56 and name   HA) 3.632 1.649 1.649 weight 1.000 ! spec=13Cnoesy, no=1391, id=1133, vol=6.914000e+02
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   20 and name HG22) 3.401 1.446 1.446 weight 1.000 ! spec=13Cnoesy, no=1396, id=1138, vol=1.336000e+03
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   20 and name HG21)
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   20 and name HG23)
assign (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   20 and name HG22) 3.401 1.446 1.446 weight 1.000 ! spec=13Cnoesy, no=1396, id=1138, vol=1.336000e+03
    or (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   20 and name HG21)
    or (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   20 and name HG23)
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name  HG1) 3.224 1.299 1.299 weight 1.000 ! spec=13Cnoesy, no=1404, id=1145, vol=2.953000e+03
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   74 and name  HG1) 3.224 1.299 1.299 weight 1.000 ! spec=13Cnoesy, no=1404, id=1145, vol=2.953000e+03
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   75 and name  HD2) 5.979 4.468 4.468 weight 1.000 ! spec=13Cnoesy, no=1405, id=1146, vol=5.075000e+02
assign (segid "   B" and resid   74 and name  HG1) (segid "   B" and resid   75 and name  HD2) 5.979 4.468 4.468 weight 1.000 ! spec=13Cnoesy, no=1405, id=1146, vol=5.075000e+02
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name  HG1) 2.847 1.013 1.013 weight 1.000 ! spec=13Cnoesy, no=1407, id=1148, vol=2.296000e+03
assign (segid "   B" and resid   74 and name  HB2) (segid "   B" and resid   74 and name  HG1) 2.847 1.013 1.013 weight 1.000 ! spec=13Cnoesy, no=1407, id=1148, vol=2.296000e+03
assign (segid "   A" and resid   74 and name  HD2) (segid "   A" and resid   74 and name  HG1) 2.688 0.903 0.903 weight 1.000 ! spec=13Cnoesy, no=1408, id=1149, vol=2.953000e+03
assign (segid "   B" and resid   74 and name  HD2) (segid "   B" and resid   74 and name  HG1) 2.688 0.903 0.903 weight 1.000 ! spec=13Cnoesy, no=1408, id=1149, vol=2.953000e+03
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   74 and name   HA) 3.007 1.130 1.130 weight 1.000 ! spec=13Cnoesy, no=1410, id=1151, vol=1.740000e+03
assign (segid "   B" and resid   74 and name  HG1) (segid "   B" and resid   74 and name   HA) 3.007 1.130 1.130 weight 1.000 ! spec=13Cnoesy, no=1410, id=1151, vol=1.740000e+03
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name  HE1) 5.676 4.027 4.027 weight 1.000 ! spec=13Cnoesy, no=1413, id=1154, vol=4.304000e+02
assign (segid "   B" and resid   75 and name  HB2) (segid "   B" and resid   75 and name  HE1) 5.676 4.027 4.027 weight 1.000 ! spec=13Cnoesy, no=1413, id=1154, vol=4.304000e+02
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   88 and name  HB2) 1.808 0.409 0.409 weight 1.000 ! spec=13Cnoesy, no=1419, id=1160, vol=1.927000e+04
assign (segid "   B" and resid   88 and name  HD2) (segid "   B" and resid   88 and name  HB2) 1.808 0.409 0.409 weight 1.000 ! spec=13Cnoesy, no=1419, id=1160, vol=1.927000e+04
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   88 and name  HG2) 1.753 1.753 4.247 weight 1.000 ! spec=13Cnoesy, no=1420, id=1161, vol=2.314000e+04
assign (segid "   B" and resid   88 and name  HD2) (segid "   B" and resid   88 and name  HG2) 1.753 1.753 4.247 weight 1.000 ! spec=13Cnoesy, no=1420, id=1161, vol=2.314000e+04
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   88 and name  HE2) 1.710 1.710 4.290 weight 1.000 ! spec=13Cnoesy, no=1421, id=1162, vol=1.882000e+04
assign (segid "   B" and resid   88 and name  HD2) (segid "   B" and resid   88 and name  HE2) 1.710 1.710 4.290 weight 1.000 ! spec=13Cnoesy, no=1421, id=1162, vol=1.882000e+04
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   22 and name HG12) 4.594 2.638 2.638 weight 1.000 ! spec=13Cnoesy, no=1423, id=1164, vol=9.051000e+02
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   22 and name HG11)
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   22 and name HG13)
assign (segid "   B" and resid   24 and name  HB1) (segid "   B" and resid   22 and name HG12) 4.594 2.638 2.638 weight 1.000 ! spec=13Cnoesy, no=1423, id=1164, vol=9.051000e+02
    or (segid "   B" and resid   24 and name  HB1) (segid "   B" and resid   22 and name HG11)
    or (segid "   B" and resid   24 and name  HB1) (segid "   B" and resid   22 and name HG13)
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name HG12) 1.829 0.418 0.418 weight 1.000 ! spec=13Cnoesy, no=1426, id=1167, vol=5.070000e+03
    or (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name HG11)
    or (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name HG13)
assign (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   22 and name HG12) 1.829 0.418 0.418 weight 1.000 ! spec=13Cnoesy, no=1426, id=1167, vol=5.070000e+03
    or (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   22 and name HG11)
    or (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   22 and name HG13)
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   53 and name  HB1) 4.144 2.147 2.147 weight 1.000 ! spec=13Cnoesy, no=1429, id=1170, vol=7.236000e+02
    or (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   22 and name HG13) (segid "   A" and resid   53 and name  HB1)
assign (segid "   B" and resid   22 and name HG12) (segid "   B" and resid   53 and name  HB1) 4.144 2.147 2.147 weight 1.000 ! spec=13Cnoesy, no=1429, id=1170, vol=7.236000e+02
    or (segid "   B" and resid   22 and name HG11) (segid "   B" and resid   53 and name  HB1)
    or (segid "   B" and resid   22 and name HG13) (segid "   B" and resid   53 and name  HB1)
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   53 and name  HD1) 4.668 2.724 2.724 weight 1.000 ! spec=13Cnoesy, no=1431, id=1172, vol=1.007000e+03
    or (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   53 and name  HD1)
    or (segid "   A" and resid   22 and name HG13) (segid "   A" and resid   53 and name  HD1)
assign (segid "   B" and resid   22 and name HG12) (segid "   B" and resid   53 and name  HD1) 4.668 2.724 2.724 weight 1.000 ! spec=13Cnoesy, no=1431, id=1172, vol=1.007000e+03
    or (segid "   B" and resid   22 and name HG11) (segid "   B" and resid   53 and name  HD1)
    or (segid "   B" and resid   22 and name HG13) (segid "   B" and resid   53 and name  HD1)
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   95 and name   HN) 4.360 2.377 2.377 weight 1.000 ! spec=13Cnoesy, no=1433, id=1174, vol=8.522000e+02
assign (segid "   B" and resid   94 and name   HA) (segid "   B" and resid   95 and name   HN) 4.360 2.377 2.377 weight 1.000 ! spec=13Cnoesy, no=1433, id=1174, vol=8.522000e+02
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HB2) 2.792 0.974 0.974 weight 1.000 ! spec=13Cnoesy, no=1435, id=1176, vol=7.602000e+03
assign (segid "   B" and resid   94 and name   HA) (segid "   B" and resid   94 and name  HB2) 2.792 0.974 0.974 weight 1.000 ! spec=13Cnoesy, no=1435, id=1176, vol=7.602000e+03
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HG1) 2.868 1.028 1.028 weight 1.000 ! spec=13Cnoesy, no=1436, id=1177, vol=4.409000e+03
assign (segid "   B" and resid   94 and name   HA) (segid "   B" and resid   94 and name  HG1) 2.868 1.028 1.028 weight 1.000 ! spec=13Cnoesy, no=1436, id=1177, vol=4.409000e+03
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name   HN) 3.235 1.308 1.308 weight 1.000 ! spec=13Cnoesy, no=1437, id=1178, vol=1.779000e+03
assign (segid "   B" and resid   94 and name   HA) (segid "   B" and resid   94 and name   HN) 3.235 1.308 1.308 weight 1.000 ! spec=13Cnoesy, no=1437, id=1178, vol=1.779000e+03
assign (segid "   A" and resid   81 and name   HB) (segid "   A" and resid   81 and name   HN) 3.737 1.746 1.746 weight 1.000 ! spec=13Cnoesy, no=1442, id=1183, vol=4.274000e+02
assign (segid "   B" and resid   81 and name   HB) (segid "   B" and resid   81 and name   HN) 3.737 1.746 1.746 weight 1.000 ! spec=13Cnoesy, no=1442, id=1183, vol=4.274000e+02
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   20 and name HG12) 2.295 0.658 0.658 weight 1.000 ! spec=13Cnoesy, no=1449, id=1190, vol=4.517000e+03
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   20 and name HG11)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   20 and name HG13)
assign (segid "   B" and resid   22 and name   HA) (segid "   B" and resid   20 and name HG12) 2.295 0.658 0.658 weight 1.000 ! spec=13Cnoesy, no=1449, id=1190, vol=4.517000e+03
    or (segid "   B" and resid   22 and name   HA) (segid "   B" and resid   20 and name HG11)
    or (segid "   B" and resid   22 and name   HA) (segid "   B" and resid   20 and name HG13)
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   20 and name   HA) 2.491 0.776 0.776 weight 1.000 ! spec=13Cnoesy, no=1451, id=1192, vol=4.511000e+03
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   20 and name   HA)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   20 and name   HA)
assign (segid "   B" and resid   20 and name HG12) (segid "   B" and resid   20 and name   HA) 2.491 0.776 0.776 weight 1.000 ! spec=13Cnoesy, no=1451, id=1192, vol=4.511000e+03
    or (segid "   B" and resid   20 and name HG11) (segid "   B" and resid   20 and name   HA)
    or (segid "   B" and resid   20 and name HG13) (segid "   B" and resid   20 and name   HA)
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   55 and name   HN) 3.473 1.508 1.508 weight 1.000 ! spec=13Cnoesy, no=1456, id=1196, vol=2.296000e+03
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   55 and name   HN)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   55 and name   HN)
assign (segid "   B" and resid   20 and name HG12) (segid "   B" and resid   55 and name   HN) 3.473 1.508 1.508 weight 1.000 ! spec=13Cnoesy, no=1456, id=1196, vol=2.296000e+03
    or (segid "   B" and resid   20 and name HG11) (segid "   B" and resid   55 and name   HN)
    or (segid "   B" and resid   20 and name HG13) (segid "   B" and resid   55 and name   HN)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name  HB2) 2.755 0.949 0.949 weight 1.000 ! spec=13Cnoesy, no=1457, id=1197, vol=2.338000e+03
assign (segid "   B" and resid   41 and name   HA) (segid "   B" and resid   41 and name  HB2) 2.755 0.949 0.949 weight 1.000 ! spec=13Cnoesy, no=1457, id=1197, vol=2.338000e+03
assign (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   43 and name   HN) 4.806 2.888 2.888 weight 1.000 ! spec=13Cnoesy, no=1458, id=1198, vol=2.754000e+02
assign (segid "   B" and resid   41 and name  HB2) (segid "   B" and resid   43 and name   HN) 4.806 2.888 2.888 weight 1.000 ! spec=13Cnoesy, no=1458, id=1198, vol=2.754000e+02
assign (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   42 and name   HN) 2.773 0.961 0.961 weight 1.000 ! spec=13Cnoesy, no=1461, id=1201, vol=2.358000e+03
assign (segid "   B" and resid   41 and name  HB2) (segid "   B" and resid   42 and name   HN) 2.773 0.961 0.961 weight 1.000 ! spec=13Cnoesy, no=1461, id=1201, vol=2.358000e+03
assign (segid "   A" and resid   56 and name   HB) (segid "   A" and resid  107 and name  HB2) 4.593 2.637 2.637 weight 1.000 ! spec=13Cnoesy, no=1463, id=1203, vol=4.514000e+02
    or (segid "   A" and resid   56 and name   HB) (segid "   A" and resid  107 and name  HB1)
    or (segid "   A" and resid   56 and name   HB) (segid "   A" and resid  107 and name  HB3)
assign (segid "   B" and resid   56 and name   HB) (segid "   B" and resid  107 and name  HB2) 4.593 2.637 2.637 weight 1.000 ! spec=13Cnoesy, no=1463, id=1203, vol=4.514000e+02
    or (segid "   B" and resid   56 and name   HB) (segid "   B" and resid  107 and name  HB1)
    or (segid "   B" and resid   56 and name   HB) (segid "   B" and resid  107 and name  HB3)
assign (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  107 and name  HB2) 1.528 1.528 4.472 weight 1.000 ! spec=13Cnoesy, no=1464, id=1204, vol=1.075000e+04
    or (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  107 and name  HB1)
    or (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  107 and name  HB3)
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  107 and name  HB2)
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  107 and name  HB1)
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  107 and name  HB3)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  107 and name  HB2)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  107 and name  HB1)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  107 and name  HB3)
assign (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  107 and name  HB2) 1.528 1.528 4.472 weight 1.000 ! spec=13Cnoesy, no=1464, id=1204, vol=1.075000e+04
    or (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  107 and name  HB1)
    or (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  107 and name  HB3)
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  107 and name  HB2)
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  107 and name  HB1)
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  107 and name  HB3)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  107 and name  HB2)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  107 and name  HB1)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  107 and name  HB3)
assign (segid "   A" and resid  107 and name  HB2) (segid "   A" and resid  107 and name   HA) 2.070 0.536 0.536 weight 1.000 ! spec=13Cnoesy, no=1465, id=1205, vol=6.098000e+03
    or (segid "   A" and resid  107 and name  HB1) (segid "   A" and resid  107 and name   HA)
    or (segid "   A" and resid  107 and name  HB3) (segid "   A" and resid  107 and name   HA)
assign (segid "   B" and resid  107 and name  HB2) (segid "   B" and resid  107 and name   HA) 2.070 0.536 0.536 weight 1.000 ! spec=13Cnoesy, no=1465, id=1205, vol=6.098000e+03
    or (segid "   B" and resid  107 and name  HB1) (segid "   B" and resid  107 and name   HA)
    or (segid "   B" and resid  107 and name  HB3) (segid "   B" and resid  107 and name   HA)
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   87 and name   HB) 1.942 0.471 0.471 weight 1.000 ! spec=13Cnoesy, no=1469, id=1209, vol=6.356000e+03
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   87 and name   HB)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   87 and name   HB)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   87 and name   HB) 1.942 0.471 0.471 weight 1.000 ! spec=13Cnoesy, no=1469, id=1209, vol=6.356000e+03
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   87 and name   HB)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   87 and name   HB)
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   87 and name   HB) 2.784 2.784 3.216 weight 1.000 ! spec=13Cnoesy, no=1472, id=1211, vol=4.000000e+03
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   87 and name   HB)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   87 and name   HB)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid   87 and name   HB) 2.784 2.784 3.216 weight 1.000 ! spec=13Cnoesy, no=1472, id=1211, vol=4.000000e+03
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid   87 and name   HB)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid   87 and name   HB)
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name   HB) 2.763 0.954 0.954 weight 1.000 ! spec=13Cnoesy, no=1473, id=1212, vol=2.372000e+03
assign (segid "   B" and resid   87 and name   HA) (segid "   B" and resid   87 and name   HB) 2.763 0.954 0.954 weight 1.000 ! spec=13Cnoesy, no=1473, id=1212, vol=2.372000e+03
assign (segid "   A" and resid   87 and name   HB) (segid "   A" and resid   87 and name HG22) 1.962 0.481 0.481 weight 1.000 ! spec=13Cnoesy, no=1476, id=1215, vol=5.327000e+03
    or (segid "   A" and resid   87 and name   HB) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid   87 and name   HB) (segid "   A" and resid   87 and name HG23)
assign (segid "   B" and resid   87 and name   HB) (segid "   B" and resid   87 and name HG22) 1.962 0.481 0.481 weight 1.000 ! spec=13Cnoesy, no=1476, id=1215, vol=5.327000e+03
    or (segid "   B" and resid   87 and name   HB) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid   87 and name   HB) (segid "   B" and resid   87 and name HG23)
assign (segid "   A" and resid   65 and name   HA) (segid "   A" and resid   65 and name  HB2) 2.730 0.931 0.931 weight 1.000 ! spec=13Cnoesy, no=1478, id=1217, vol=6.838000e+03
assign (segid "   B" and resid   65 and name   HA) (segid "   B" and resid   65 and name  HB2) 2.730 0.931 0.931 weight 1.000 ! spec=13Cnoesy, no=1478, id=1217, vol=6.838000e+03
assign (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   66 and name   HN) 4.537 2.573 2.573 weight 1.000 ! spec=13Cnoesy, no=1480, id=1219, vol=1.148000e+03
assign (segid "   B" and resid   65 and name  HB2) (segid "   B" and resid   66 and name   HN) 4.537 2.573 2.573 weight 1.000 ! spec=13Cnoesy, no=1480, id=1219, vol=1.148000e+03
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   19 and name  HB1) 4.660 2.715 2.715 weight 1.000 ! spec=13Cnoesy, no=1484, id=1223, vol=4.168000e+02
assign (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   19 and name  HB1) 4.660 2.715 2.715 weight 1.000 ! spec=13Cnoesy, no=1484, id=1223, vol=4.168000e+02
assign (segid "   A" and resid   91 and name   HB) (segid "   A" and resid   91 and name   HN) 4.465 2.492 2.492 weight 1.000 ! spec=13Cnoesy, no=1490, id=1229, vol=3.148000e+02
assign (segid "   B" and resid   91 and name   HB) (segid "   B" and resid   91 and name   HN) 4.465 2.492 2.492 weight 1.000 ! spec=13Cnoesy, no=1490, id=1229, vol=3.148000e+02
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   44 and name HG22) 4.096 2.097 2.097 weight 1.000 ! spec=13Cnoesy, no=1496, id=1234, vol=8.852000e+02
    or (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   45 and name  HB1) (segid "   B" and resid   44 and name HG22) 4.096 2.097 2.097 weight 1.000 ! spec=13Cnoesy, no=1496, id=1234, vol=8.852000e+02
    or (segid "   B" and resid   45 and name  HB1) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   45 and name  HB1) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name   HA) 3.735 1.743 1.743 weight 1.000 ! spec=13Cnoesy, no=1497, id=1235, vol=8.442000e+02
assign (segid "   B" and resid   45 and name  HB1) (segid "   B" and resid   45 and name   HA) 3.735 1.743 1.743 weight 1.000 ! spec=13Cnoesy, no=1497, id=1235, vol=8.442000e+02
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name   HA) 3.381 1.429 1.429 weight 1.000 ! spec=13Cnoesy, no=1502, id=1240, vol=1.946000e+03
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid    8 and name   HA) 3.381 1.429 1.429 weight 1.000 ! spec=13Cnoesy, no=1502, id=1240, vol=1.946000e+03
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    9 and name  HB2) 5.391 3.633 3.633 weight 1.000 ! spec=13Cnoesy, no=1503, id=1241, vol=3.515000e+02
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid    9 and name  HB2) 5.391 3.633 3.633 weight 1.000 ! spec=13Cnoesy, no=1503, id=1241, vol=3.515000e+02
assign (segid "   A" and resid   95 and name  HD2) (segid "   A" and resid   94 and name  HG2) 5.696 4.055 4.055 weight 1.000 ! spec=13Cnoesy, no=1510, id=1246, vol=6.149000e+02
assign (segid "   B" and resid   95 and name  HD2) (segid "   B" and resid   94 and name  HG2) 5.696 4.055 4.055 weight 1.000 ! spec=13Cnoesy, no=1510, id=1246, vol=6.149000e+02
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HG2) 3.683 1.696 1.696 weight 1.000 ! spec=13Cnoesy, no=1511, id=1247, vol=3.455000e+03
assign (segid "   B" and resid   94 and name   HA) (segid "   B" and resid   94 and name  HG2) 3.683 1.696 1.696 weight 1.000 ! spec=13Cnoesy, no=1511, id=1247, vol=3.455000e+03
assign (segid "   A" and resid   94 and name  HG2) (segid "   A" and resid   94 and name  HB2) 1.867 0.436 0.436 weight 1.000 ! spec=13Cnoesy, no=1512, id=1248, vol=3.059000e+04
assign (segid "   B" and resid   94 and name  HG2) (segid "   B" and resid   94 and name  HB2) 1.867 0.436 0.436 weight 1.000 ! spec=13Cnoesy, no=1512, id=1248, vol=3.059000e+04
assign (segid "   A" and resid   94 and name  HG2) (segid "   A" and resid   94 and name  HG1) 1.368 1.368 4.632 weight 1.000 ! spec=13Cnoesy, no=1513, id=1249, vol=5.645000e+04
assign (segid "   B" and resid   94 and name  HG2) (segid "   B" and resid   94 and name  HG1) 1.368 1.368 4.632 weight 1.000 ! spec=13Cnoesy, no=1513, id=1249, vol=5.645000e+04
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name   HG) 2.736 0.936 0.936 weight 1.000 ! spec=13Cnoesy, no=1516, id=1252, vol=1.172000e+03
assign (segid "   B" and resid   90 and name  HB2) (segid "   B" and resid   90 and name   HG) 2.736 0.936 0.936 weight 1.000 ! spec=13Cnoesy, no=1516, id=1252, vol=1.172000e+03
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name HD12) 3.151 1.241 1.241 weight 1.000 ! spec=13Cnoesy, no=1518, id=1254, vol=1.533000e+03
    or (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name HD11)
    or (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name HD13)
assign (segid "   B" and resid   90 and name  HB2) (segid "   B" and resid   90 and name HD12) 3.151 1.241 1.241 weight 1.000 ! spec=13Cnoesy, no=1518, id=1254, vol=1.533000e+03
    or (segid "   B" and resid   90 and name  HB2) (segid "   B" and resid   90 and name HD11)
    or (segid "   B" and resid   90 and name  HB2) (segid "   B" and resid   90 and name HD13)
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   44 and name HG22) 3.519 1.548 1.548 weight 1.000 ! spec=13Cnoesy, no=1525, id=1259, vol=1.168000e+03
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   44 and name HG22) 3.519 1.548 1.548 weight 1.000 ! spec=13Cnoesy, no=1525, id=1259, vol=1.168000e+03
    or (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name  HB2) 1.842 0.424 0.424 weight 1.000 ! spec=13Cnoesy, no=1526, id=1260, vol=1.202000e+04
assign (segid "   B" and resid   45 and name  HB1) (segid "   B" and resid   45 and name  HB2) 1.842 0.424 0.424 weight 1.000 ! spec=13Cnoesy, no=1526, id=1260, vol=1.202000e+04
assign (segid "   A" and resid   69 and name  HD1) (segid "   A" and resid   69 and name  HB2) 2.221 0.617 0.617 weight 1.000 ! spec=13Cnoesy, no=1533, id=1266, vol=7.170000e+03
assign (segid "   B" and resid   69 and name  HD1) (segid "   B" and resid   69 and name  HB2) 2.221 0.617 0.617 weight 1.000 ! spec=13Cnoesy, no=1533, id=1266, vol=7.170000e+03
assign (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   69 and name  HD1) 3.012 1.134 1.134 weight 1.000 ! spec=13Cnoesy, no=1535, id=1268, vol=2.752000e+03
assign (segid "   B" and resid   69 and name  HB1) (segid "   B" and resid   69 and name  HD1) 3.012 1.134 1.134 weight 1.000 ! spec=13Cnoesy, no=1535, id=1268, vol=2.752000e+03
assign (segid "   A" and resid   69 and name  HD1) (segid "   A" and resid   69 and name  HG2) 3.325 1.382 1.382 weight 1.000 ! spec=13Cnoesy, no=1537, id=1269, vol=2.128000e+03
assign (segid "   B" and resid   69 and name  HD1) (segid "   B" and resid   69 and name  HG2) 3.325 1.382 1.382 weight 1.000 ! spec=13Cnoesy, no=1537, id=1269, vol=2.128000e+03
assign (segid "   A" and resid   69 and name  HD1) (segid "   A" and resid   69 and name  HG1) 2.365 0.699 0.699 weight 1.000 ! spec=13Cnoesy, no=1538, id=1270, vol=4.699000e+03
assign (segid "   B" and resid   69 and name  HD1) (segid "   B" and resid   69 and name  HG1) 2.365 0.699 0.699 weight 1.000 ! spec=13Cnoesy, no=1538, id=1270, vol=4.699000e+03
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name   HA) 2.821 0.995 0.995 weight 1.000 ! spec=13Cnoesy, no=1540, id=1272, vol=5.191000e+03
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   74 and name   HA) 2.821 0.995 0.995 weight 1.000 ! spec=13Cnoesy, no=1540, id=1272, vol=5.191000e+03
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name   HA) 2.594 0.841 0.841 weight 1.000 ! spec=13Cnoesy, no=1542, id=1274, vol=3.653000e+03
assign (segid "   B" and resid   74 and name  HB2) (segid "   B" and resid   74 and name   HA) 2.594 0.841 0.841 weight 1.000 ! spec=13Cnoesy, no=1542, id=1274, vol=3.653000e+03
assign (segid "   A" and resid   74 and name  HD2) (segid "   A" and resid   74 and name   HA) 4.120 2.122 2.122 weight 1.000 ! spec=13Cnoesy, no=1543, id=1275, vol=5.191000e+03
assign (segid "   B" and resid   74 and name  HD2) (segid "   B" and resid   74 and name   HA) 4.120 2.122 2.122 weight 1.000 ! spec=13Cnoesy, no=1543, id=1275, vol=5.191000e+03
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name  HD1) 4.173 2.177 2.177 weight 1.000 ! spec=13Cnoesy, no=1548, id=1280, vol=2.318000e+03
assign (segid "   B" and resid   74 and name   HA) (segid "   B" and resid   74 and name  HD1) 4.173 2.177 2.177 weight 1.000 ! spec=13Cnoesy, no=1548, id=1280, vol=2.318000e+03
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   74 and name  HG2) 1.651 0.341 0.341 weight 1.000 ! spec=13Cnoesy, no=1555, id=1287, vol=1.268000e+04
assign (segid "   B" and resid   74 and name  HG1) (segid "   B" and resid   74 and name  HG2) 1.651 0.341 0.341 weight 1.000 ! spec=13Cnoesy, no=1555, id=1287, vol=1.268000e+04
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name  HG2) 3.549 1.575 1.575 weight 1.000 ! spec=13Cnoesy, no=1557, id=1289, vol=2.179000e+03
assign (segid "   B" and resid   74 and name   HA) (segid "   B" and resid   74 and name  HG2) 3.549 1.575 1.575 weight 1.000 ! spec=13Cnoesy, no=1557, id=1289, vol=2.179000e+03
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   18 and name   HA) 6.679 5.575 5.575 weight 1.000 ! spec=13Cnoesy, no=1563, id=1295, vol=2.654000e+02
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   18 and name   HA) 6.679 5.575 5.575 weight 1.000 ! spec=13Cnoesy, no=1563, id=1295, vol=2.654000e+02
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   95 and name  HG2) 4.601 2.647 2.647 weight 1.000 ! spec=13Cnoesy, no=1568, id=1300, vol=8.422000e+02
assign (segid "   B" and resid   94 and name  HB2) (segid "   B" and resid   95 and name  HG2) 4.601 2.647 2.647 weight 1.000 ! spec=13Cnoesy, no=1568, id=1300, vol=8.422000e+02
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name   HA) 3.044 1.158 1.158 weight 1.000 ! spec=13Cnoesy, no=1575, id=1307, vol=1.016000e+03
assign (segid "   B" and resid   17 and name  HB1) (segid "   B" and resid   17 and name   HA) 3.044 1.158 1.158 weight 1.000 ! spec=13Cnoesy, no=1575, id=1307, vol=1.016000e+03
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   17 and name   HA) 4.335 2.349 2.349 weight 1.000 ! spec=13Cnoesy, no=1576, id=1308, vol=7.085000e+02
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   17 and name   HA) 4.335 2.349 2.349 weight 1.000 ! spec=13Cnoesy, no=1576, id=1308, vol=7.085000e+02
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name HG21) 2.706 0.915 0.915 weight 1.000 ! spec=13Cnoesy, no=1592, id=1320, vol=2.736000e+03
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name HG22)
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name HG23)
assign (segid "   B" and resid   83 and name   HA) (segid "   B" and resid   83 and name HG21) 2.706 0.915 0.915 weight 1.000 ! spec=13Cnoesy, no=1592, id=1320, vol=2.736000e+03
    or (segid "   B" and resid   83 and name   HA) (segid "   B" and resid   83 and name HG22)
    or (segid "   B" and resid   83 and name   HA) (segid "   B" and resid   83 and name HG23)
assign (segid "   A" and resid   83 and name HG21) (segid "   A" and resid  109 and name HG12) 1.679 1.679 4.321 weight 1.000 ! spec=13Cnoesy, no=1593, id=1321, vol=1.069000e+04
    or (segid "   A" and resid   83 and name HG21) (segid "   A" and resid  109 and name HG11)
    or (segid "   A" and resid   83 and name HG21) (segid "   A" and resid  109 and name HG13)
    or (segid "   A" and resid   83 and name HG22) (segid "   A" and resid  109 and name HG12)
    or (segid "   A" and resid   83 and name HG22) (segid "   A" and resid  109 and name HG11)
    or (segid "   A" and resid   83 and name HG22) (segid "   A" and resid  109 and name HG13)
    or (segid "   A" and resid   83 and name HG23) (segid "   A" and resid  109 and name HG12)
    or (segid "   A" and resid   83 and name HG23) (segid "   A" and resid  109 and name HG11)
    or (segid "   A" and resid   83 and name HG23) (segid "   A" and resid  109 and name HG13)
assign (segid "   B" and resid   83 and name HG21) (segid "   B" and resid  109 and name HG12) 1.679 1.679 4.321 weight 1.000 ! spec=13Cnoesy, no=1593, id=1321, vol=1.069000e+04
    or (segid "   B" and resid   83 and name HG21) (segid "   B" and resid  109 and name HG11)
    or (segid "   B" and resid   83 and name HG21) (segid "   B" and resid  109 and name HG13)
    or (segid "   B" and resid   83 and name HG22) (segid "   B" and resid  109 and name HG12)
    or (segid "   B" and resid   83 and name HG22) (segid "   B" and resid  109 and name HG11)
    or (segid "   B" and resid   83 and name HG22) (segid "   B" and resid  109 and name HG13)
    or (segid "   B" and resid   83 and name HG23) (segid "   B" and resid  109 and name HG12)
    or (segid "   B" and resid   83 and name HG23) (segid "   B" and resid  109 and name HG11)
    or (segid "   B" and resid   83 and name HG23) (segid "   B" and resid  109 and name HG13)
assign (segid "   A" and resid   83 and name HG21) (segid "   A" and resid   83 and name   HB) 2.068 0.534 0.534 weight 1.000 ! spec=13Cnoesy, no=1595, id=1323, vol=4.824000e+03
    or (segid "   A" and resid   83 and name HG22) (segid "   A" and resid   83 and name   HB)
    or (segid "   A" and resid   83 and name HG23) (segid "   A" and resid   83 and name   HB)
assign (segid "   B" and resid   83 and name HG21) (segid "   B" and resid   83 and name   HB) 2.068 0.534 0.534 weight 1.000 ! spec=13Cnoesy, no=1595, id=1323, vol=4.824000e+03
    or (segid "   B" and resid   83 and name HG22) (segid "   B" and resid   83 and name   HB)
    or (segid "   B" and resid   83 and name HG23) (segid "   B" and resid   83 and name   HB)
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name  HB2) 2.559 0.819 0.819 weight 1.000 ! spec=13Cnoesy, no=1598, id=1326, vol=1.219000e+03
assign (segid "   B" and resid   80 and name  HB1) (segid "   B" and resid   80 and name  HB2) 2.559 0.819 0.819 weight 1.000 ! spec=13Cnoesy, no=1598, id=1326, vol=1.219000e+03
assign (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name HD22) 4.304 2.316 2.316 weight 1.000 ! spec=13Cnoesy, no=1605, id=1333, vol=4.748000e+02
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name HD21)
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name HD23)
assign (segid "   B" and resid   90 and name   HA) (segid "   B" and resid   90 and name HD22) 4.304 2.316 2.316 weight 1.000 ! spec=13Cnoesy, no=1605, id=1333, vol=4.748000e+02
    or (segid "   B" and resid   90 and name   HA) (segid "   B" and resid   90 and name HD21)
    or (segid "   B" and resid   90 and name   HA) (segid "   B" and resid   90 and name HD23)
assign (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name HD12) 3.137 1.230 1.230 weight 1.000 ! spec=13Cnoesy, no=1609, id=1335, vol=7.457000e+02
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name HD11)
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name HD13)
assign (segid "   B" and resid   90 and name   HA) (segid "   B" and resid   90 and name HD12) 3.137 1.230 1.230 weight 1.000 ! spec=13Cnoesy, no=1609, id=1335, vol=7.457000e+02
    or (segid "   B" and resid   90 and name   HA) (segid "   B" and resid   90 and name HD11)
    or (segid "   B" and resid   90 and name   HA) (segid "   B" and resid   90 and name HD13)
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name   HA) 3.516 1.545 1.545 weight 1.000 ! spec=13Cnoesy, no=1610, id=1336, vol=1.067000e+03
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name   HA) 3.516 1.545 1.545 weight 1.000 ! spec=13Cnoesy, no=1610, id=1336, vol=1.067000e+03
assign (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name   HA) 2.922 1.068 1.068 weight 1.000 ! spec=13Cnoesy, no=1612, id=1338, vol=1.909000e+03
assign (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name   HA) 2.922 1.068 1.068 weight 1.000 ! spec=13Cnoesy, no=1612, id=1338, vol=1.909000e+03
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name HD12) 4.065 2.066 2.066 weight 1.000 ! spec=13Cnoesy, no=1613, id=1339, vol=7.256000e+02
    or (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name HD11)
    or (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name HD13)
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HD12) 4.065 2.066 2.066 weight 1.000 ! spec=13Cnoesy, no=1613, id=1339, vol=7.256000e+02
    or (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HD11)
    or (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HD13)
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name HG12) 3.431 1.471 1.471 weight 1.000 ! spec=13Cnoesy, no=1614, id=1340, vol=6.814000e+02
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HG12) 3.431 1.471 1.471 weight 1.000 ! spec=13Cnoesy, no=1614, id=1340, vol=6.814000e+02
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name HG22) 2.650 0.878 0.878 weight 1.000 ! spec=13Cnoesy, no=1615, id=1341, vol=2.452000e+03
    or (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HG22) 2.650 0.878 0.878 weight 1.000 ! spec=13Cnoesy, no=1615, id=1341, vol=2.452000e+03
    or (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name  HB2) 1.971 0.485 0.485 weight 1.000 ! spec=13Cnoesy, no=1625, id=1349, vol=4.858000e+03
assign (segid "   B" and resid   53 and name  HB1) (segid "   B" and resid   53 and name  HB2) 1.971 0.485 0.485 weight 1.000 ! spec=13Cnoesy, no=1625, id=1349, vol=4.858000e+03
assign (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name  HB1) 3.340 1.394 1.394 weight 1.000 ! spec=13Cnoesy, no=1627, id=1351, vol=1.688000e+03
assign (segid "   B" and resid  100 and name   HA) (segid "   B" and resid  100 and name  HB1) 3.340 1.394 1.394 weight 1.000 ! spec=13Cnoesy, no=1627, id=1351, vol=1.688000e+03
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name HG22) 4.089 2.090 2.090 weight 1.000 ! spec=13Cnoesy, no=1646, id=1368, vol=2.117000e+03
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name HG23)
assign (segid "   B" and resid   17 and name   HA) (segid "   B" and resid   18 and name HG22) 4.089 2.090 2.090 weight 1.000 ! spec=13Cnoesy, no=1646, id=1368, vol=2.117000e+03
    or (segid "   B" and resid   17 and name   HA) (segid "   B" and resid   18 and name HG21)
    or (segid "   B" and resid   17 and name   HA) (segid "   B" and resid   18 and name HG23)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HD1) 4.626 2.675 2.675 weight 1.000 ! spec=13Cnoesy, no=1651, id=1372, vol=1.016000e+03
assign (segid "   B" and resid   25 and name   HA) (segid "   B" and resid   25 and name  HD1) 4.626 2.675 2.675 weight 1.000 ! spec=13Cnoesy, no=1651, id=1372, vol=1.016000e+03
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HB1) 2.764 0.955 0.955 weight 1.000 ! spec=13Cnoesy, no=1652, id=1373, vol=1.824000e+03
assign (segid "   B" and resid   25 and name   HA) (segid "   B" and resid   25 and name  HB1) 2.764 0.955 0.955 weight 1.000 ! spec=13Cnoesy, no=1652, id=1373, vol=1.824000e+03
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HB2) 3.179 1.263 1.263 weight 1.000 ! spec=13Cnoesy, no=1653, id=1374, vol=1.776000e+03
assign (segid "   B" and resid   25 and name   HA) (segid "   B" and resid   25 and name  HB2) 3.179 1.263 1.263 weight 1.000 ! spec=13Cnoesy, no=1653, id=1374, vol=1.776000e+03
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   50 and name   HA) 3.909 1.910 1.910 weight 1.000 ! spec=13Cnoesy, no=1658, id=1379, vol=2.353000e+03
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   50 and name   HA) 3.909 1.910 1.910 weight 1.000 ! spec=13Cnoesy, no=1658, id=1379, vol=2.353000e+03
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HD1) 6.055 4.583 4.583 weight 1.000 ! spec=13Cnoesy, no=1660, id=1380, vol=4.464000e+02
assign (segid "   B" and resid   50 and name   HA) (segid "   B" and resid   50 and name  HD1) 6.055 4.583 4.583 weight 1.000 ! spec=13Cnoesy, no=1660, id=1380, vol=4.464000e+02
assign (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   32 and name   HA) 3.084 1.189 1.189 weight 1.000 ! spec=13Cnoesy, no=1663, id=1381, vol=2.712000e+03
assign (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name   HA) 3.084 1.189 1.189 weight 1.000 ! spec=13Cnoesy, no=1663, id=1381, vol=2.712000e+03
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   31 and name HG22) 4.034 2.034 2.034 weight 1.000 ! spec=13Cnoesy, no=1668, id=1386, vol=8.190000e+02
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   31 and name HG22) 4.034 2.034 2.034 weight 1.000 ! spec=13Cnoesy, no=1668, id=1386, vol=8.190000e+02
    or (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name  HB2) 2.854 1.018 1.018 weight 1.000 ! spec=13Cnoesy, no=1670, id=1388, vol=4.920000e+03
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   32 and name  HB2) 2.854 1.018 1.018 weight 1.000 ! spec=13Cnoesy, no=1670, id=1388, vol=4.920000e+03
assign (segid "   A" and resid  118 and name  HB1) (segid "   A" and resid  118 and name  HB2) 1.275 1.275 4.725 weight 1.000 ! spec=13Cnoesy, no=1671, id=1389, vol=5.890000e+04
assign (segid "   B" and resid  118 and name  HB1) (segid "   B" and resid  118 and name  HB2) 1.275 1.275 4.725 weight 1.000 ! spec=13Cnoesy, no=1671, id=1389, vol=5.890000e+04
assign (segid "   A" and resid  118 and name  HB2) (segid "   A" and resid  118 and name  HD2) 4.501 2.532 2.532 weight 1.000 ! spec=13Cnoesy, no=1675, id=1393, vol=6.703000e+02
assign (segid "   B" and resid  118 and name  HB2) (segid "   B" and resid  118 and name  HD2) 4.501 2.532 2.532 weight 1.000 ! spec=13Cnoesy, no=1675, id=1393, vol=6.703000e+02
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   59 and name   HA) 4.849 2.939 2.939 weight 1.000 ! spec=13Cnoesy, no=1676, id=1394, vol=1.135000e+03
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   59 and name   HA) 4.849 2.939 2.939 weight 1.000 ! spec=13Cnoesy, no=1676, id=1394, vol=1.135000e+03
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name   HA) 2.779 0.965 0.965 weight 1.000 ! spec=13Cnoesy, no=1677, id=1395, vol=2.412000e+03
assign (segid "   B" and resid   59 and name  HB2) (segid "   B" and resid   59 and name   HA) 2.779 0.965 0.965 weight 1.000 ! spec=13Cnoesy, no=1677, id=1395, vol=2.412000e+03
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   18 and name HG12) 3.542 1.569 1.569 weight 1.000 ! spec=13Cnoesy, no=1678, id=1396, vol=2.088000e+03
    or (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   18 and name HG13)
assign (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   18 and name HG12) 3.542 1.569 1.569 weight 1.000 ! spec=13Cnoesy, no=1678, id=1396, vol=2.088000e+03
    or (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   18 and name HG11)
    or (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   18 and name HG13)
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   59 and name  HD2) 6.076 4.614 4.614 weight 1.000 ! spec=13Cnoesy, no=1679, id=1397, vol=3.872000e+02
assign (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   59 and name  HD2) 6.076 4.614 4.614 weight 1.000 ! spec=13Cnoesy, no=1679, id=1397, vol=3.872000e+02
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   59 and name  HG2) 2.869 1.029 1.029 weight 1.000 ! spec=13Cnoesy, no=1681, id=1399, vol=2.412000e+03
assign (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   59 and name  HG2) 2.869 1.029 1.029 weight 1.000 ! spec=13Cnoesy, no=1681, id=1399, vol=2.412000e+03
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   59 and name  HG1) 3.053 1.165 1.165 weight 1.000 ! spec=13Cnoesy, no=1682, id=1400, vol=3.818000e+03
assign (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   59 and name  HG1) 3.053 1.165 1.165 weight 1.000 ! spec=13Cnoesy, no=1682, id=1400, vol=3.818000e+03
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   59 and name  HB1) 2.550 0.813 0.813 weight 1.000 ! spec=13Cnoesy, no=1685, id=1403, vol=4.727000e+03
assign (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   59 and name  HB1) 2.550 0.813 0.813 weight 1.000 ! spec=13Cnoesy, no=1685, id=1403, vol=4.727000e+03
assign (segid "   A" and resid   33 and name  HA2) (segid "   A" and resid   29 and name HG21) 2.173 0.590 0.590 weight 1.000 ! spec=13Cnoesy, no=1686, id=1404, vol=4.596000e+03
    or (segid "   A" and resid   33 and name  HA2) (segid "   A" and resid   29 and name HG22)
    or (segid "   A" and resid   33 and name  HA2) (segid "   A" and resid   29 and name HG23)
assign (segid "   B" and resid   33 and name  HA2) (segid "   B" and resid   29 and name HG21) 2.173 0.590 0.590 weight 1.000 ! spec=13Cnoesy, no=1686, id=1404, vol=4.596000e+03
    or (segid "   B" and resid   33 and name  HA2) (segid "   B" and resid   29 and name HG22)
    or (segid "   B" and resid   33 and name  HA2) (segid "   B" and resid   29 and name HG23)
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HA) 2.429 0.738 0.738 weight 1.000 ! spec=13Cnoesy, no=1692, id=1409, vol=3.756000e+03
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HA)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   29 and name   HA) 2.429 0.738 0.738 weight 1.000 ! spec=13Cnoesy, no=1692, id=1409, vol=3.756000e+03
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   29 and name   HA)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   29 and name   HA)
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HB) 1.984 0.492 0.492 weight 1.000 ! spec=13Cnoesy, no=1693, id=1410, vol=5.086000e+03
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HB)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   29 and name   HB) 1.984 0.492 0.492 weight 1.000 ! spec=13Cnoesy, no=1693, id=1410, vol=5.086000e+03
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   29 and name   HB)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   29 and name   HB)
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   79 and name  HB2) 2.537 0.805 0.805 weight 1.000 ! spec=13Cnoesy, no=1702, id=1414, vol=1.638000e+03
assign (segid "   B" and resid   79 and name  HB1) (segid "   B" and resid   79 and name  HB2) 2.537 0.805 0.805 weight 1.000 ! spec=13Cnoesy, no=1702, id=1414, vol=1.638000e+03
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   79 and name   HA) 3.641 1.657 1.657 weight 1.000 ! spec=13Cnoesy, no=1706, id=1418, vol=7.296000e+02
assign (segid "   B" and resid   79 and name  HB2) (segid "   B" and resid   79 and name   HA) 3.641 1.657 1.657 weight 1.000 ! spec=13Cnoesy, no=1706, id=1418, vol=7.296000e+02
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    6 and name   HA) 4.659 2.713 2.713 weight 1.000 ! spec=13Cnoesy, no=1707, id=1419, vol=4.926000e+02
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    6 and name   HA) 4.659 2.713 2.713 weight 1.000 ! spec=13Cnoesy, no=1707, id=1419, vol=4.926000e+02
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    5 and name  HG2) 5.667 4.014 4.014 weight 1.000 ! spec=13Cnoesy, no=1708, id=1420, vol=5.416000e+02
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    5 and name  HG2) 5.667 4.014 4.014 weight 1.000 ! spec=13Cnoesy, no=1708, id=1420, vol=5.416000e+02
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name   HA) 3.395 1.441 1.441 weight 1.000 ! spec=13Cnoesy, no=1711, id=1423, vol=1.642000e+03
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    7 and name   HA) 3.395 1.441 1.441 weight 1.000 ! spec=13Cnoesy, no=1711, id=1423, vol=1.642000e+03
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    6 and name   HB) 4.567 2.607 2.607 weight 1.000 ! spec=13Cnoesy, no=1712, id=1424, vol=5.416000e+02
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    6 and name   HB) 4.567 2.607 2.607 weight 1.000 ! spec=13Cnoesy, no=1712, id=1424, vol=5.416000e+02
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name  HE1) 4.554 2.593 2.593 weight 1.000 ! spec=13Cnoesy, no=1713, id=1425, vol=1.165000e+03
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    7 and name  HE1) 4.554 2.593 2.593 weight 1.000 ! spec=13Cnoesy, no=1713, id=1425, vol=1.165000e+03
assign (segid "   A" and resid   10 and name  HA2) (segid "   A" and resid   11 and name  HG1) 6.011 4.516 4.516 weight 1.000 ! spec=13Cnoesy, no=1717, id=1427, vol=5.232000e+02
assign (segid "   B" and resid   10 and name  HA2) (segid "   B" and resid   11 and name  HG1) 6.011 4.516 4.516 weight 1.000 ! spec=13Cnoesy, no=1717, id=1427, vol=5.232000e+02
assign (segid "   A" and resid   11 and name  HG1) (segid "   A" and resid   11 and name   HA) 4.292 2.303 2.303 weight 1.000 ! spec=13Cnoesy, no=1718, id=1428, vol=6.582000e+02
assign (segid "   B" and resid   11 and name  HG1) (segid "   B" and resid   11 and name   HA) 4.292 2.303 2.303 weight 1.000 ! spec=13Cnoesy, no=1718, id=1428, vol=6.582000e+02
assign (segid "   A" and resid   11 and name  HG1) (segid "   A" and resid   11 and name  HB2) 2.593 0.840 0.840 weight 1.000 ! spec=13Cnoesy, no=1719, id=1429, vol=7.249000e+03
assign (segid "   B" and resid   11 and name  HG1) (segid "   B" and resid   11 and name  HB2) 2.593 0.840 0.840 weight 1.000 ! spec=13Cnoesy, no=1719, id=1429, vol=7.249000e+03
assign (segid "   A" and resid   11 and name  HG1) (segid "   A" and resid   11 and name  HG2) 1.773 0.393 0.393 weight 1.000 ! spec=13Cnoesy, no=1720, id=1430, vol=1.366000e+04
assign (segid "   B" and resid   11 and name  HG1) (segid "   B" and resid   11 and name  HG2) 1.773 0.393 0.393 weight 1.000 ! spec=13Cnoesy, no=1720, id=1430, vol=1.366000e+04
assign (segid "   A" and resid  118 and name  HB2) (segid "   A" and resid  118 and name  HG2) 1.918 0.460 0.460 weight 1.000 ! spec=13Cnoesy, no=1723, id=1433, vol=2.160000e+04
assign (segid "   B" and resid  118 and name  HB2) (segid "   B" and resid  118 and name  HG2) 1.918 0.460 0.460 weight 1.000 ! spec=13Cnoesy, no=1723, id=1433, vol=2.160000e+04
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name   HA) 3.543 1.569 1.569 weight 1.000 ! spec=13Cnoesy, no=1737, id=1441, vol=1.664000e+03
assign (segid "   B" and resid   96 and name  HB2) (segid "   B" and resid   96 and name   HA) 3.543 1.569 1.569 weight 1.000 ! spec=13Cnoesy, no=1737, id=1441, vol=1.664000e+03
assign (segid "   A" and resid  114 and name  HB2) (segid "   A" and resid  114 and name  HG2) 2.699 0.910 0.910 weight 1.000 ! spec=13Cnoesy, no=1740, id=1444, vol=2.372000e+03
assign (segid "   B" and resid  114 and name  HB2) (segid "   B" and resid  114 and name  HG2) 2.699 0.910 0.910 weight 1.000 ! spec=13Cnoesy, no=1740, id=1444, vol=2.372000e+03
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name   HA) 2.849 1.015 1.015 weight 1.000 ! spec=13Cnoesy, no=1743, id=1447, vol=3.086000e+03
assign (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   35 and name   HA) 2.849 1.015 1.015 weight 1.000 ! spec=13Cnoesy, no=1743, id=1447, vol=3.086000e+03
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   35 and name  HG2) 5.772 4.164 4.164 weight 1.000 ! spec=13Cnoesy, no=1744, id=1448, vol=6.743000e+02
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   35 and name  HG2) 5.772 4.164 4.164 weight 1.000 ! spec=13Cnoesy, no=1744, id=1448, vol=6.743000e+02
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   35 and name  HG2) 3.052 1.165 1.165 weight 1.000 ! spec=13Cnoesy, no=1746, id=1450, vol=1.390000e+03
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   35 and name  HG2) 3.052 1.165 1.165 weight 1.000 ! spec=13Cnoesy, no=1746, id=1450, vol=1.390000e+03
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name  HG1) 1.555 0.302 0.302 weight 1.000 ! spec=13Cnoesy, no=1747, id=1451, vol=3.213000e+04
assign (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   35 and name  HG1) 1.555 0.302 0.302 weight 1.000 ! spec=13Cnoesy, no=1747, id=1451, vol=3.213000e+04
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   27 and name HG21) 2.925 1.070 1.070 weight 1.000 ! spec=13Cnoesy, no=1749, id=1453, vol=3.086000e+03
    or (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   27 and name HG22)
    or (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   27 and name HG23)
assign (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   27 and name HG21) 2.925 1.070 1.070 weight 1.000 ! spec=13Cnoesy, no=1749, id=1453, vol=3.086000e+03
    or (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   27 and name HG22)
    or (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   27 and name HG23)
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   28 and name   HN) 4.661 2.715 2.715 weight 1.000 ! spec=13Cnoesy, no=1750, id=1454, vol=3.434000e+02
assign (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   28 and name   HN) 4.661 2.715 2.715 weight 1.000 ! spec=13Cnoesy, no=1750, id=1454, vol=3.434000e+02
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name  HB2) 2.589 0.838 0.838 weight 1.000 ! spec=13Cnoesy, no=1751, id=1455, vol=1.559000e+04
assign (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   35 and name  HB2) 2.589 0.838 0.838 weight 1.000 ! spec=13Cnoesy, no=1751, id=1455, vol=1.559000e+04
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   43 and name  HB1) 3.040 1.155 1.155 weight 1.000 ! spec=13Cnoesy, no=1752, id=1456, vol=1.801000e+03
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   43 and name  HB1) 3.040 1.155 1.155 weight 1.000 ! spec=13Cnoesy, no=1752, id=1456, vol=1.801000e+03
assign (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   48 and name HG22) 3.430 1.471 1.471 weight 1.000 ! spec=13Cnoesy, no=1754, id=1458, vol=1.571000e+03
    or (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   48 and name HG21)
    or (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   48 and name HG23)
assign (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   48 and name HG22) 3.430 1.471 1.471 weight 1.000 ! spec=13Cnoesy, no=1754, id=1458, vol=1.571000e+03
    or (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   48 and name HG21)
    or (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   48 and name HG23)
assign (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   43 and name  HB2) 1.934 0.467 0.467 weight 1.000 ! spec=13Cnoesy, no=1757, id=1461, vol=8.397000e+03
assign (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   43 and name  HB2) 1.934 0.467 0.467 weight 1.000 ! spec=13Cnoesy, no=1757, id=1461, vol=8.397000e+03
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   43 and name  HB2) 3.266 1.333 1.333 weight 1.000 ! spec=13Cnoesy, no=1759, id=1463, vol=1.904000e+03
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   43 and name  HB2) 3.266 1.333 1.333 weight 1.000 ! spec=13Cnoesy, no=1759, id=1463, vol=1.904000e+03
assign (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   39 and name HD12) 3.479 1.513 1.513 weight 1.000 ! spec=13Cnoesy, no=1764, id=1468, vol=2.060000e+03
    or (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   43 and name  HB2) (segid "   B" and resid   39 and name HD12) 3.479 1.513 1.513 weight 1.000 ! spec=13Cnoesy, no=1764, id=1468, vol=2.060000e+03
    or (segid "   B" and resid   43 and name  HB2) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   43 and name  HB2) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  104 and name   HB) 2.582 0.834 0.834 weight 1.000 ! spec=13Cnoesy, no=1771, id=1474, vol=1.660000e+03
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  104 and name   HB)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  104 and name   HB)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  104 and name   HB) 2.582 0.834 0.834 weight 1.000 ! spec=13Cnoesy, no=1771, id=1474, vol=1.660000e+03
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  104 and name   HB)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  104 and name   HB)
assign (segid "   A" and resid  104 and name HG12) (segid "   A" and resid  104 and name   HB) 2.668 0.890 0.890 weight 1.000 ! spec=13Cnoesy, no=1772, id=1475, vol=2.945000e+03
assign (segid "   B" and resid  104 and name HG12) (segid "   B" and resid  104 and name   HB) 2.668 0.890 0.890 weight 1.000 ! spec=13Cnoesy, no=1772, id=1475, vol=2.945000e+03
assign (segid "   A" and resid  104 and name   HB) (segid "   A" and resid  104 and name HG11) 2.476 0.766 0.766 weight 1.000 ! spec=13Cnoesy, no=1774, id=1477, vol=1.909000e+03
assign (segid "   B" and resid  104 and name   HB) (segid "   B" and resid  104 and name HG11) 2.476 0.766 0.766 weight 1.000 ! spec=13Cnoesy, no=1774, id=1477, vol=1.909000e+03
assign (segid "   A" and resid  104 and name   HB) (segid "   A" and resid  104 and name   HA) 3.082 1.187 1.187 weight 1.000 ! spec=13Cnoesy, no=1776, id=1479, vol=1.248000e+03
assign (segid "   B" and resid  104 and name   HB) (segid "   B" and resid  104 and name   HA) 3.082 1.187 1.187 weight 1.000 ! spec=13Cnoesy, no=1776, id=1479, vol=1.248000e+03
assign (segid "   A" and resid   48 and name   HB) (segid "   A" and resid   48 and name HG22) 1.736 0.377 0.377 weight 1.000 ! spec=13Cnoesy, no=1777, id=1480, vol=1.134000e+04
    or (segid "   A" and resid   48 and name   HB) (segid "   A" and resid   48 and name HG21)
    or (segid "   A" and resid   48 and name   HB) (segid "   A" and resid   48 and name HG23)
assign (segid "   B" and resid   48 and name   HB) (segid "   B" and resid   48 and name HG22) 1.736 0.377 0.377 weight 1.000 ! spec=13Cnoesy, no=1777, id=1480, vol=1.134000e+04
    or (segid "   B" and resid   48 and name   HB) (segid "   B" and resid   48 and name HG21)
    or (segid "   B" and resid   48 and name   HB) (segid "   B" and resid   48 and name HG23)
assign (segid "   A" and resid   48 and name   HB) (segid "   A" and resid   48 and name   HA) 2.885 1.040 1.040 weight 1.000 ! spec=13Cnoesy, no=1778, id=1481, vol=1.892000e+03
assign (segid "   B" and resid   48 and name   HB) (segid "   B" and resid   48 and name   HA) 2.885 1.040 1.040 weight 1.000 ! spec=13Cnoesy, no=1778, id=1481, vol=1.892000e+03
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name   HA) 2.968 1.101 1.101 weight 1.000 ! spec=13Cnoesy, no=1781, id=1484, vol=1.248000e+03
assign (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name   HA) 2.968 1.101 1.101 weight 1.000 ! spec=13Cnoesy, no=1781, id=1484, vol=1.248000e+03
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HB2) 3.591 1.612 1.612 weight 1.000 ! spec=13Cnoesy, no=1782, id=1485, vol=1.131000e+03
assign (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name  HB2) 3.591 1.612 1.612 weight 1.000 ! spec=13Cnoesy, no=1782, id=1485, vol=1.131000e+03
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name   HG) 2.801 0.980 0.980 weight 1.000 ! spec=13Cnoesy, no=1783, id=1486, vol=3.182000e+03
assign (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name   HG) 2.801 0.980 0.980 weight 1.000 ! spec=13Cnoesy, no=1783, id=1486, vol=3.182000e+03
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name HD12) 3.429 1.470 1.470 weight 1.000 ! spec=13Cnoesy, no=1785, id=1488, vol=2.772000e+03
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name HD12) 3.429 1.470 1.470 weight 1.000 ! spec=13Cnoesy, no=1785, id=1488, vol=2.772000e+03
    or (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name  HG2) 2.791 0.974 0.974 weight 1.000 ! spec=13Cnoesy, no=1797, id=1500, vol=3.829000e+03
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   34 and name  HG2) 2.791 0.974 0.974 weight 1.000 ! spec=13Cnoesy, no=1797, id=1500, vol=3.829000e+03
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid  109 and name HG22) 3.870 1.872 1.872 weight 1.000 ! spec=13Cnoesy, no=1802, id=1505, vol=1.096000e+03
    or (segid "   A" and resid   80 and name   HA) (segid "   A" and resid  109 and name HG21)
    or (segid "   A" and resid   80 and name   HA) (segid "   A" and resid  109 and name HG23)
assign (segid "   B" and resid   80 and name   HA) (segid "   B" and resid  109 and name HG22) 3.870 1.872 1.872 weight 1.000 ! spec=13Cnoesy, no=1802, id=1505, vol=1.096000e+03
    or (segid "   B" and resid   80 and name   HA) (segid "   B" and resid  109 and name HG21)
    or (segid "   B" and resid   80 and name   HA) (segid "   B" and resid  109 and name HG23)
assign (segid "   A" and resid   81 and name   HB) (segid "   A" and resid  109 and name HG22) 2.345 2.345 3.655 weight 1.000 ! spec=13Cnoesy, no=1805, id=1508, vol=3.058000e+03
    or (segid "   A" and resid   81 and name   HB) (segid "   A" and resid  109 and name HG21)
    or (segid "   A" and resid   81 and name   HB) (segid "   A" and resid  109 and name HG23)
assign (segid "   B" and resid   81 and name   HB) (segid "   B" and resid  109 and name HG22) 2.345 2.345 3.655 weight 1.000 ! spec=13Cnoesy, no=1805, id=1508, vol=3.058000e+03
    or (segid "   B" and resid   81 and name   HB) (segid "   B" and resid  109 and name HG21)
    or (segid "   B" and resid   81 and name   HB) (segid "   B" and resid  109 and name HG23)
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   61 and name  HB2) 4.864 2.958 2.958 weight 1.000 ! spec=13Cnoesy, no=1809, id=1512, vol=5.559000e+02
assign (segid "   B" and resid   79 and name  HB2) (segid "   B" and resid   61 and name  HB2) 4.864 2.958 2.958 weight 1.000 ! spec=13Cnoesy, no=1809, id=1512, vol=5.559000e+02
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    9 and name   HN) 5.396 3.640 3.640 weight 1.000 ! spec=13Cnoesy, no=1811, id=1513, vol=3.821000e+02
assign (segid "   B" and resid    8 and name  HB1) (segid "   B" and resid    9 and name   HN) 5.396 3.640 3.640 weight 1.000 ! spec=13Cnoesy, no=1811, id=1513, vol=3.821000e+02
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name  HB1) 2.931 1.074 1.074 weight 1.000 ! spec=13Cnoesy, no=1813, id=1515, vol=2.688000e+03
assign (segid "   B" and resid    8 and name   HA) (segid "   B" and resid    8 and name  HB1) 2.931 1.074 1.074 weight 1.000 ! spec=13Cnoesy, no=1813, id=1515, vol=2.688000e+03
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid   11 and name  HB2) 5.616 3.943 3.943 weight 1.000 ! spec=13Cnoesy, no=1817, id=1518, vol=3.535000e+02
assign (segid "   B" and resid    8 and name  HB1) (segid "   B" and resid   11 and name  HB2) 5.616 3.943 3.943 weight 1.000 ! spec=13Cnoesy, no=1817, id=1518, vol=3.535000e+02
assign (segid "   A" and resid  100 and name  HD1) (segid "   A" and resid  100 and name   HA) 4.330 2.344 2.344 weight 1.000 ! spec=13Cnoesy, no=1818, id=1519, vol=6.984000e+02
assign (segid "   B" and resid  100 and name  HD1) (segid "   B" and resid  100 and name   HA) 4.330 2.344 2.344 weight 1.000 ! spec=13Cnoesy, no=1818, id=1519, vol=6.984000e+02
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name   HA) 2.773 0.961 0.961 weight 1.000 ! spec=13Cnoesy, no=1826, id=1527, vol=2.628000e+03
assign (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   64 and name   HA) 2.773 0.961 0.961 weight 1.000 ! spec=13Cnoesy, no=1826, id=1527, vol=2.628000e+03
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HG1) 3.546 1.572 1.572 weight 1.000 ! spec=13Cnoesy, no=1836, id=1535, vol=2.495000e+03
assign (segid "   B" and resid   35 and name   HA) (segid "   B" and resid   35 and name  HG1) 3.546 1.572 1.572 weight 1.000 ! spec=13Cnoesy, no=1836, id=1535, vol=2.495000e+03
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   35 and name  HG1) 5.824 4.239 4.239 weight 1.000 ! spec=13Cnoesy, no=1837, id=1536, vol=6.814000e+02
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   35 and name  HG1) 5.824 4.239 4.239 weight 1.000 ! spec=13Cnoesy, no=1837, id=1536, vol=6.814000e+02
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   27 and name HG21) 2.894 1.047 1.047 weight 1.000 ! spec=13Cnoesy, no=1841, id=1540, vol=2.756000e+03
    or (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   27 and name HG22)
    or (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   27 and name HG23)
assign (segid "   B" and resid   35 and name  HG1) (segid "   B" and resid   27 and name HG21) 2.894 1.047 1.047 weight 1.000 ! spec=13Cnoesy, no=1841, id=1540, vol=2.756000e+03
    or (segid "   B" and resid   35 and name  HG1) (segid "   B" and resid   27 and name HG22)
    or (segid "   B" and resid   35 and name  HG1) (segid "   B" and resid   27 and name HG23)
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name  HB2) 2.144 0.575 0.575 weight 1.000 ! spec=13Cnoesy, no=1842, id=1541, vol=1.493000e+04
assign (segid "   B" and resid   35 and name  HG1) (segid "   B" and resid   35 and name  HB2) 2.144 0.575 0.575 weight 1.000 ! spec=13Cnoesy, no=1842, id=1541, vol=1.493000e+04
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HG1) 3.266 1.334 1.334 weight 1.000 ! spec=13Cnoesy, no=1843, id=1542, vol=1.821000e+03
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   34 and name  HG1) 3.266 1.334 1.334 weight 1.000 ! spec=13Cnoesy, no=1843, id=1542, vol=1.821000e+03
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HB2) 2.234 0.624 0.624 weight 1.000 ! spec=13Cnoesy, no=1848, id=1546, vol=6.098000e+03
assign (segid "   B" and resid   34 and name  HG1) (segid "   B" and resid   34 and name  HB2) 2.234 0.624 0.624 weight 1.000 ! spec=13Cnoesy, no=1848, id=1546, vol=6.098000e+03
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid   55 and name  HG2) 3.772 1.779 1.779 weight 1.000 ! spec=13Cnoesy, no=1851, id=1549, vol=5.793000e+02
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid   55 and name  HG2)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid   55 and name  HG2)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid   55 and name  HG2) 3.772 1.779 1.779 weight 1.000 ! spec=13Cnoesy, no=1851, id=1549, vol=5.793000e+02
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid   55 and name  HG2)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid   55 and name  HG2)
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   55 and name  HG2) 4.380 2.398 2.398 weight 1.000 ! spec=13Cnoesy, no=1855, id=1552, vol=1.302000e+03
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   55 and name  HG2)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   55 and name  HG2)
assign (segid "   B" and resid   20 and name HG12) (segid "   B" and resid   55 and name  HG2) 4.380 2.398 2.398 weight 1.000 ! spec=13Cnoesy, no=1855, id=1552, vol=1.302000e+03
    or (segid "   B" and resid   20 and name HG11) (segid "   B" and resid   55 and name  HG2)
    or (segid "   B" and resid   20 and name HG13) (segid "   B" and resid   55 and name  HG2)
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name  HG2) 3.704 1.715 1.715 weight 1.000 ! spec=13Cnoesy, no=1856, id=1553, vol=7.507000e+02
assign (segid "   B" and resid   55 and name   HA) (segid "   B" and resid   55 and name  HG2) 3.704 1.715 1.715 weight 1.000 ! spec=13Cnoesy, no=1856, id=1553, vol=7.507000e+02
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   55 and name  HB2) 3.212 1.290 1.290 weight 1.000 ! spec=13Cnoesy, no=1858, id=1555, vol=1.121000e+03
assign (segid "   B" and resid   55 and name  HG2) (segid "   B" and resid   55 and name  HB2) 3.212 1.290 1.290 weight 1.000 ! spec=13Cnoesy, no=1858, id=1555, vol=1.121000e+03
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid  104 and name   HA) 4.563 2.603 2.603 weight 1.000 ! spec=13Cnoesy, no=1860, id=1557, vol=6.006000e+02
assign (segid "   B" and resid   55 and name  HG2) (segid "   B" and resid  104 and name   HA) 4.563 2.603 2.603 weight 1.000 ! spec=13Cnoesy, no=1860, id=1557, vol=6.006000e+02
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  104 and name HG22) 1.835 0.421 0.421 weight 1.000 ! spec=13Cnoesy, no=1866, id=1563, vol=8.340000e+03
    or (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  104 and name HG21)
    or (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  104 and name HG23)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  104 and name HG22)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  104 and name HG21)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  104 and name HG23)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  104 and name HG22)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  104 and name HG21)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  104 and name HG23)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  104 and name HG22) 1.835 0.421 0.421 weight 1.000 ! spec=13Cnoesy, no=1866, id=1563, vol=8.340000e+03
    or (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  104 and name HG21)
    or (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  104 and name HG23)
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  104 and name HG22)
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  104 and name HG21)
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  104 and name HG23)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  104 and name HG22)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  104 and name HG21)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  104 and name HG23)
assign (segid "   A" and resid  104 and name HG12) (segid "   A" and resid  104 and name HG22) 1.825 0.416 0.416 weight 1.000 ! spec=13Cnoesy, no=1867, id=1564, vol=7.352000e+03
    or (segid "   A" and resid  104 and name HG12) (segid "   A" and resid  104 and name HG21)
    or (segid "   A" and resid  104 and name HG12) (segid "   A" and resid  104 and name HG23)
assign (segid "   B" and resid  104 and name HG12) (segid "   B" and resid  104 and name HG22) 1.825 0.416 0.416 weight 1.000 ! spec=13Cnoesy, no=1867, id=1564, vol=7.352000e+03
    or (segid "   B" and resid  104 and name HG12) (segid "   B" and resid  104 and name HG21)
    or (segid "   B" and resid  104 and name HG12) (segid "   B" and resid  104 and name HG23)
assign (segid "   A" and resid  104 and name HG22) (segid "   A" and resid  104 and name HG11) 2.503 0.783 0.783 weight 1.000 ! spec=13Cnoesy, no=1870, id=1567, vol=5.673000e+03
    or (segid "   A" and resid  104 and name HG21) (segid "   A" and resid  104 and name HG11)
    or (segid "   A" and resid  104 and name HG23) (segid "   A" and resid  104 and name HG11)
assign (segid "   B" and resid  104 and name HG22) (segid "   B" and resid  104 and name HG11) 2.503 0.783 0.783 weight 1.000 ! spec=13Cnoesy, no=1870, id=1567, vol=5.673000e+03
    or (segid "   B" and resid  104 and name HG21) (segid "   B" and resid  104 and name HG11)
    or (segid "   B" and resid  104 and name HG23) (segid "   B" and resid  104 and name HG11)
assign (segid "   A" and resid  104 and name HG22) (segid "   A" and resid  104 and name   HA) 2.607 0.849 0.849 weight 1.000 ! spec=13Cnoesy, no=1872, id=1569, vol=3.066000e+03
    or (segid "   A" and resid  104 and name HG21) (segid "   A" and resid  104 and name   HA)
    or (segid "   A" and resid  104 and name HG23) (segid "   A" and resid  104 and name   HA)
assign (segid "   B" and resid  104 and name HG22) (segid "   B" and resid  104 and name   HA) 2.607 0.849 0.849 weight 1.000 ! spec=13Cnoesy, no=1872, id=1569, vol=3.066000e+03
    or (segid "   B" and resid  104 and name HG21) (segid "   B" and resid  104 and name   HA)
    or (segid "   B" and resid  104 and name HG23) (segid "   B" and resid  104 and name   HA)
assign (segid "   A" and resid  114 and name  HG2) (segid "   A" and resid   76 and name  HZ2) 6.150 4.728 4.728 weight 1.000 ! spec=13Cnoesy, no=1874, id=1571, vol=2.821000e+02
assign (segid "   B" and resid  114 and name  HG2) (segid "   B" and resid   76 and name  HZ2) 6.150 4.728 4.728 weight 1.000 ! spec=13Cnoesy, no=1874, id=1571, vol=2.821000e+02
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   71 and name HD12) 5.072 3.216 3.216 weight 1.000 ! spec=13Cnoesy, no=1881, id=1575, vol=6.077000e+02
    or (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   71 and name HD13)
assign (segid "   B" and resid   72 and name  HB2) (segid "   B" and resid   71 and name HD12) 5.072 3.216 3.216 weight 1.000 ! spec=13Cnoesy, no=1881, id=1575, vol=6.077000e+02
    or (segid "   B" and resid   72 and name  HB2) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid   72 and name  HB2) (segid "   B" and resid   71 and name HD13)
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   72 and name  HB2) 3.766 1.773 1.773 weight 1.000 ! spec=13Cnoesy, no=1883, id=1577, vol=1.503000e+03
assign (segid "   B" and resid   72 and name   HA) (segid "   B" and resid   72 and name  HB2) 3.766 1.773 1.773 weight 1.000 ! spec=13Cnoesy, no=1883, id=1577, vol=1.503000e+03
assign (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   65 and name  HG2) 5.853 4.283 4.283 weight 1.000 ! spec=13Cnoesy, no=1887, id=1579, vol=4.259000e+02
assign (segid "   B" and resid   62 and name  HB1) (segid "   B" and resid   65 and name  HG2) 5.853 4.283 4.283 weight 1.000 ! spec=13Cnoesy, no=1887, id=1579, vol=4.259000e+02
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name  HB2) 2.143 0.574 0.574 weight 1.000 ! spec=13Cnoesy, no=1891, id=1582, vol=2.077000e+03
assign (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name  HB2) 2.143 0.574 0.574 weight 1.000 ! spec=13Cnoesy, no=1891, id=1582, vol=2.077000e+03
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   26 and name   HN) 3.709 1.719 1.719 weight 1.000 ! spec=13Cnoesy, no=1898, id=1587, vol=1.314000e+03
assign (segid "   B" and resid   25 and name  HB2) (segid "   B" and resid   26 and name   HN) 3.709 1.719 1.719 weight 1.000 ! spec=13Cnoesy, no=1898, id=1587, vol=1.314000e+03
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name  HD2) 2.944 1.083 1.083 weight 1.000 ! spec=13Cnoesy, no=1899, id=1588, vol=2.151000e+03
assign (segid "   B" and resid   25 and name  HB2) (segid "   B" and resid   25 and name  HD2) 2.944 1.083 1.083 weight 1.000 ! spec=13Cnoesy, no=1899, id=1588, vol=2.151000e+03
assign (segid "   A" and resid  118 and name  HB1) (segid "   A" and resid  118 and name   HA) 3.128 1.223 1.223 weight 1.000 ! spec=13Cnoesy, no=1905, id=1592, vol=1.807000e+03
assign (segid "   B" and resid  118 and name  HB1) (segid "   B" and resid  118 and name   HA) 3.128 1.223 1.223 weight 1.000 ! spec=13Cnoesy, no=1905, id=1592, vol=1.807000e+03
assign (segid "   A" and resid  118 and name  HB2) (segid "   A" and resid  118 and name   HA) 3.349 1.402 1.402 weight 1.000 ! spec=13Cnoesy, no=1907, id=1594, vol=1.435000e+03
assign (segid "   B" and resid  118 and name  HB2) (segid "   B" and resid  118 and name   HA) 3.349 1.402 1.402 weight 1.000 ! spec=13Cnoesy, no=1907, id=1594, vol=1.435000e+03
assign (segid "   A" and resid  118 and name  HG2) (segid "   A" and resid  118 and name   HA) 4.566 2.605 2.605 weight 1.000 ! spec=13Cnoesy, no=1908, id=1595, vol=1.314000e+03
assign (segid "   B" and resid  118 and name  HG2) (segid "   B" and resid  118 and name   HA) 4.566 2.605 2.605 weight 1.000 ! spec=13Cnoesy, no=1908, id=1595, vol=1.314000e+03
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name  HB2) 2.061 0.531 0.531 weight 1.000 ! spec=13Cnoesy, no=1927, id=1607, vol=8.033000e+03
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name  HB3)
assign (segid "   B" and resid   40 and name   HA) (segid "   B" and resid   40 and name  HB2) 2.061 0.531 0.531 weight 1.000 ! spec=13Cnoesy, no=1927, id=1607, vol=8.033000e+03
    or (segid "   B" and resid   40 and name   HA) (segid "   B" and resid   40 and name  HB1)
    or (segid "   B" and resid   40 and name   HA) (segid "   B" and resid   40 and name  HB3)
assign (segid "   A" and resid   59 and name  HD2) (segid "   A" and resid   59 and name  HG2) 2.450 0.751 0.751 weight 1.000 ! spec=13Cnoesy, no=1941, id=1616, vol=3.579000e+03
assign (segid "   B" and resid   59 and name  HD2) (segid "   B" and resid   59 and name  HG2) 2.450 0.751 0.751 weight 1.000 ! spec=13Cnoesy, no=1941, id=1616, vol=3.579000e+03
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name  HB1) 2.686 0.902 0.902 weight 1.000 ! spec=13Cnoesy, no=1946, id=1620, vol=7.193000e+03
assign (segid "   B" and resid   59 and name  HG2) (segid "   B" and resid   59 and name  HB1) 2.686 0.902 0.902 weight 1.000 ! spec=13Cnoesy, no=1946, id=1620, vol=7.193000e+03
assign (segid "   A" and resid  110 and name  HB1) (segid "   A" and resid  110 and name   HA) 3.654 1.669 1.669 weight 1.000 ! spec=13Cnoesy, no=1949, id=1622, vol=1.169000e+03
assign (segid "   B" and resid  110 and name  HB1) (segid "   B" and resid  110 and name   HA) 3.654 1.669 1.669 weight 1.000 ! spec=13Cnoesy, no=1949, id=1622, vol=1.169000e+03
assign (segid "   A" and resid  110 and name   HA) (segid "   A" and resid  110 and name  HB2) 3.073 1.180 1.180 weight 1.000 ! spec=13Cnoesy, no=1951, id=1624, vol=1.320000e+03
assign (segid "   B" and resid  110 and name   HA) (segid "   B" and resid  110 and name  HB2) 3.073 1.180 1.180 weight 1.000 ! spec=13Cnoesy, no=1951, id=1624, vol=1.320000e+03
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name   HG) 2.626 0.862 0.862 weight 1.000 ! spec=13Cnoesy, no=1954, id=1625, vol=4.957000e+03
assign (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name   HG) 2.626 0.862 0.862 weight 1.000 ! spec=13Cnoesy, no=1954, id=1625, vol=4.957000e+03
assign (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   91 and name   HA) 3.135 1.229 1.229 weight 1.000 ! spec=13Cnoesy, no=1955, id=1626, vol=6.653000e+02
assign (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   91 and name   HA) 3.135 1.229 1.229 weight 1.000 ! spec=13Cnoesy, no=1955, id=1626, vol=6.653000e+02
assign (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   38 and name   HA) 3.836 1.840 1.840 weight 1.000 ! spec=13Cnoesy, no=1956, id=1627, vol=9.535000e+02
assign (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   38 and name   HA) 3.836 1.840 1.840 weight 1.000 ! spec=13Cnoesy, no=1956, id=1627, vol=9.535000e+02
assign (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   37 and name   HA) 4.243 2.250 2.250 weight 1.000 ! spec=13Cnoesy, no=1961, id=1631, vol=7.256000e+02
assign (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   37 and name   HA) 4.243 2.250 2.250 weight 1.000 ! spec=13Cnoesy, no=1961, id=1631, vol=7.256000e+02
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   52 and name  HB1) 4.094 2.095 2.095 weight 1.000 ! spec=13Cnoesy, no=1965, id=1635, vol=1.240000e+03
assign (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   52 and name  HB1) 4.094 2.095 2.095 weight 1.000 ! spec=13Cnoesy, no=1965, id=1635, vol=1.240000e+03
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   52 and name  HB1) 3.365 1.416 1.416 weight 1.000 ! spec=13Cnoesy, no=1966, id=1636, vol=6.482000e+02
assign (segid "   B" and resid   52 and name   HA) (segid "   B" and resid   52 and name  HB1) 3.365 1.416 1.416 weight 1.000 ! spec=13Cnoesy, no=1966, id=1636, vol=6.482000e+02
assign (segid "   A" and resid    5 and name  HG1) (segid "   A" and resid    5 and name  HD2) 3.588 1.609 1.609 weight 1.000 ! spec=13Cnoesy, no=1970, id=1637, vol=4.777000e+02
assign (segid "   B" and resid    5 and name  HG1) (segid "   B" and resid    5 and name  HD2) 3.588 1.609 1.609 weight 1.000 ! spec=13Cnoesy, no=1970, id=1637, vol=4.777000e+02
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    5 and name  HD2) 5.276 3.479 3.479 weight 1.000 ! spec=13Cnoesy, no=1971, id=1638, vol=1.050000e+03
assign (segid "   B" and resid    4 and name  HB1) (segid "   B" and resid    5 and name  HD2) 5.276 3.479 3.479 weight 1.000 ! spec=13Cnoesy, no=1971, id=1638, vol=1.050000e+03
assign (segid "   A" and resid    5 and name  HG2) (segid "   A" and resid    5 and name  HD2) 3.023 1.142 1.142 weight 1.000 ! spec=13Cnoesy, no=1974, id=1641, vol=5.351000e+03
assign (segid "   B" and resid    5 and name  HG2) (segid "   B" and resid    5 and name  HD2) 3.023 1.142 1.142 weight 1.000 ! spec=13Cnoesy, no=1974, id=1641, vol=5.351000e+03
assign (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    4 and name   HA) 2.502 0.783 0.783 weight 1.000 ! spec=13Cnoesy, no=1977, id=1644, vol=5.496000e+03
assign (segid "   B" and resid    5 and name  HD2) (segid "   B" and resid    4 and name   HA) 2.502 0.783 0.783 weight 1.000 ! spec=13Cnoesy, no=1977, id=1644, vol=5.496000e+03
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   63 and name  HG2) 4.617 2.664 2.664 weight 1.000 ! spec=13Cnoesy, no=1978, id=1645, vol=7.196000e+02
assign (segid "   B" and resid   62 and name   HA) (segid "   B" and resid   63 and name  HG2) 4.617 2.664 2.664 weight 1.000 ! spec=13Cnoesy, no=1978, id=1645, vol=7.196000e+02
assign (segid "   A" and resid   63 and name  HD1) (segid "   A" and resid   62 and name   HA) 2.604 0.848 0.848 weight 1.000 ! spec=13Cnoesy, no=1980, id=1647, vol=1.867000e+03
assign (segid "   B" and resid   63 and name  HD1) (segid "   B" and resid   62 and name   HA) 2.604 0.848 0.848 weight 1.000 ! spec=13Cnoesy, no=1980, id=1647, vol=1.867000e+03
assign (segid "   A" and resid   63 and name  HD2) (segid "   A" and resid   62 and name   HA) 3.815 1.820 1.820 weight 1.000 ! spec=13Cnoesy, no=1981, id=1648, vol=1.414000e+03
assign (segid "   B" and resid   63 and name  HD2) (segid "   B" and resid   62 and name   HA) 3.815 1.820 1.820 weight 1.000 ! spec=13Cnoesy, no=1981, id=1648, vol=1.414000e+03
assign (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name   HA) 3.477 1.511 1.511 weight 1.000 ! spec=13Cnoesy, no=1982, id=1649, vol=1.461000e+03
assign (segid "   B" and resid   62 and name  HB1) (segid "   B" and resid   62 and name   HA) 3.477 1.511 1.511 weight 1.000 ! spec=13Cnoesy, no=1982, id=1649, vol=1.461000e+03
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   64 and name   HN) 3.982 1.982 1.982 weight 1.000 ! spec=13Cnoesy, no=1983, id=1650, vol=4.239000e+02
assign (segid "   B" and resid   62 and name   HA) (segid "   B" and resid   64 and name   HN) 3.982 1.982 1.982 weight 1.000 ! spec=13Cnoesy, no=1983, id=1650, vol=4.239000e+02
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name  HB2) 3.113 1.211 1.211 weight 1.000 ! spec=13Cnoesy, no=1985, id=1652, vol=1.276000e+03
assign (segid "   B" and resid   62 and name   HA) (segid "   B" and resid   62 and name  HB2) 3.113 1.211 1.211 weight 1.000 ! spec=13Cnoesy, no=1985, id=1652, vol=1.276000e+03
assign (segid "   A" and resid   50 and name  HG2) (segid "   A" and resid   52 and name   HA) 4.073 2.074 2.074 weight 1.000 ! spec=13Cnoesy, no=1986, id=1653, vol=1.002000e+03
assign (segid "   B" and resid   50 and name  HG2) (segid "   B" and resid   52 and name   HA) 4.073 2.074 2.074 weight 1.000 ! spec=13Cnoesy, no=1986, id=1653, vol=1.002000e+03
assign (segid "   A" and resid   50 and name  HG2) (segid "   A" and resid   52 and name  HD1) 5.359 3.590 3.590 weight 1.000 ! spec=13Cnoesy, no=1988, id=1655, vol=2.818000e+02
assign (segid "   B" and resid   50 and name  HG2) (segid "   B" and resid   52 and name  HD1) 5.359 3.590 3.590 weight 1.000 ! spec=13Cnoesy, no=1988, id=1655, vol=2.818000e+02
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name  HG2) 2.066 0.534 0.534 weight 1.000 ! spec=13Cnoesy, no=1989, id=1656, vol=1.393000e+04
assign (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   50 and name  HG2) 2.066 0.534 0.534 weight 1.000 ! spec=13Cnoesy, no=1989, id=1656, vol=1.393000e+04
assign (segid "   A" and resid   50 and name  HG2) (segid "   A" and resid   50 and name   HA) 4.053 2.054 2.054 weight 1.000 ! spec=13Cnoesy, no=1990, id=1657, vol=3.651000e+02
assign (segid "   B" and resid   50 and name  HG2) (segid "   B" and resid   50 and name   HA) 4.053 2.054 2.054 weight 1.000 ! spec=13Cnoesy, no=1990, id=1657, vol=3.651000e+02
assign (segid "   A" and resid   50 and name  HG2) (segid "   A" and resid   50 and name  HD1) 2.473 0.764 0.764 weight 1.000 ! spec=13Cnoesy, no=1992, id=1659, vol=4.920000e+03
assign (segid "   B" and resid   50 and name  HG2) (segid "   B" and resid   50 and name  HD1) 2.473 0.764 0.764 weight 1.000 ! spec=13Cnoesy, no=1992, id=1659, vol=4.920000e+03
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    6 and name HG22) 3.008 1.131 1.131 weight 1.000 ! spec=13Cnoesy, no=1996, id=1662, vol=5.523000e+02
    or (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    6 and name HG23)
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    6 and name HG22)
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    6 and name HG23)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    6 and name HG22)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    6 and name HG23)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    6 and name HG22) 3.008 1.131 1.131 weight 1.000 ! spec=13Cnoesy, no=1996, id=1662, vol=5.523000e+02
    or (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    6 and name HG23)
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    6 and name HG22)
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    6 and name HG23)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    6 and name HG22)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    6 and name HG23)
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    6 and name   HB) 2.165 2.165 3.835 weight 1.000 ! spec=13Cnoesy, no=1999, id=1665, vol=4.982000e+03
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    6 and name   HB)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    6 and name   HB)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    6 and name   HB) 2.165 2.165 3.835 weight 1.000 ! spec=13Cnoesy, no=1999, id=1665, vol=4.982000e+03
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    6 and name   HB)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    6 and name   HB)
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    7 and name  HD1) 5.448 3.711 3.711 weight 1.000 ! spec=13Cnoesy, no=2003, id=1667, vol=3.887000e+02
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    7 and name  HD1)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    7 and name  HD1)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    7 and name  HD1) 5.448 3.711 3.711 weight 1.000 ! spec=13Cnoesy, no=2003, id=1667, vol=3.887000e+02
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    7 and name  HD1)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    7 and name  HD1)
assign (segid "   A" and resid   10 and name  HA1) (segid "   A" and resid   10 and name   HN) 3.921 1.921 1.921 weight 1.000 ! spec=13Cnoesy, no=2008, id=1670, vol=3.776000e+02
assign (segid "   B" and resid   10 and name  HA1) (segid "   B" and resid   10 and name   HN) 3.921 1.921 1.921 weight 1.000 ! spec=13Cnoesy, no=2008, id=1670, vol=3.776000e+02
assign (segid "   A" and resid   10 and name  HA1) (segid "   A" and resid   12 and name   HA) 5.145 3.308 3.308 weight 1.000 ! spec=13Cnoesy, no=2011, id=1673, vol=6.351000e+02
assign (segid "   B" and resid   10 and name  HA1) (segid "   B" and resid   12 and name   HA) 5.145 3.308 3.308 weight 1.000 ! spec=13Cnoesy, no=2011, id=1673, vol=6.351000e+02
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HG2) 3.405 1.450 1.450 weight 1.000 ! spec=13Cnoesy, no=2014, id=1674, vol=1.884000e+03
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   34 and name  HG2) 3.405 1.450 1.450 weight 1.000 ! spec=13Cnoesy, no=2014, id=1674, vol=1.884000e+03
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name  HB2) 2.123 0.564 0.564 weight 1.000 ! spec=13Cnoesy, no=2018, id=1677, vol=5.922000e+03
assign (segid "   B" and resid   34 and name  HG2) (segid "   B" and resid   34 and name  HB2) 2.123 0.564 0.564 weight 1.000 ! spec=13Cnoesy, no=2018, id=1677, vol=5.922000e+03
assign (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   32 and name  HE2) 2.001 0.500 0.500 weight 1.000 ! spec=13Cnoesy, no=2021, id=1680, vol=8.011000e+03
assign (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name  HE2) 2.001 0.500 0.500 weight 1.000 ! spec=13Cnoesy, no=2021, id=1680, vol=8.011000e+03
assign (segid "   A" and resid   32 and name  HE2) (segid "   A" and resid   32 and name   HN) 4.835 2.922 2.922 weight 1.000 ! spec=13Cnoesy, no=2022, id=1681, vol=6.120000e+02
assign (segid "   B" and resid   32 and name  HE2) (segid "   B" and resid   32 and name   HN) 4.835 2.922 2.922 weight 1.000 ! spec=13Cnoesy, no=2022, id=1681, vol=6.120000e+02
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   32 and name  HE2) 2.576 0.830 0.830 weight 1.000 ! spec=13Cnoesy, no=2023, id=1682, vol=5.681000e+03
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name  HE2) 2.576 0.830 0.830 weight 1.000 ! spec=13Cnoesy, no=2023, id=1682, vol=5.681000e+03
assign (segid "   A" and resid   32 and name  HD2) (segid "   A" and resid   32 and name  HE2) 1.720 1.720 4.280 weight 1.000 ! spec=13Cnoesy, no=2024, id=1683, vol=2.317000e+04
assign (segid "   B" and resid   32 and name  HD2) (segid "   B" and resid   32 and name  HE2) 1.720 1.720 4.280 weight 1.000 ! spec=13Cnoesy, no=2024, id=1683, vol=2.317000e+04
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name  HE2) 4.848 2.938 2.938 weight 1.000 ! spec=13Cnoesy, no=2025, id=1684, vol=1.447000e+03
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   32 and name  HE2) 4.848 2.938 2.938 weight 1.000 ! spec=13Cnoesy, no=2025, id=1684, vol=1.447000e+03
assign (segid "   A" and resid   32 and name  HE2) (segid "   A" and resid   32 and name  HB2) 3.786 1.792 1.792 weight 1.000 ! spec=13Cnoesy, no=2026, id=1685, vol=2.676000e+03
assign (segid "   B" and resid   32 and name  HE2) (segid "   B" and resid   32 and name  HB2) 3.786 1.792 1.792 weight 1.000 ! spec=13Cnoesy, no=2026, id=1685, vol=2.676000e+03
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HD1) 1.901 1.901 4.099 weight 1.000 ! spec=13Cnoesy, no=2027, id=1686, vol=2.301000e+04
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name  HD1) 1.901 1.901 4.099 weight 1.000 ! spec=13Cnoesy, no=2027, id=1686, vol=2.301000e+04
assign (segid "   A" and resid   57 and name  HD1) (segid "   A" and resid   57 and name   HA) 5.715 4.082 4.082 weight 1.000 ! spec=13Cnoesy, no=2031, id=1689, vol=4.947000e+02
assign (segid "   B" and resid   57 and name  HD1) (segid "   B" and resid   57 and name   HA) 5.715 4.082 4.082 weight 1.000 ! spec=13Cnoesy, no=2031, id=1689, vol=4.947000e+02
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   57 and name  HD1) 1.878 0.441 0.441 weight 1.000 ! spec=13Cnoesy, no=2033, id=1691, vol=1.579000e+04
assign (segid "   B" and resid   57 and name  HE1) (segid "   B" and resid   57 and name  HD1) 1.878 0.441 0.441 weight 1.000 ! spec=13Cnoesy, no=2033, id=1691, vol=1.579000e+04
assign (segid "   A" and resid   57 and name  HD1) (segid "   A" and resid   57 and name  HB2) 3.314 1.373 1.373 weight 1.000 ! spec=13Cnoesy, no=2034, id=1692, vol=4.193000e+03
assign (segid "   B" and resid   57 and name  HD1) (segid "   B" and resid   57 and name  HB2) 3.314 1.373 1.373 weight 1.000 ! spec=13Cnoesy, no=2034, id=1692, vol=4.193000e+03
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   27 and name HG21) 2.042 0.521 0.521 weight 1.000 ! spec=13Cnoesy, no=2045, id=1700, vol=7.204000e+03
    or (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   27 and name HG22)
    or (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   27 and name HG23)
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   27 and name HG21) 2.042 0.521 0.521 weight 1.000 ! spec=13Cnoesy, no=2045, id=1700, vol=7.204000e+03
    or (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   27 and name HG22)
    or (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   27 and name HG23)
assign (segid "   A" and resid   27 and name HG21) (segid "   A" and resid   27 and name   HA) 2.287 0.654 0.654 weight 1.000 ! spec=13Cnoesy, no=2049, id=1704, vol=4.176000e+03
    or (segid "   A" and resid   27 and name HG22) (segid "   A" and resid   27 and name   HA)
    or (segid "   A" and resid   27 and name HG23) (segid "   A" and resid   27 and name   HA)
assign (segid "   B" and resid   27 and name HG21) (segid "   B" and resid   27 and name   HA) 2.287 0.654 0.654 weight 1.000 ! spec=13Cnoesy, no=2049, id=1704, vol=4.176000e+03
    or (segid "   B" and resid   27 and name HG22) (segid "   B" and resid   27 and name   HA)
    or (segid "   B" and resid   27 and name HG23) (segid "   B" and resid   27 and name   HA)
assign (segid "   A" and resid   56 and name   HB) (segid "   A" and resid  106 and name   HA) 3.644 1.660 1.660 weight 1.000 ! spec=13Cnoesy, no=2050, id=1705, vol=6.954000e+02
assign (segid "   B" and resid   56 and name   HB) (segid "   B" and resid  106 and name   HA) 3.644 1.660 1.660 weight 1.000 ! spec=13Cnoesy, no=2050, id=1705, vol=6.954000e+02
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name   HA) 3.191 1.273 1.273 weight 1.000 ! spec=13Cnoesy, no=2056, id=1710, vol=1.821000e+03
assign (segid "   B" and resid   13 and name  HB1) (segid "   B" and resid   13 and name   HA) 3.191 1.273 1.273 weight 1.000 ! spec=13Cnoesy, no=2056, id=1710, vol=1.821000e+03
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   53 and name   HZ) 3.105 1.205 1.205 weight 1.000 ! spec=13Cnoesy, no=2063, id=1716, vol=7.889000e+02
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   53 and name   HZ)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   53 and name   HZ)
assign (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   53 and name   HZ) 3.105 1.205 1.205 weight 1.000 ! spec=13Cnoesy, no=2063, id=1716, vol=7.889000e+02
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   53 and name   HZ)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   53 and name   HZ)
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name   HB) 1.938 0.470 0.470 weight 1.000 ! spec=13Cnoesy, no=2064, id=1717, vol=3.949000e+03
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name   HB)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   38 and name   HB)
assign (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   38 and name   HB) 1.938 0.470 0.470 weight 1.000 ! spec=13Cnoesy, no=2064, id=1717, vol=3.949000e+03
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   38 and name   HB)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   38 and name   HB)
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   25 and name   HN) 3.270 1.337 1.337 weight 1.000 ! spec=13Cnoesy, no=2065, id=1718, vol=2.469000e+03
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   25 and name   HN)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   25 and name   HN)
assign (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   25 and name   HN) 3.270 1.337 1.337 weight 1.000 ! spec=13Cnoesy, no=2065, id=1718, vol=2.469000e+03
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   25 and name   HN)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   25 and name   HN)
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   39 and name   HN) 2.618 0.857 0.857 weight 1.000 ! spec=13Cnoesy, no=2066, id=1719, vol=2.491000e+03
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   39 and name   HN)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   39 and name   HN)
assign (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   39 and name   HN) 2.618 0.857 0.857 weight 1.000 ! spec=13Cnoesy, no=2066, id=1719, vol=2.491000e+03
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   39 and name   HN)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   39 and name   HN)
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name   HA) 2.411 0.726 0.726 weight 1.000 ! spec=13Cnoesy, no=2067, id=1720, vol=2.752000e+03
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name   HA)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   38 and name   HA)
assign (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   38 and name   HA) 2.411 0.726 0.726 weight 1.000 ! spec=13Cnoesy, no=2067, id=1720, vol=2.752000e+03
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   38 and name   HA)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   38 and name   HA)
assign (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name   HB) 2.998 1.124 1.124 weight 1.000 ! spec=13Cnoesy, no=2069, id=1722, vol=1.443000e+03
assign (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  109 and name   HB) 2.998 1.124 1.124 weight 1.000 ! spec=13Cnoesy, no=2069, id=1722, vol=1.443000e+03
assign (segid "   A" and resid  109 and name HG22) (segid "   A" and resid  109 and name   HB) 2.395 0.717 0.717 weight 1.000 ! spec=13Cnoesy, no=2071, id=1724, vol=1.609000e+03
    or (segid "   A" and resid  109 and name HG21) (segid "   A" and resid  109 and name   HB)
    or (segid "   A" and resid  109 and name HG23) (segid "   A" and resid  109 and name   HB)
assign (segid "   B" and resid  109 and name HG22) (segid "   B" and resid  109 and name   HB) 2.395 0.717 0.717 weight 1.000 ! spec=13Cnoesy, no=2071, id=1724, vol=1.609000e+03
    or (segid "   B" and resid  109 and name HG21) (segid "   B" and resid  109 and name   HB)
    or (segid "   B" and resid  109 and name HG23) (segid "   B" and resid  109 and name   HB)
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   53 and name   HZ) 4.879 2.976 2.976 weight 1.000 ! spec=13Cnoesy, no=2076, id=1728, vol=2.629000e+02
assign (segid "   B" and resid   38 and name   HB) (segid "   B" and resid   53 and name   HZ) 4.879 2.976 2.976 weight 1.000 ! spec=13Cnoesy, no=2076, id=1728, vol=2.629000e+02
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name   HA) 3.396 1.441 1.441 weight 1.000 ! spec=13Cnoesy, no=2078, id=1729, vol=5.388000e+02
assign (segid "   B" and resid   38 and name   HB) (segid "   B" and resid   38 and name   HA) 3.396 1.441 1.441 weight 1.000 ! spec=13Cnoesy, no=2078, id=1729, vol=5.388000e+02
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name  HB2) 1.753 0.384 0.384 weight 1.000 ! spec=13Cnoesy, no=2104, id=1745, vol=3.710000e+03
assign (segid "   B" and resid   57 and name  HB1) (segid "   B" and resid   57 and name  HB2) 1.753 0.384 0.384 weight 1.000 ! spec=13Cnoesy, no=2104, id=1745, vol=3.710000e+03
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid  114 and name   HA) 4.258 2.267 2.267 weight 1.000 ! spec=13Cnoesy, no=2115, id=1752, vol=4.499000e+02
assign (segid "   B" and resid   76 and name   HA) (segid "   B" and resid  114 and name   HA) 4.258 2.267 2.267 weight 1.000 ! spec=13Cnoesy, no=2115, id=1752, vol=4.499000e+02
assign (segid "   A" and resid   90 and name   HG) (segid "   A" and resid   99 and name   HN) 4.010 2.010 2.010 weight 1.000 ! spec=13Cnoesy, no=2120, id=1756, vol=6.773000e+02
assign (segid "   B" and resid   90 and name   HG) (segid "   B" and resid   99 and name   HN) 4.010 2.010 2.010 weight 1.000 ! spec=13Cnoesy, no=2120, id=1756, vol=6.773000e+02
assign (segid "   A" and resid   90 and name   HG) (segid "   A" and resid   97 and name   HA) 3.647 1.662 1.662 weight 1.000 ! spec=13Cnoesy, no=2121, id=1757, vol=8.231000e+02
assign (segid "   B" and resid   90 and name   HG) (segid "   B" and resid   97 and name   HA) 3.647 1.662 1.662 weight 1.000 ! spec=13Cnoesy, no=2121, id=1757, vol=8.231000e+02
assign (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name HD22) 2.733 0.934 0.934 weight 1.000 ! spec=13Cnoesy, no=2128, id=1762, vol=1.736000e+03
    or (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name HD22) 2.733 0.934 0.934 weight 1.000 ! spec=13Cnoesy, no=2128, id=1762, vol=1.736000e+03
    or (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid  112 and name  HB1) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name HD22) 2.444 0.747 0.747 weight 1.000 ! spec=13Cnoesy, no=2129, id=1763, vol=2.321000e+03
    or (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name HD22) 2.444 0.747 0.747 weight 1.000 ! spec=13Cnoesy, no=2129, id=1763, vol=2.321000e+03
    or (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid  112 and name HD22) 3.441 1.480 1.480 weight 1.000 ! spec=13Cnoesy, no=2130, id=1764, vol=1.702000e+03
    or (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid  112 and name HD22) 3.441 1.480 1.480 weight 1.000 ! spec=13Cnoesy, no=2130, id=1764, vol=1.702000e+03
    or (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid  112 and name HD22) 3.671 1.684 1.684 weight 1.000 ! spec=13Cnoesy, no=2132, id=1766, vol=1.638000e+03
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid   78 and name  HB2) (segid "   B" and resid  112 and name HD22) 3.671 1.684 1.684 weight 1.000 ! spec=13Cnoesy, no=2132, id=1766, vol=1.638000e+03
    or (segid "   B" and resid   78 and name  HB2) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid   78 and name  HB2) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid  112 and name HD22) 3.490 1.522 1.522 weight 1.000 ! spec=13Cnoesy, no=2133, id=1767, vol=1.206000e+03
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid   78 and name   HA) (segid "   B" and resid  112 and name HD22) 3.490 1.522 1.522 weight 1.000 ! spec=13Cnoesy, no=2133, id=1767, vol=1.206000e+03
    or (segid "   B" and resid   78 and name   HA) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid   78 and name   HA) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid  112 and name HD22) 2.565 0.822 0.822 weight 1.000 ! spec=13Cnoesy, no=2134, id=1768, vol=1.636000e+03
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid  112 and name HD22) 2.565 0.822 0.822 weight 1.000 ! spec=13Cnoesy, no=2134, id=1768, vol=1.636000e+03
    or (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name HD22) 3.331 1.387 1.387 weight 1.000 ! spec=13Cnoesy, no=2135, id=1769, vol=1.901000e+03
    or (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid  112 and name  HB2) (segid "   B" and resid  112 and name HD22) 3.331 1.387 1.387 weight 1.000 ! spec=13Cnoesy, no=2135, id=1769, vol=1.901000e+03
    or (segid "   B" and resid  112 and name  HB2) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid  112 and name  HB2) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid  112 and name HD22) 1.836 0.421 0.421 weight 1.000 ! spec=13Cnoesy, no=2136, id=1770, vol=4.892000e+03
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid  112 and name HD23)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid  112 and name HD22)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid  112 and name HD23)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid  112 and name HD22)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid  112 and name HD22) 1.836 0.421 0.421 weight 1.000 ! spec=13Cnoesy, no=2136, id=1770, vol=4.892000e+03
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid  112 and name HD23)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid  112 and name HD22)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid  112 and name HD23)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid  112 and name HD22)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid  112 and name   HG) (segid "   A" and resid  112 and name HD22) 1.902 0.452 0.452 weight 1.000 ! spec=13Cnoesy, no=2137, id=1771, vol=5.375000e+03
    or (segid "   A" and resid  112 and name   HG) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid  112 and name   HG) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid  112 and name   HG) (segid "   B" and resid  112 and name HD22) 1.902 0.452 0.452 weight 1.000 ! spec=13Cnoesy, no=2137, id=1771, vol=5.375000e+03
    or (segid "   B" and resid  112 and name   HG) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid  112 and name   HG) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid  112 and name HD22) 3.344 1.397 1.397 weight 1.000 ! spec=13Cnoesy, no=2138, id=1772, vol=1.702000e+03
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid   76 and name  HB1) (segid "   B" and resid  112 and name HD22) 3.344 1.397 1.397 weight 1.000 ! spec=13Cnoesy, no=2138, id=1772, vol=1.702000e+03
    or (segid "   B" and resid   76 and name  HB1) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid   76 and name  HB1) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid  112 and name   HN) 3.813 1.817 1.817 weight 1.000 ! spec=13Cnoesy, no=2141, id=1773, vol=9.662000e+02
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid  112 and name   HN)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid  112 and name   HN)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid  112 and name   HN) 3.813 1.817 1.817 weight 1.000 ! spec=13Cnoesy, no=2141, id=1773, vol=9.662000e+02
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid  112 and name   HN)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid  112 and name   HN)
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid   71 and name   HA) 3.311 1.370 1.370 weight 1.000 ! spec=13Cnoesy, no=2142, id=1774, vol=1.960000e+03
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid   71 and name   HA)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid   71 and name   HA)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid   71 and name   HA) 3.311 1.370 1.370 weight 1.000 ! spec=13Cnoesy, no=2142, id=1774, vol=1.960000e+03
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid   71 and name   HA)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid   71 and name   HA)
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid  111 and name HG22) 2.867 2.867 3.133 weight 1.000 ! spec=13Cnoesy, no=2144, id=1775, vol=3.767000e+03
    or (segid "   A" and resid  112 and name HD22) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  112 and name HD22) (segid "   A" and resid  111 and name HG23)
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid  111 and name HG22)
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid  111 and name HG23)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid  111 and name HG22)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid  111 and name HG23)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid  111 and name HG22) 2.867 2.867 3.133 weight 1.000 ! spec=13Cnoesy, no=2144, id=1775, vol=3.767000e+03
    or (segid "   B" and resid  112 and name HD22) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  112 and name HD22) (segid "   B" and resid  111 and name HG23)
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid  111 and name HG22)
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid  111 and name HG23)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid  111 and name HG22)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid  111 and name HG23)
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid   77 and name   HA) 3.376 1.424 1.424 weight 1.000 ! spec=13Cnoesy, no=2147, id=1778, vol=2.579000e+03
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid   77 and name   HA)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid   77 and name   HA)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid   77 and name   HA) 3.376 1.424 1.424 weight 1.000 ! spec=13Cnoesy, no=2147, id=1778, vol=2.579000e+03
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid   77 and name   HA)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid   77 and name   HA)
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   71 and name HG22) 3.718 1.728 1.728 weight 1.000 ! spec=13Cnoesy, no=2151, id=1782, vol=1.174000e+03
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   71 and name HG21)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   71 and name HG23)
assign (segid "   B" and resid   78 and name  HB2) (segid "   B" and resid   71 and name HG22) 3.718 1.728 1.728 weight 1.000 ! spec=13Cnoesy, no=2151, id=1782, vol=1.174000e+03
    or (segid "   B" and resid   78 and name  HB2) (segid "   B" and resid   71 and name HG21)
    or (segid "   B" and resid   78 and name  HB2) (segid "   B" and resid   71 and name HG23)
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   71 and name HG22) 2.791 0.974 0.974 weight 1.000 ! spec=13Cnoesy, no=2153, id=1784, vol=1.734000e+03
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   71 and name HG21)
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   71 and name HG23)
assign (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid   71 and name HG22) 2.791 0.974 0.974 weight 1.000 ! spec=13Cnoesy, no=2153, id=1784, vol=1.734000e+03
    or (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid   71 and name HG21)
    or (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid   71 and name HG23)
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   71 and name HG22) 2.022 0.511 0.511 weight 1.000 ! spec=13Cnoesy, no=2154, id=1785, vol=6.556000e+03
    or (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   71 and name HG21)
    or (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   71 and name HG23)
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   71 and name HG22)
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   71 and name HG21)
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   71 and name HG23)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   71 and name HG22)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   71 and name HG21)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   71 and name HG23)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   71 and name HG22) 2.022 0.511 0.511 weight 1.000 ! spec=13Cnoesy, no=2154, id=1785, vol=6.556000e+03
    or (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   71 and name HG21)
    or (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   71 and name HG23)
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   71 and name HG22)
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   71 and name HG21)
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   71 and name HG23)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   71 and name HG22)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   71 and name HG21)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   71 and name HG23)
assign (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   71 and name HG22) 2.441 0.745 0.745 weight 1.000 ! spec=13Cnoesy, no=2156, id=1787, vol=2.037000e+03
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   71 and name HG21)
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   71 and name HG23)
assign (segid "   B" and resid   76 and name  HB1) (segid "   B" and resid   71 and name HG22) 2.441 0.745 0.745 weight 1.000 ! spec=13Cnoesy, no=2156, id=1787, vol=2.037000e+03
    or (segid "   B" and resid   76 and name  HB1) (segid "   B" and resid   71 and name HG21)
    or (segid "   B" and resid   76 and name  HB1) (segid "   B" and resid   71 and name HG23)
assign (segid "   A" and resid   71 and name HG22) (segid "   A" and resid   71 and name   HA) 2.559 0.818 0.818 weight 1.000 ! spec=13Cnoesy, no=2158, id=1789, vol=2.712000e+03
    or (segid "   A" and resid   71 and name HG21) (segid "   A" and resid   71 and name   HA)
    or (segid "   A" and resid   71 and name HG23) (segid "   A" and resid   71 and name   HA)
assign (segid "   B" and resid   71 and name HG22) (segid "   B" and resid   71 and name   HA) 2.559 0.818 0.818 weight 1.000 ! spec=13Cnoesy, no=2158, id=1789, vol=2.712000e+03
    or (segid "   B" and resid   71 and name HG21) (segid "   B" and resid   71 and name   HA)
    or (segid "   B" and resid   71 and name HG23) (segid "   B" and resid   71 and name   HA)
assign (segid "   A" and resid   71 and name HG22) (segid "   A" and resid   71 and name HG11) 2.902 1.053 1.053 weight 1.000 ! spec=13Cnoesy, no=2161, id=1791, vol=3.242000e+03
    or (segid "   A" and resid   71 and name HG21) (segid "   A" and resid   71 and name HG11)
    or (segid "   A" and resid   71 and name HG23) (segid "   A" and resid   71 and name HG11)
assign (segid "   B" and resid   71 and name HG22) (segid "   B" and resid   71 and name HG11) 2.902 1.053 1.053 weight 1.000 ! spec=13Cnoesy, no=2161, id=1791, vol=3.242000e+03
    or (segid "   B" and resid   71 and name HG21) (segid "   B" and resid   71 and name HG11)
    or (segid "   B" and resid   71 and name HG23) (segid "   B" and resid   71 and name HG11)
assign (segid "   A" and resid  108 and name  HB2) (segid "   A" and resid   18 and name   HN) 5.459 3.724 3.724 weight 1.000 ! spec=13Cnoesy, no=2162, id=1792, vol=3.520000e+02
assign (segid "   B" and resid  108 and name  HB2) (segid "   B" and resid   18 and name   HN) 5.459 3.724 3.724 weight 1.000 ! spec=13Cnoesy, no=2162, id=1792, vol=3.520000e+02
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HD2) 2.434 0.740 0.740 weight 1.000 ! spec=13Cnoesy, no=2166, id=1795, vol=1.452000e+04
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name  HD2) 2.434 0.740 0.740 weight 1.000 ! spec=13Cnoesy, no=2166, id=1795, vol=1.452000e+04
assign (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   57 and name   HA) 4.874 2.969 2.969 weight 1.000 ! spec=13Cnoesy, no=2170, id=1798, vol=1.015000e+03
assign (segid "   B" and resid   57 and name  HD2) (segid "   B" and resid   57 and name   HA) 4.874 2.969 2.969 weight 1.000 ! spec=13Cnoesy, no=2170, id=1798, vol=1.015000e+03
assign (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   57 and name  HD2) 2.246 0.631 0.631 weight 1.000 ! spec=13Cnoesy, no=2171, id=1799, vol=8.499000e+03
assign (segid "   B" and resid   57 and name  HG1) (segid "   B" and resid   57 and name  HD2) 2.246 0.631 0.631 weight 1.000 ! spec=13Cnoesy, no=2171, id=1799, vol=8.499000e+03
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   57 and name  HD2) 2.472 0.764 0.764 weight 1.000 ! spec=13Cnoesy, no=2172, id=1800, vol=8.283000e+03
assign (segid "   B" and resid   57 and name  HE1) (segid "   B" and resid   57 and name  HD2) 2.472 0.764 0.764 weight 1.000 ! spec=13Cnoesy, no=2172, id=1800, vol=8.283000e+03
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name  HD2) 2.137 0.571 0.571 weight 1.000 ! spec=13Cnoesy, no=2174, id=1801, vol=5.560000e+03
assign (segid "   B" and resid   57 and name  HB2) (segid "   B" and resid   57 and name  HD2) 2.137 0.571 0.571 weight 1.000 ! spec=13Cnoesy, no=2174, id=1801, vol=5.560000e+03
assign (segid "   A" and resid    3 and name   HB) (segid "   A" and resid    2 and name   HN) 5.774 4.167 4.167 weight 1.000 ! spec=13Cnoesy, no=2178, id=1805, vol=3.278000e+02
assign (segid "   B" and resid    3 and name   HB) (segid "   B" and resid    2 and name   HN) 5.774 4.167 4.167 weight 1.000 ! spec=13Cnoesy, no=2178, id=1805, vol=3.278000e+02
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  103 and name  HG2) 2.607 0.850 0.850 weight 1.000 ! spec=13Cnoesy, no=2184, id=1810, vol=7.488000e+03
assign (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid  103 and name  HG2) 2.607 0.850 0.850 weight 1.000 ! spec=13Cnoesy, no=2184, id=1810, vol=7.488000e+03
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  103 and name  HG2) 1.958 0.479 0.479 weight 1.000 ! spec=13Cnoesy, no=2187, id=1812, vol=1.457000e+04
assign (segid "   B" and resid  103 and name  HB2) (segid "   B" and resid  103 and name  HG2) 1.958 0.479 0.479 weight 1.000 ! spec=13Cnoesy, no=2187, id=1812, vol=1.457000e+04
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name  HD1) 2.531 0.801 0.801 weight 1.000 ! spec=13Cnoesy, no=2190, id=1815, vol=1.189000e+04
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   74 and name  HD1) 2.531 0.801 0.801 weight 1.000 ! spec=13Cnoesy, no=2190, id=1815, vol=1.189000e+04
assign (segid "   A" and resid   74 and name  HD2) (segid "   A" and resid   74 and name  HD1) 1.652 0.341 0.341 weight 1.000 ! spec=13Cnoesy, no=2193, id=1818, vol=1.189000e+04
assign (segid "   B" and resid   74 and name  HD2) (segid "   B" and resid   74 and name  HD1) 1.652 0.341 0.341 weight 1.000 ! spec=13Cnoesy, no=2193, id=1818, vol=1.189000e+04
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   74 and name  HD1) 2.248 0.632 0.632 weight 1.000 ! spec=13Cnoesy, no=2194, id=1819, vol=9.147000e+03
assign (segid "   B" and resid   74 and name  HG1) (segid "   B" and resid   74 and name  HD1) 2.248 0.632 0.632 weight 1.000 ! spec=13Cnoesy, no=2194, id=1819, vol=9.147000e+03
assign (segid "   A" and resid   74 and name  HG2) (segid "   A" and resid   74 and name  HD1) 2.672 0.892 0.892 weight 1.000 ! spec=13Cnoesy, no=2197, id=1822, vol=9.886000e+03
assign (segid "   B" and resid   74 and name  HG2) (segid "   B" and resid   74 and name  HD1) 2.672 0.892 0.892 weight 1.000 ! spec=13Cnoesy, no=2197, id=1822, vol=9.886000e+03
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   39 and name HD22) 3.433 1.474 1.474 weight 1.000 ! spec=13Cnoesy, no=2206, id=1825, vol=1.455000e+03
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   39 and name HD23)
assign (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   39 and name HD22) 3.433 1.474 1.474 weight 1.000 ! spec=13Cnoesy, no=2206, id=1825, vol=1.455000e+03
    or (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   39 and name HD23)
assign (segid "   A" and resid   84 and name  HB1) (segid "   A" and resid   84 and name  HB2) 2.715 0.921 0.921 weight 1.000 ! spec=13Cnoesy, no=2211, id=1828, vol=9.392000e+02
assign (segid "   B" and resid   84 and name  HB1) (segid "   B" and resid   84 and name  HB2) 2.715 0.921 0.921 weight 1.000 ! spec=13Cnoesy, no=2211, id=1828, vol=9.392000e+02
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid   55 and name  HG1) 4.310 2.322 2.322 weight 1.000 ! spec=13Cnoesy, no=2214, id=1830, vol=5.807000e+02
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid   55 and name  HG1)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid   55 and name  HG1)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid   55 and name  HG1) 4.310 2.322 2.322 weight 1.000 ! spec=13Cnoesy, no=2214, id=1830, vol=5.807000e+02
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid   55 and name  HG1)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid   55 and name  HG1)
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name  HG1) 2.972 1.104 1.104 weight 1.000 ! spec=13Cnoesy, no=2218, id=1832, vol=1.435000e+03
assign (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   55 and name  HG1) 2.972 1.104 1.104 weight 1.000 ! spec=13Cnoesy, no=2218, id=1832, vol=1.435000e+03
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   55 and name  HG1) 3.487 1.520 1.520 weight 1.000 ! spec=13Cnoesy, no=2219, id=1833, vol=1.392000e+03
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   55 and name  HG1)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   55 and name  HG1)
assign (segid "   B" and resid   20 and name HG12) (segid "   B" and resid   55 and name  HG1) 3.487 1.520 1.520 weight 1.000 ! spec=13Cnoesy, no=2219, id=1833, vol=1.392000e+03
    or (segid "   B" and resid   20 and name HG11) (segid "   B" and resid   55 and name  HG1)
    or (segid "   B" and resid   20 and name HG13) (segid "   B" and resid   55 and name  HG1)
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name  HG1) 4.326 2.340 2.340 weight 1.000 ! spec=13Cnoesy, no=2220, id=1834, vol=7.226000e+02
assign (segid "   B" and resid   55 and name   HA) (segid "   B" and resid   55 and name  HG1) 4.326 2.340 2.340 weight 1.000 ! spec=13Cnoesy, no=2220, id=1834, vol=7.226000e+02
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   55 and name  HG1) 2.195 0.602 0.602 weight 1.000 ! spec=13Cnoesy, no=2221, id=1835, vol=2.997000e+03
assign (segid "   B" and resid   55 and name  HG2) (segid "   B" and resid   55 and name  HG1) 2.195 0.602 0.602 weight 1.000 ! spec=13Cnoesy, no=2221, id=1835, vol=2.997000e+03
assign (segid "   A" and resid   55 and name  HG1) (segid "   A" and resid   55 and name  HB2) 3.731 1.740 1.740 weight 1.000 ! spec=13Cnoesy, no=2222, id=1836, vol=1.390000e+03
assign (segid "   B" and resid   55 and name  HG1) (segid "   B" and resid   55 and name  HB2) 3.731 1.740 1.740 weight 1.000 ! spec=13Cnoesy, no=2222, id=1836, vol=1.390000e+03
assign (segid "   A" and resid   55 and name  HG1) (segid "   A" and resid  104 and name   HA) 5.973 4.460 4.460 weight 1.000 ! spec=13Cnoesy, no=2224, id=1838, vol=4.428000e+02
assign (segid "   B" and resid   55 and name  HG1) (segid "   B" and resid  104 and name   HA) 5.973 4.460 4.460 weight 1.000 ! spec=13Cnoesy, no=2224, id=1838, vol=4.428000e+02
assign (segid "   A" and resid   16 and name  HB1) (segid "   A" and resid   16 and name   HN) 3.862 1.865 1.865 weight 1.000 ! spec=13Cnoesy, no=2230, id=1842, vol=7.427000e+02
assign (segid "   B" and resid   16 and name  HB1) (segid "   B" and resid   16 and name   HN) 3.862 1.865 1.865 weight 1.000 ! spec=13Cnoesy, no=2230, id=1842, vol=7.427000e+02
assign (segid "   A" and resid  118 and name  HB1) (segid "   A" and resid  118 and name  HD2) 3.707 1.718 1.718 weight 1.000 ! spec=13Cnoesy, no=2232, id=1844, vol=9.463000e+02
assign (segid "   B" and resid  118 and name  HB1) (segid "   B" and resid  118 and name  HD2) 3.707 1.718 1.718 weight 1.000 ! spec=13Cnoesy, no=2232, id=1844, vol=9.463000e+02
assign (segid "   A" and resid  118 and name  HD2) (segid "   A" and resid  118 and name   HN) 4.583 2.626 2.626 weight 1.000 ! spec=13Cnoesy, no=2233, id=1845, vol=2.423000e+02
assign (segid "   B" and resid  118 and name  HD2) (segid "   B" and resid  118 and name   HN) 4.583 2.626 2.626 weight 1.000 ! spec=13Cnoesy, no=2233, id=1845, vol=2.423000e+02
assign (segid "   A" and resid  118 and name  HG2) (segid "   A" and resid  118 and name  HD2) 3.335 1.390 1.390 weight 1.000 ! spec=13Cnoesy, no=2235, id=1847, vol=1.551000e+03
assign (segid "   B" and resid  118 and name  HG2) (segid "   B" and resid  118 and name  HD2) 3.335 1.390 1.390 weight 1.000 ! spec=13Cnoesy, no=2235, id=1847, vol=1.551000e+03
assign (segid "   A" and resid  118 and name   HA) (segid "   A" and resid  118 and name  HD2) 3.959 1.959 1.959 weight 1.000 ! spec=13Cnoesy, no=2236, id=1848, vol=3.862000e+02
assign (segid "   B" and resid  118 and name   HA) (segid "   B" and resid  118 and name  HD2) 3.959 1.959 1.959 weight 1.000 ! spec=13Cnoesy, no=2236, id=1848, vol=3.862000e+02
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   25 and name  HG2) 1.540 1.540 4.460 weight 1.000 ! spec=13Cnoesy, no=2242, id=1850, vol=6.136000e+04
assign (segid "   B" and resid   25 and name  HD2) (segid "   B" and resid   25 and name  HG2) 1.540 1.540 4.460 weight 1.000 ! spec=13Cnoesy, no=2242, id=1850, vol=6.136000e+04
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name  HG2) 2.843 1.011 1.011 weight 1.000 ! spec=13Cnoesy, no=2246, id=1853, vol=3.636000e+03
assign (segid "   B" and resid   25 and name  HB1) (segid "   B" and resid   25 and name  HG2) 2.843 1.011 1.011 weight 1.000 ! spec=13Cnoesy, no=2246, id=1853, vol=3.636000e+03
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name  HG2) 1.941 0.471 0.471 weight 1.000 ! spec=13Cnoesy, no=2248, id=1854, vol=8.238000e+03
assign (segid "   B" and resid   25 and name  HB2) (segid "   B" and resid   25 and name  HG2) 1.941 0.471 0.471 weight 1.000 ! spec=13Cnoesy, no=2248, id=1854, vol=8.238000e+03
assign (segid "   A" and resid   31 and name HG12) (segid "   A" and resid   33 and name   HN) 5.207 3.389 3.389 weight 1.000 ! spec=13Cnoesy, no=2255, id=1860, vol=2.512000e+02
assign (segid "   B" and resid   31 and name HG12) (segid "   B" and resid   33 and name   HN) 5.207 3.389 3.389 weight 1.000 ! spec=13Cnoesy, no=2255, id=1860, vol=2.512000e+02
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid  115 and name  HE2) 2.675 0.895 0.895 weight 1.000 ! spec=13Cnoesy, no=2260, id=1865, vol=8.386000e+03
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid  115 and name  HE2) 2.675 0.895 0.895 weight 1.000 ! spec=13Cnoesy, no=2260, id=1865, vol=8.386000e+03
assign (segid "   A" and resid  115 and name  HD1) (segid "   A" and resid  115 and name  HE2) 2.677 0.896 0.896 weight 1.000 ! spec=13Cnoesy, no=2261, id=1866, vol=6.364000e+03
assign (segid "   B" and resid  115 and name  HD1) (segid "   B" and resid  115 and name  HE2) 2.677 0.896 0.896 weight 1.000 ! spec=13Cnoesy, no=2261, id=1866, vol=6.364000e+03
assign (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name HG22) 1.980 0.490 0.490 weight 1.000 ! spec=13Cnoesy, no=2268, id=1872, vol=5.544000e+03
    or (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name HG21)
    or (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name HG23)
assign (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name HG22) 1.980 0.490 0.490 weight 1.000 ! spec=13Cnoesy, no=2268, id=1872, vol=5.544000e+03
    or (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name HG21)
    or (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name HG23)
assign (segid "   A" and resid   31 and name HG22) (segid "   A" and resid  101 and name  HB2) 2.670 0.891 0.891 weight 1.000 ! spec=13Cnoesy, no=2277, id=1881, vol=2.452000e+03
    or (segid "   A" and resid   31 and name HG21) (segid "   A" and resid  101 and name  HB2)
    or (segid "   A" and resid   31 and name HG23) (segid "   A" and resid  101 and name  HB2)
assign (segid "   B" and resid   31 and name HG22) (segid "   B" and resid  101 and name  HB2) 2.670 0.891 0.891 weight 1.000 ! spec=13Cnoesy, no=2277, id=1881, vol=2.452000e+03
    or (segid "   B" and resid   31 and name HG21) (segid "   B" and resid  101 and name  HB2)
    or (segid "   B" and resid   31 and name HG23) (segid "   B" and resid  101 and name  HB2)
assign (segid "   A" and resid   31 and name HG22) (segid "   A" and resid   32 and name  HB2) 3.960 1.960 1.960 weight 1.000 ! spec=13Cnoesy, no=2278, id=1882, vol=1.188000e+03
    or (segid "   A" and resid   31 and name HG21) (segid "   A" and resid   32 and name  HB2)
    or (segid "   A" and resid   31 and name HG23) (segid "   A" and resid   32 and name  HB2)
assign (segid "   B" and resid   31 and name HG22) (segid "   B" and resid   32 and name  HB2) 3.960 1.960 1.960 weight 1.000 ! spec=13Cnoesy, no=2278, id=1882, vol=1.188000e+03
    or (segid "   B" and resid   31 and name HG21) (segid "   B" and resid   32 and name  HB2)
    or (segid "   B" and resid   31 and name HG23) (segid "   B" and resid   32 and name  HB2)
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    5 and name  HB1) 4.876 2.972 2.972 weight 1.000 ! spec=13Cnoesy, no=2281, id=1885, vol=9.776000e+02
assign (segid "   B" and resid    5 and name  HD1) (segid "   B" and resid    5 and name  HB1) 4.876 2.972 2.972 weight 1.000 ! spec=13Cnoesy, no=2281, id=1885, vol=9.776000e+02
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    5 and name  HB1) 2.856 1.020 1.020 weight 1.000 ! spec=13Cnoesy, no=2283, id=1887, vol=4.846000e+03
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    5 and name  HB1) 2.856 1.020 1.020 weight 1.000 ! spec=13Cnoesy, no=2283, id=1887, vol=4.846000e+03
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name  HB1) 1.742 0.379 0.379 weight 1.000 ! spec=13Cnoesy, no=2284, id=1888, vol=1.411000e+04
assign (segid "   B" and resid    5 and name  HB2) (segid "   B" and resid    5 and name  HB1) 1.742 0.379 0.379 weight 1.000 ! spec=13Cnoesy, no=2284, id=1888, vol=1.411000e+04
assign (segid "   A" and resid    5 and name  HG2) (segid "   A" and resid    5 and name  HB1) 2.277 0.648 0.648 weight 1.000 ! spec=13Cnoesy, no=2285, id=1889, vol=6.765000e+03
assign (segid "   B" and resid    5 and name  HG2) (segid "   B" and resid    5 and name  HB1) 2.277 0.648 0.648 weight 1.000 ! spec=13Cnoesy, no=2285, id=1889, vol=6.765000e+03
assign (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid    6 and name HG22) 3.281 1.346 1.346 weight 1.000 ! spec=13Cnoesy, no=2286, id=1890, vol=2.245000e+03
    or (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid    6 and name HG21)
    or (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid    6 and name HG23)
assign (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    6 and name HG22) 3.281 1.346 1.346 weight 1.000 ! spec=13Cnoesy, no=2286, id=1890, vol=2.245000e+03
    or (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    6 and name HG21)
    or (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    6 and name HG23)
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    5 and name  HB1) 5.788 4.188 4.188 weight 1.000 ! spec=13Cnoesy, no=2287, id=1891, vol=5.161000e+02
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid    5 and name  HB1) 5.788 4.188 4.188 weight 1.000 ! spec=13Cnoesy, no=2287, id=1891, vol=5.161000e+02
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    5 and name  HB1) 5.414 3.664 3.664 weight 1.000 ! spec=13Cnoesy, no=2289, id=1893, vol=4.219000e+02
assign (segid "   B" and resid    8 and name  HB1) (segid "   B" and resid    5 and name  HB1) 5.414 3.664 3.664 weight 1.000 ! spec=13Cnoesy, no=2289, id=1893, vol=4.219000e+02
assign (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    5 and name  HB1) 4.790 2.868 2.868 weight 1.000 ! spec=13Cnoesy, no=2290, id=1894, vol=1.017000e+03
assign (segid "   B" and resid    5 and name  HD2) (segid "   B" and resid    5 and name  HB1) 4.790 2.868 2.868 weight 1.000 ! spec=13Cnoesy, no=2290, id=1894, vol=1.017000e+03
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   27 and name   HA) 3.351 1.404 1.404 weight 1.000 ! spec=13Cnoesy, no=2301, id=1900, vol=7.788000e+02
assign (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   27 and name   HA) 3.351 1.404 1.404 weight 1.000 ! spec=13Cnoesy, no=2301, id=1900, vol=7.788000e+02
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   28 and name  HB2) 3.576 1.598 1.598 weight 1.000 ! spec=13Cnoesy, no=2302, id=1901, vol=1.746000e+03
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   28 and name  HB3)
assign (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   28 and name  HB2) 3.576 1.598 1.598 weight 1.000 ! spec=13Cnoesy, no=2302, id=1901, vol=1.746000e+03
    or (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   28 and name  HB3)
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid  103 and name  HB1) 5.069 3.212 3.212 weight 1.000 ! spec=13Cnoesy, no=2305, id=1904, vol=7.517000e+02
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid  103 and name  HB1) 5.069 3.212 3.212 weight 1.000 ! spec=13Cnoesy, no=2305, id=1904, vol=7.517000e+02
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   30 and name  HB2) 4.852 2.942 2.942 weight 1.000 ! spec=13Cnoesy, no=2306, id=1905, vol=5.658000e+02
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   30 and name  HB2) 4.852 2.942 2.942 weight 1.000 ! spec=13Cnoesy, no=2306, id=1905, vol=5.658000e+02
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name   HB) 3.303 1.363 1.363 weight 1.000 ! spec=13Cnoesy, no=2309, id=1908, vol=1.054000e+03
assign (segid "   B" and resid   29 and name   HA) (segid "   B" and resid   29 and name   HB) 3.303 1.363 1.363 weight 1.000 ! spec=13Cnoesy, no=2309, id=1908, vol=1.054000e+03
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   28 and name  HB2) 4.118 2.120 2.120 weight 1.000 ! spec=13Cnoesy, no=2310, id=1909, vol=1.179000e+03
    or (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   28 and name  HB3)
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   28 and name  HB2) 4.118 2.120 2.120 weight 1.000 ! spec=13Cnoesy, no=2310, id=1909, vol=1.179000e+03
    or (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   28 and name  HB3)
assign (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   68 and name   HA) 3.904 1.905 1.905 weight 1.000 ! spec=13Cnoesy, no=2313, id=1912, vol=7.497000e+02
assign (segid "   B" and resid   68 and name  HB2) (segid "   B" and resid   68 and name   HA) 3.904 1.905 1.905 weight 1.000 ! spec=13Cnoesy, no=2313, id=1912, vol=7.497000e+02
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name  HD2) 3.685 1.697 1.697 weight 1.000 ! spec=13Cnoesy, no=2320, id=1917, vol=1.081000e+03
assign (segid "   B" and resid   75 and name   HA) (segid "   B" and resid   75 and name  HD2) 3.685 1.697 1.697 weight 1.000 ! spec=13Cnoesy, no=2320, id=1917, vol=1.081000e+03
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name  HB1) 3.593 1.614 1.614 weight 1.000 ! spec=13Cnoesy, no=2321, id=1918, vol=1.485000e+03
assign (segid "   B" and resid   75 and name   HA) (segid "   B" and resid   75 and name  HB1) 3.593 1.614 1.614 weight 1.000 ! spec=13Cnoesy, no=2321, id=1918, vol=1.485000e+03
assign (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name  HG2) 4.001 2.001 2.001 weight 1.000 ! spec=13Cnoesy, no=2322, id=1919, vol=7.819000e+02
assign (segid "   B" and resid  100 and name   HA) (segid "   B" and resid  100 and name  HG2) 4.001 2.001 2.001 weight 1.000 ! spec=13Cnoesy, no=2322, id=1919, vol=7.819000e+02
assign (segid "   A" and resid   88 and name  HG2) (segid "   A" and resid   88 and name  HE2) 2.213 0.612 0.612 weight 1.000 ! spec=13Cnoesy, no=2330, id=1927, vol=5.745000e+03
assign (segid "   B" and resid   88 and name  HG2) (segid "   B" and resid   88 and name  HE2) 2.213 0.612 0.612 weight 1.000 ! spec=13Cnoesy, no=2330, id=1927, vol=5.745000e+03
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name  HB2) 4.035 2.035 2.035 weight 1.000 ! spec=13Cnoesy, no=2332, id=1929, vol=5.843000e+02
assign (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   69 and name  HB2) 4.035 2.035 2.035 weight 1.000 ! spec=13Cnoesy, no=2332, id=1929, vol=5.843000e+02
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name  HD2) 5.490 3.768 3.768 weight 1.000 ! spec=13Cnoesy, no=2333, id=1930, vol=4.898000e+02
assign (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   69 and name  HD2) 5.490 3.768 3.768 weight 1.000 ! spec=13Cnoesy, no=2333, id=1930, vol=4.898000e+02
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name  HD1) 5.808 4.216 4.216 weight 1.000 ! spec=13Cnoesy, no=2335, id=1932, vol=3.847000e+02
assign (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   69 and name  HD1) 5.808 4.216 4.216 weight 1.000 ! spec=13Cnoesy, no=2335, id=1932, vol=3.847000e+02
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name  HG2) 3.374 1.423 1.423 weight 1.000 ! spec=13Cnoesy, no=2338, id=1934, vol=6.311000e+02
assign (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   69 and name  HG2) 3.374 1.423 1.423 weight 1.000 ! spec=13Cnoesy, no=2338, id=1934, vol=6.311000e+02
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name  HG1) 4.703 2.764 2.764 weight 1.000 ! spec=13Cnoesy, no=2339, id=1935, vol=2.771000e+02
assign (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   69 and name  HG1) 4.703 2.764 2.764 weight 1.000 ! spec=13Cnoesy, no=2339, id=1935, vol=2.771000e+02
assign (segid "   A" and resid    5 and name  HD1) (segid "   A" and resid    4 and name  HB2) 3.826 1.829 1.829 weight 1.000 ! spec=13Cnoesy, no=2343, id=1939, vol=1.390000e+03
assign (segid "   B" and resid    5 and name  HD1) (segid "   B" and resid    4 and name  HB2) 3.826 1.829 1.829 weight 1.000 ! spec=13Cnoesy, no=2343, id=1939, vol=1.390000e+03
assign (segid "   A" and resid    5 and name  HD2) (segid "   A" and resid    4 and name  HB2) 5.236 3.427 3.427 weight 1.000 ! spec=13Cnoesy, no=2346, id=1942, vol=7.668000e+02
assign (segid "   B" and resid    5 and name  HD2) (segid "   B" and resid    4 and name  HB2) 5.236 3.427 3.427 weight 1.000 ! spec=13Cnoesy, no=2346, id=1942, vol=7.668000e+02
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    4 and name   HA) 2.987 1.115 1.115 weight 1.000 ! spec=13Cnoesy, no=2347, id=1943, vol=2.776000e+03
assign (segid "   B" and resid    4 and name  HB2) (segid "   B" and resid    4 and name   HA) 2.987 1.115 1.115 weight 1.000 ! spec=13Cnoesy, no=2347, id=1943, vol=2.776000e+03
assign (segid "   A" and resid   23 and name  HA1) (segid "   A" and resid   23 and name  HA2) 2.598 0.843 0.843 weight 1.000 ! spec=13Cnoesy, no=2350, id=1945, vol=1.469000e+03
assign (segid "   B" and resid   23 and name  HA1) (segid "   B" and resid   23 and name  HA2) 2.598 0.843 0.843 weight 1.000 ! spec=13Cnoesy, no=2350, id=1945, vol=1.469000e+03
assign (segid "   A" and resid   23 and name  HA2) (segid "   A" and resid   23 and name   HN) 3.912 1.913 1.913 weight 1.000 ! spec=13Cnoesy, no=2352, id=1947, vol=3.369000e+02
assign (segid "   B" and resid   23 and name  HA2) (segid "   B" and resid   23 and name   HN) 3.912 1.913 1.913 weight 1.000 ! spec=13Cnoesy, no=2352, id=1947, vol=3.369000e+02
assign (segid "   A" and resid   44 and name HD12) (segid "   A" and resid   44 and name HG12) 2.909 1.058 1.058 weight 1.000 ! spec=13Cnoesy, no=2358, id=1951, vol=6.191000e+02
    or (segid "   A" and resid   44 and name HD11) (segid "   A" and resid   44 and name HG12)
    or (segid "   A" and resid   44 and name HD13) (segid "   A" and resid   44 and name HG12)
assign (segid "   B" and resid   44 and name HD12) (segid "   B" and resid   44 and name HG12) 2.909 1.058 1.058 weight 1.000 ! spec=13Cnoesy, no=2358, id=1951, vol=6.191000e+02
    or (segid "   B" and resid   44 and name HD11) (segid "   B" and resid   44 and name HG12)
    or (segid "   B" and resid   44 and name HD13) (segid "   B" and resid   44 and name HG12)
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   65 and name   HA) 4.540 2.576 2.576 weight 1.000 ! spec=13Cnoesy, no=2361, id=1954, vol=8.110000e+02
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   65 and name   HA)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   65 and name   HA)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   65 and name   HA) 4.540 2.576 2.576 weight 1.000 ! spec=13Cnoesy, no=2361, id=1954, vol=8.110000e+02
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   65 and name   HA)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   65 and name   HA)
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   63 and name  HD1) 4.760 2.832 2.832 weight 1.000 ! spec=13Cnoesy, no=2362, id=1955, vol=3.074000e+02
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   63 and name  HD1)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   63 and name  HD1)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   63 and name  HD1) 4.760 2.832 2.832 weight 1.000 ! spec=13Cnoesy, no=2362, id=1955, vol=3.074000e+02
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   63 and name  HD1)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   63 and name  HD1)
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   64 and name HG22) 4.610 2.656 2.656 weight 1.000 ! spec=13Cnoesy, no=2363, id=1956, vol=5.196000e+02
    or (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   64 and name HG23)
assign (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   64 and name HG22) 4.610 2.656 2.656 weight 1.000 ! spec=13Cnoesy, no=2363, id=1956, vol=5.196000e+02
    or (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   64 and name HG23)
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG22) 1.949 0.475 0.475 weight 1.000 ! spec=13Cnoesy, no=2364, id=1957, vol=4.926000e+03
    or (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG23)
assign (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   64 and name HG22) 1.949 0.475 0.475 weight 1.000 ! spec=13Cnoesy, no=2364, id=1957, vol=4.926000e+03
    or (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   64 and name HG23)
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   66 and name   HN) 3.017 1.138 1.138 weight 1.000 ! spec=13Cnoesy, no=2367, id=1960, vol=2.409000e+03
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   66 and name   HN)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   66 and name   HN)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   66 and name   HN) 3.017 1.138 1.138 weight 1.000 ! spec=13Cnoesy, no=2367, id=1960, vol=2.409000e+03
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   66 and name   HN)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   66 and name   HN)
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name HG22) 3.185 1.268 1.268 weight 1.000 ! spec=13Cnoesy, no=2368, id=1961, vol=2.026000e+03
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name HG23)
assign (segid "   B" and resid   64 and name   HA) (segid "   B" and resid   64 and name HG22) 3.185 1.268 1.268 weight 1.000 ! spec=13Cnoesy, no=2368, id=1961, vol=2.026000e+03
    or (segid "   B" and resid   64 and name   HA) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   64 and name   HA) (segid "   B" and resid   64 and name HG23)
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   64 and name HG22) 2.613 0.853 0.853 weight 1.000 ! spec=13Cnoesy, no=2370, id=1963, vol=2.128000e+03
    or (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   64 and name HG23)
assign (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   64 and name HG22) 2.613 0.853 0.853 weight 1.000 ! spec=13Cnoesy, no=2370, id=1963, vol=2.128000e+03
    or (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   64 and name HG21)
    or (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   64 and name HG23)
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   66 and name  HB1) 3.846 1.849 1.849 weight 1.000 ! spec=13Cnoesy, no=2372, id=1965, vol=9.151000e+02
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   66 and name  HB1)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   66 and name  HB1)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   66 and name  HB1) 3.846 1.849 1.849 weight 1.000 ! spec=13Cnoesy, no=2372, id=1965, vol=9.151000e+02
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   66 and name  HB1)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   66 and name  HB1)
assign (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   96 and name   HA) 3.103 1.203 1.203 weight 1.000 ! spec=13Cnoesy, no=2379, id=1969, vol=1.595000e+03
assign (segid "   B" and resid   96 and name  HB1) (segid "   B" and resid   96 and name   HA) 3.103 1.203 1.203 weight 1.000 ! spec=13Cnoesy, no=2379, id=1969, vol=1.595000e+03
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name  HB2) 1.819 0.414 0.414 weight 1.000 ! spec=13Cnoesy, no=2380, id=1970, vol=6.958000e+03
assign (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   55 and name  HB2) 1.819 0.414 0.414 weight 1.000 ! spec=13Cnoesy, no=2380, id=1970, vol=6.958000e+03
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name  HB2) 2.766 0.956 0.956 weight 1.000 ! spec=13Cnoesy, no=2381, id=1971, vol=2.327000e+03
assign (segid "   B" and resid   55 and name   HA) (segid "   B" and resid   55 and name  HB2) 2.766 0.956 0.956 weight 1.000 ! spec=13Cnoesy, no=2381, id=1971, vol=2.327000e+03
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name   HN) 3.762 1.769 1.769 weight 1.000 ! spec=13Cnoesy, no=2384, id=1974, vol=2.418000e+03
assign (segid "   B" and resid   55 and name  HB2) (segid "   B" and resid   55 and name   HN) 3.762 1.769 1.769 weight 1.000 ! spec=13Cnoesy, no=2384, id=1974, vol=2.418000e+03
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   87 and name HG22) 3.366 1.416 1.416 weight 1.000 ! spec=13Cnoesy, no=2385, id=1975, vol=4.744000e+03
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   87 and name HG23)
assign (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   87 and name HG22) 3.366 1.416 1.416 weight 1.000 ! spec=13Cnoesy, no=2385, id=1975, vol=4.744000e+03
    or (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   87 and name HG23)
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   87 and name HG22) 4.462 2.488 2.488 weight 1.000 ! spec=13Cnoesy, no=2387, id=1977, vol=9.606000e+02
    or (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   87 and name HG23)
assign (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   87 and name HG22) 4.462 2.488 2.488 weight 1.000 ! spec=13Cnoesy, no=2387, id=1977, vol=9.606000e+02
    or (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   87 and name HG23)
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   87 and name HG22) 4.197 2.201 2.201 weight 1.000 ! spec=13Cnoesy, no=2389, id=1979, vol=9.037000e+02
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   87 and name HG23)
assign (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   87 and name HG22) 4.197 2.201 2.201 weight 1.000 ! spec=13Cnoesy, no=2389, id=1979, vol=9.037000e+02
    or (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   87 and name HG23)
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name HG22) 3.155 1.244 1.244 weight 1.000 ! spec=13Cnoesy, no=2391, id=1981, vol=2.196000e+03
    or (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name HG21)
    or (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name HG23)
assign (segid "   B" and resid   87 and name   HA) (segid "   B" and resid   87 and name HG22) 3.155 1.244 1.244 weight 1.000 ! spec=13Cnoesy, no=2391, id=1981, vol=2.196000e+03
    or (segid "   B" and resid   87 and name   HA) (segid "   B" and resid   87 and name HG21)
    or (segid "   B" and resid   87 and name   HA) (segid "   B" and resid   87 and name HG23)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name   HB) 2.745 0.942 0.942 weight 1.000 ! spec=13Cnoesy, no=2400, id=1988, vol=2.193000e+03
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name   HB) 2.745 0.942 0.942 weight 1.000 ! spec=13Cnoesy, no=2400, id=1988, vol=2.193000e+03
assign (segid "   A" and resid    6 and name   HB) (segid "   A" and resid    7 and name   HN) 3.613 1.632 1.632 weight 1.000 ! spec=13Cnoesy, no=2406, id=1992, vol=1.358000e+03
assign (segid "   B" and resid    6 and name   HB) (segid "   B" and resid    7 and name   HN) 3.613 1.632 1.632 weight 1.000 ! spec=13Cnoesy, no=2406, id=1992, vol=1.358000e+03
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   47 and name  HB2) 3.362 1.413 1.413 weight 1.000 ! spec=13Cnoesy, no=2415, id=2000, vol=6.127000e+02
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   47 and name  HB2) 3.362 1.413 1.413 weight 1.000 ! spec=13Cnoesy, no=2415, id=2000, vol=6.127000e+02
assign (segid "   A" and resid  115 and name  HB2) (segid "   A" and resid  115 and name   HA) 3.644 1.660 1.660 weight 1.000 ! spec=13Cnoesy, no=2422, id=2005, vol=5.125000e+02
assign (segid "   B" and resid  115 and name  HB2) (segid "   B" and resid  115 and name   HA) 3.644 1.660 1.660 weight 1.000 ! spec=13Cnoesy, no=2422, id=2005, vol=5.125000e+02
assign (segid "   A" and resid  115 and name  HG2) (segid "   A" and resid  115 and name  HB2) 2.748 0.944 0.944 weight 1.000 ! spec=13Cnoesy, no=2423, id=2006, vol=5.697000e+03
assign (segid "   B" and resid  115 and name  HG2) (segid "   B" and resid  115 and name  HB2) 2.748 0.944 0.944 weight 1.000 ! spec=13Cnoesy, no=2423, id=2006, vol=5.697000e+03
assign (segid "   A" and resid  115 and name  HB2) (segid "   A" and resid  115 and name   HN) 5.429 3.685 3.685 weight 1.000 ! spec=13Cnoesy, no=2425, id=2008, vol=2.512000e+02
assign (segid "   B" and resid  115 and name  HB2) (segid "   B" and resid  115 and name   HN) 5.429 3.685 3.685 weight 1.000 ! spec=13Cnoesy, no=2425, id=2008, vol=2.512000e+02
assign (segid "   A" and resid  115 and name  HB2) (segid "   A" and resid  115 and name  HB1) 1.596 0.319 0.319 weight 1.000 ! spec=13Cnoesy, no=2427, id=2010, vol=1.008000e+04
assign (segid "   B" and resid  115 and name  HB2) (segid "   B" and resid  115 and name  HB1) 1.596 0.319 0.319 weight 1.000 ! spec=13Cnoesy, no=2427, id=2010, vol=1.008000e+04
assign (segid "   A" and resid   63 and name  HG1) (segid "   A" and resid   63 and name   HA) 4.017 2.017 2.017 weight 1.000 ! spec=13Cnoesy, no=2434, id=2016, vol=2.287000e+03
assign (segid "   B" and resid   63 and name  HG1) (segid "   B" and resid   63 and name   HA) 4.017 2.017 2.017 weight 1.000 ! spec=13Cnoesy, no=2434, id=2016, vol=2.287000e+03
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   63 and name   HA) 3.356 1.408 1.408 weight 1.000 ! spec=13Cnoesy, no=2437, id=2019, vol=2.287000e+03
assign (segid "   B" and resid   63 and name  HB2) (segid "   B" and resid   63 and name   HA) 3.356 1.408 1.408 weight 1.000 ! spec=13Cnoesy, no=2437, id=2019, vol=2.287000e+03
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name  HB1) 2.565 0.822 0.822 weight 1.000 ! spec=13Cnoesy, no=2439, id=2021, vol=5.637000e+02
assign (segid "   B" and resid   90 and name  HB2) (segid "   B" and resid   90 and name  HB1) 2.565 0.822 0.822 weight 1.000 ! spec=13Cnoesy, no=2439, id=2021, vol=5.637000e+02
assign (segid "   A" and resid   90 and name   HG) (segid "   A" and resid   90 and name  HB1) 3.696 1.707 1.707 weight 1.000 ! spec=13Cnoesy, no=2440, id=2022, vol=4.606000e+02
assign (segid "   B" and resid   90 and name   HG) (segid "   B" and resid   90 and name  HB1) 3.696 1.707 1.707 weight 1.000 ! spec=13Cnoesy, no=2440, id=2022, vol=4.606000e+02
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name  HB1) 1.718 0.369 0.369 weight 1.000 ! spec=13Cnoesy, no=2441, id=2023, vol=8.522000e+03
assign (segid "   B" and resid   95 and name  HB2) (segid "   B" and resid   95 and name  HB1) 1.718 0.369 0.369 weight 1.000 ! spec=13Cnoesy, no=2441, id=2023, vol=8.522000e+03
assign (segid "   A" and resid   90 and name HD12) (segid "   A" and resid   99 and name  HD1) 3.926 1.926 1.926 weight 1.000 ! spec=13Cnoesy, no=2446, id=2027, vol=4.549000e+02
    or (segid "   A" and resid   90 and name HD11) (segid "   A" and resid   99 and name  HD1)
    or (segid "   A" and resid   90 and name HD13) (segid "   A" and resid   99 and name  HD1)
assign (segid "   B" and resid   90 and name HD12) (segid "   B" and resid   99 and name  HD1) 3.926 1.926 1.926 weight 1.000 ! spec=13Cnoesy, no=2446, id=2027, vol=4.549000e+02
    or (segid "   B" and resid   90 and name HD11) (segid "   B" and resid   99 and name  HD1)
    or (segid "   B" and resid   90 and name HD13) (segid "   B" and resid   99 and name  HD1)
assign (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   90 and name HD12) 2.015 0.507 0.507 weight 1.000 ! spec=13Cnoesy, no=2447, id=2028, vol=2.507000e+03
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   90 and name HD11)
    or (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   90 and name HD13)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   90 and name HD12)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   90 and name HD11)
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   90 and name HD13)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   90 and name HD12)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   90 and name HD11)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   90 and name HD13)
assign (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   90 and name HD12) 2.015 0.507 0.507 weight 1.000 ! spec=13Cnoesy, no=2447, id=2028, vol=2.507000e+03
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   90 and name HD11)
    or (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   90 and name HD13)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   90 and name HD12)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   90 and name HD11)
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   90 and name HD13)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   90 and name HD12)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   90 and name HD11)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   90 and name HD13)
assign (segid "   A" and resid   90 and name HD12) (segid "   A" and resid   89 and name   HN) 4.509 2.542 2.542 weight 1.000 ! spec=13Cnoesy, no=2449, id=2030, vol=4.976000e+02
    or (segid "   A" and resid   90 and name HD11) (segid "   A" and resid   89 and name   HN)
    or (segid "   A" and resid   90 and name HD13) (segid "   A" and resid   89 and name   HN)
assign (segid "   B" and resid   90 and name HD12) (segid "   B" and resid   89 and name   HN) 4.509 2.542 2.542 weight 1.000 ! spec=13Cnoesy, no=2449, id=2030, vol=4.976000e+02
    or (segid "   B" and resid   90 and name HD11) (segid "   B" and resid   89 and name   HN)
    or (segid "   B" and resid   90 and name HD13) (segid "   B" and resid   89 and name   HN)
assign (segid "   A" and resid   90 and name   HG) (segid "   A" and resid   90 and name HD12) 2.205 0.608 0.608 weight 1.000 ! spec=13Cnoesy, no=2452, id=2031, vol=1.784000e+03
    or (segid "   A" and resid   90 and name   HG) (segid "   A" and resid   90 and name HD11)
    or (segid "   A" and resid   90 and name   HG) (segid "   A" and resid   90 and name HD13)
assign (segid "   B" and resid   90 and name   HG) (segid "   B" and resid   90 and name HD12) 2.205 0.608 0.608 weight 1.000 ! spec=13Cnoesy, no=2452, id=2031, vol=1.784000e+03
    or (segid "   B" and resid   90 and name   HG) (segid "   B" and resid   90 and name HD11)
    or (segid "   B" and resid   90 and name   HG) (segid "   B" and resid   90 and name HD13)
assign (segid "   A" and resid   90 and name HD12) (segid "   A" and resid  100 and name  HG2) 4.172 2.176 2.176 weight 1.000 ! spec=13Cnoesy, no=2453, id=2032, vol=7.055000e+02
    or (segid "   A" and resid   90 and name HD11) (segid "   A" and resid  100 and name  HG2)
    or (segid "   A" and resid   90 and name HD13) (segid "   A" and resid  100 and name  HG2)
assign (segid "   B" and resid   90 and name HD12) (segid "   B" and resid  100 and name  HG2) 4.172 2.176 2.176 weight 1.000 ! spec=13Cnoesy, no=2453, id=2032, vol=7.055000e+02
    or (segid "   B" and resid   90 and name HD11) (segid "   B" and resid  100 and name  HG2)
    or (segid "   B" and resid   90 and name HD13) (segid "   B" and resid  100 and name  HG2)
assign (segid "   A" and resid    5 and name  HG2) (segid "   A" and resid    4 and name   HA) 4.763 2.836 2.836 weight 1.000 ! spec=13Cnoesy, no=2461, id=2037, vol=1.714000e+03
assign (segid "   B" and resid    5 and name  HG2) (segid "   B" and resid    4 and name   HA) 4.763 2.836 2.836 weight 1.000 ! spec=13Cnoesy, no=2461, id=2037, vol=1.714000e+03
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name  HB1) 2.707 0.916 0.916 weight 1.000 ! spec=13Cnoesy, no=2465, id=2041, vol=1.091000e+03
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   19 and name  HB1) 2.707 0.916 0.916 weight 1.000 ! spec=13Cnoesy, no=2465, id=2041, vol=1.091000e+03
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   19 and name  HB1) 5.441 3.701 3.701 weight 1.000 ! spec=13Cnoesy, no=2469, id=2045, vol=3.942000e+02
assign (segid "   B" and resid   18 and name   HA) (segid "   B" and resid   19 and name  HB1) 5.441 3.701 3.701 weight 1.000 ! spec=13Cnoesy, no=2469, id=2045, vol=3.942000e+02
assign (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   37 and name   HB) 4.577 2.619 2.619 weight 1.000 ! spec=13Cnoesy, no=2472, id=2047, vol=7.065000e+02
assign (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   37 and name   HB) 4.577 2.619 2.619 weight 1.000 ! spec=13Cnoesy, no=2472, id=2047, vol=7.065000e+02
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name   HB) 2.981 1.111 1.111 weight 1.000 ! spec=13Cnoesy, no=2474, id=2049, vol=1.246000e+03
assign (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name   HB) 2.981 1.111 1.111 weight 1.000 ! spec=13Cnoesy, no=2474, id=2049, vol=1.246000e+03
assign (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   92 and name HG21) 4.590 2.634 2.634 weight 1.000 ! spec=13Cnoesy, no=2476, id=2051, vol=7.547000e+02
    or (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   92 and name HG22)
    or (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   92 and name HG23)
assign (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   92 and name HG21) 4.590 2.634 2.634 weight 1.000 ! spec=13Cnoesy, no=2476, id=2051, vol=7.547000e+02
    or (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   92 and name HG22)
    or (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   92 and name HG23)
assign (segid "   A" and resid   91 and name   HB) (segid "   A" and resid   36 and name   HB) 2.824 0.997 0.997 weight 1.000 ! spec=13Cnoesy, no=2477, id=2052, vol=6.492000e+02
assign (segid "   B" and resid   91 and name   HB) (segid "   B" and resid   36 and name   HB) 2.824 0.997 0.997 weight 1.000 ! spec=13Cnoesy, no=2477, id=2052, vol=6.492000e+02
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name HG22) 2.922 1.067 1.067 weight 1.000 ! spec=13Cnoesy, no=2482, id=2057, vol=3.463000e+03
    or (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name HG21)
    or (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name HG23)
assign (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name HG22) 2.922 1.067 1.067 weight 1.000 ! spec=13Cnoesy, no=2482, id=2057, vol=3.463000e+03
    or (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name HG21)
    or (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name HG23)
assign (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   36 and name HG22) 3.662 1.676 1.676 weight 1.000 ! spec=13Cnoesy, no=2484, id=2059, vol=1.844000e+03
    or (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   36 and name HG21)
    or (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   36 and name HG23)
assign (segid "   B" and resid   93 and name  HB2) (segid "   B" and resid   36 and name HG22) 3.662 1.676 1.676 weight 1.000 ! spec=13Cnoesy, no=2484, id=2059, vol=1.844000e+03
    or (segid "   B" and resid   93 and name  HB2) (segid "   B" and resid   36 and name HG21)
    or (segid "   B" and resid   93 and name  HB2) (segid "   B" and resid   36 and name HG23)
assign (segid "   A" and resid   36 and name HG22) (segid "   A" and resid   35 and name   HN) 3.570 1.593 1.593 weight 1.000 ! spec=13Cnoesy, no=2485, id=2060, vol=1.753000e+03
    or (segid "   A" and resid   36 and name HG21) (segid "   A" and resid   35 and name   HN)
    or (segid "   A" and resid   36 and name HG23) (segid "   A" and resid   35 and name   HN)
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   35 and name   HN) 3.570 1.593 1.593 weight 1.000 ! spec=13Cnoesy, no=2485, id=2060, vol=1.753000e+03
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   35 and name   HN)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   35 and name   HN)
assign (segid "   A" and resid   36 and name HG22) (segid "   A" and resid   35 and name  HB2) 4.636 2.687 2.687 weight 1.000 ! spec=13Cnoesy, no=2488, id=2063, vol=1.107000e+03
    or (segid "   A" and resid   36 and name HG21) (segid "   A" and resid   35 and name  HB2)
    or (segid "   A" and resid   36 and name HG23) (segid "   A" and resid   35 and name  HB2)
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   35 and name  HB2) 4.636 2.687 2.687 weight 1.000 ! spec=13Cnoesy, no=2488, id=2063, vol=1.107000e+03
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   35 and name  HB2)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   35 and name  HB2)
assign (segid "   A" and resid  117 and name HG21) (segid "   A" and resid  117 and name   HA) 2.587 0.836 0.836 weight 1.000 ! spec=13Cnoesy, no=2490, id=2065, vol=4.227000e+03
    or (segid "   A" and resid  117 and name HG22) (segid "   A" and resid  117 and name   HA)
    or (segid "   A" and resid  117 and name HG23) (segid "   A" and resid  117 and name   HA)
assign (segid "   B" and resid  117 and name HG21) (segid "   B" and resid  117 and name   HA) 2.587 0.836 0.836 weight 1.000 ! spec=13Cnoesy, no=2490, id=2065, vol=4.227000e+03
    or (segid "   B" and resid  117 and name HG22) (segid "   B" and resid  117 and name   HA)
    or (segid "   B" and resid  117 and name HG23) (segid "   B" and resid  117 and name   HA)
assign (segid "   A" and resid  117 and name   HB) (segid "   A" and resid  117 and name   HA) 1.650 1.650 4.350 weight 1.000 ! spec=13Cnoesy, no=2491, id=2066, vol=6.481000e+04
assign (segid "   B" and resid  117 and name   HB) (segid "   B" and resid  117 and name   HA) 1.650 1.650 4.350 weight 1.000 ! spec=13Cnoesy, no=2491, id=2066, vol=6.481000e+04
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name  HE1) 5.145 3.309 3.309 weight 1.000 ! spec=13Cnoesy, no=2505, id=2073, vol=4.876000e+02
assign (segid "   B" and resid   53 and name  HB2) (segid "   B" and resid   53 and name  HE1) 5.145 3.309 3.309 weight 1.000 ! spec=13Cnoesy, no=2505, id=2073, vol=4.876000e+02
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   21 and name  HB2) 5.021 3.151 3.151 weight 1.000 ! spec=13Cnoesy, no=2519, id=2085, vol=6.042000e+02
assign (segid "   B" and resid   20 and name   HB) (segid "   B" and resid   21 and name  HB2) 5.021 3.151 3.151 weight 1.000 ! spec=13Cnoesy, no=2519, id=2085, vol=6.042000e+02
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   20 and name   HB) 1.555 1.555 4.445 weight 1.000 ! spec=13Cnoesy, no=2520, id=2086, vol=1.404000e+04
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   20 and name   HB)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   20 and name   HB)
assign (segid "   B" and resid   20 and name HG12) (segid "   B" and resid   20 and name   HB) 1.555 1.555 4.445 weight 1.000 ! spec=13Cnoesy, no=2520, id=2086, vol=1.404000e+04
    or (segid "   B" and resid   20 and name HG11) (segid "   B" and resid   20 and name   HB)
    or (segid "   B" and resid   20 and name HG13) (segid "   B" and resid   20 and name   HB)
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name   HB) 2.438 0.743 0.743 weight 1.000 ! spec=13Cnoesy, no=2522, id=2088, vol=5.199000e+03
assign (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   20 and name   HB) 2.438 0.743 0.743 weight 1.000 ! spec=13Cnoesy, no=2522, id=2088, vol=5.199000e+03
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   19 and name   HA) 5.149 3.314 3.314 weight 1.000 ! spec=13Cnoesy, no=2523, id=2089, vol=4.713000e+02
assign (segid "   B" and resid   20 and name   HB) (segid "   B" and resid   19 and name   HA) 5.149 3.314 3.314 weight 1.000 ! spec=13Cnoesy, no=2523, id=2089, vol=4.713000e+02
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG22) 1.588 1.588 4.412 weight 1.000 ! spec=13Cnoesy, no=2524, id=2090, vol=1.319000e+04
    or (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG21)
    or (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG23)
assign (segid "   B" and resid   20 and name   HB) (segid "   B" and resid   20 and name HG22) 1.588 1.588 4.412 weight 1.000 ! spec=13Cnoesy, no=2524, id=2090, vol=1.319000e+04
    or (segid "   B" and resid   20 and name   HB) (segid "   B" and resid   20 and name HG21)
    or (segid "   B" and resid   20 and name   HB) (segid "   B" and resid   20 and name HG23)
assign (segid "   A" and resid  111 and name   HA) (segid "   A" and resid  111 and name HG22) 3.294 1.356 1.356 weight 1.000 ! spec=13Cnoesy, no=2525, id=2091, vol=1.810000e+03
    or (segid "   A" and resid  111 and name   HA) (segid "   A" and resid  111 and name HG21)
    or (segid "   A" and resid  111 and name   HA) (segid "   A" and resid  111 and name HG23)
assign (segid "   B" and resid  111 and name   HA) (segid "   B" and resid  111 and name HG22) 3.294 1.356 1.356 weight 1.000 ! spec=13Cnoesy, no=2525, id=2091, vol=1.810000e+03
    or (segid "   B" and resid  111 and name   HA) (segid "   B" and resid  111 and name HG21)
    or (segid "   B" and resid  111 and name   HA) (segid "   B" and resid  111 and name HG23)
assign (segid "   A" and resid  111 and name HG22) (segid "   A" and resid  112 and name   HN) 3.317 1.375 1.375 weight 1.000 ! spec=13Cnoesy, no=2528, id=2094, vol=2.009000e+03
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid  112 and name   HN)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid  112 and name   HN)
assign (segid "   B" and resid  111 and name HG22) (segid "   B" and resid  112 and name   HN) 3.317 1.375 1.375 weight 1.000 ! spec=13Cnoesy, no=2528, id=2094, vol=2.009000e+03
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid  112 and name   HN)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid  112 and name   HN)
assign (segid "   A" and resid  111 and name HG22) (segid "   A" and resid   62 and name HD22) 4.924 3.031 3.031 weight 1.000 ! spec=13Cnoesy, no=2536, id=2102, vol=9.094000e+02
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid   62 and name HD22)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid   62 and name HD22)
assign (segid "   B" and resid  111 and name HG22) (segid "   B" and resid   62 and name HD22) 4.924 3.031 3.031 weight 1.000 ! spec=13Cnoesy, no=2536, id=2102, vol=9.094000e+02
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid   62 and name HD22)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid   62 and name HD22)
assign (segid "   A" and resid   92 and name HG21) (segid "   A" and resid   92 and name   HB) 2.023 0.512 0.512 weight 1.000 ! spec=13Cnoesy, no=2545, id=2107, vol=4.449000e+03
    or (segid "   A" and resid   92 and name HG22) (segid "   A" and resid   92 and name   HB)
    or (segid "   A" and resid   92 and name HG23) (segid "   A" and resid   92 and name   HB)
assign (segid "   B" and resid   92 and name HG21) (segid "   B" and resid   92 and name   HB) 2.023 0.512 0.512 weight 1.000 ! spec=13Cnoesy, no=2545, id=2107, vol=4.449000e+03
    or (segid "   B" and resid   92 and name HG22) (segid "   B" and resid   92 and name   HB)
    or (segid "   B" and resid   92 and name HG23) (segid "   B" and resid   92 and name   HB)
assign (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   92 and name   HB) 5.021 3.152 3.152 weight 1.000 ! spec=13Cnoesy, no=2547, id=2109, vol=7.376000e+02
assign (segid "   B" and resid   98 and name   HA) (segid "   B" and resid   92 and name   HB) 5.021 3.152 3.152 weight 1.000 ! spec=13Cnoesy, no=2547, id=2109, vol=7.376000e+02
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   92 and name   HB) 2.952 1.089 1.089 weight 1.000 ! spec=13Cnoesy, no=2548, id=2110, vol=1.734000e+03
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   92 and name   HB)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   92 and name   HB)
assign (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   92 and name   HB) 2.952 1.089 1.089 weight 1.000 ! spec=13Cnoesy, no=2548, id=2110, vol=1.734000e+03
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   92 and name   HB)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   92 and name   HB)
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name   HB) 2.865 1.026 1.026 weight 1.000 ! spec=13Cnoesy, no=2549, id=2111, vol=1.473000e+03
assign (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   92 and name   HB) 2.865 1.026 1.026 weight 1.000 ! spec=13Cnoesy, no=2549, id=2111, vol=1.473000e+03
assign (segid "   A" and resid   92 and name   HB) (segid "   A" and resid   91 and name   HB) 4.529 2.564 2.564 weight 1.000 ! spec=13Cnoesy, no=2551, id=2113, vol=6.904000e+02
assign (segid "   B" and resid   92 and name   HB) (segid "   B" and resid   91 and name   HB) 4.529 2.564 2.564 weight 1.000 ! spec=13Cnoesy, no=2551, id=2113, vol=6.904000e+02
assign (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   69 and name  HG2) 3.007 1.131 1.131 weight 1.000 ! spec=13Cnoesy, no=2561, id=2117, vol=1.306000e+03
assign (segid "   B" and resid   69 and name  HB1) (segid "   B" and resid   69 and name  HG2) 3.007 1.131 1.131 weight 1.000 ! spec=13Cnoesy, no=2561, id=2117, vol=1.306000e+03
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   30 and name  HB2) 2.588 0.837 0.837 weight 1.000 ! spec=13Cnoesy, no=2571, id=2124, vol=2.595000e+03
assign (segid "   B" and resid   32 and name  HB2) (segid "   B" and resid   30 and name  HB2) 2.588 0.837 0.837 weight 1.000 ! spec=13Cnoesy, no=2571, id=2124, vol=2.595000e+03
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name  HB2) 3.426 1.467 1.467 weight 1.000 ! spec=13Cnoesy, no=2576, id=2129, vol=2.009000e+03
assign (segid "   B" and resid   24 and name   HA) (segid "   B" and resid   24 and name  HB2) 3.426 1.467 1.467 weight 1.000 ! spec=13Cnoesy, no=2576, id=2129, vol=2.009000e+03
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   59 and name  HG1) 2.022 0.511 0.511 weight 1.000 ! spec=13Cnoesy, no=2579, id=2132, vol=4.886000e+03
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   59 and name  HG1) 2.022 0.511 0.511 weight 1.000 ! spec=13Cnoesy, no=2579, id=2132, vol=4.886000e+03
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name  HG1) 2.456 0.754 0.754 weight 1.000 ! spec=13Cnoesy, no=2581, id=2134, vol=1.159000e+04
assign (segid "   B" and resid   59 and name  HB2) (segid "   B" and resid   59 and name  HG1) 2.456 0.754 0.754 weight 1.000 ! spec=13Cnoesy, no=2581, id=2134, vol=1.159000e+04
assign (segid "   A" and resid   59 and name  HD2) (segid "   A" and resid   59 and name  HG1) 2.480 0.769 0.769 weight 1.000 ! spec=13Cnoesy, no=2582, id=2135, vol=4.085000e+03
assign (segid "   B" and resid   59 and name  HD2) (segid "   B" and resid   59 and name  HG1) 2.480 0.769 0.769 weight 1.000 ! spec=13Cnoesy, no=2582, id=2135, vol=4.085000e+03
assign (segid "   A" and resid   59 and name  HG1) (segid "   A" and resid   18 and name   HN) 3.188 1.270 1.270 weight 1.000 ! spec=13Cnoesy, no=2584, id=2137, vol=9.080000e+02
assign (segid "   B" and resid   59 and name  HG1) (segid "   B" and resid   18 and name   HN) 3.188 1.270 1.270 weight 1.000 ! spec=13Cnoesy, no=2584, id=2137, vol=9.080000e+02
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name  HG1) 1.543 0.298 0.298 weight 1.000 ! spec=13Cnoesy, no=2586, id=2139, vol=1.159000e+04
assign (segid "   B" and resid   59 and name  HG2) (segid "   B" and resid   59 and name  HG1) 1.543 0.298 0.298 weight 1.000 ! spec=13Cnoesy, no=2586, id=2139, vol=1.159000e+04
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   71 and name   HB) 3.279 1.344 1.344 weight 1.000 ! spec=13Cnoesy, no=2592, id=2144, vol=1.781000e+03
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   71 and name   HB)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   71 and name   HB)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   71 and name   HB) 3.279 1.344 1.344 weight 1.000 ! spec=13Cnoesy, no=2592, id=2144, vol=1.781000e+03
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   71 and name   HB)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   71 and name   HB)
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid   71 and name   HB) 3.272 1.338 1.338 weight 1.000 ! spec=13Cnoesy, no=2593, id=2145, vol=1.666000e+03
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid   71 and name   HB)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid   71 and name   HB)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid   71 and name   HB) 3.272 1.338 1.338 weight 1.000 ! spec=13Cnoesy, no=2593, id=2145, vol=1.666000e+03
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid   71 and name   HB)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid   71 and name   HB)
assign (segid "   A" and resid   71 and name HG22) (segid "   A" and resid   71 and name   HB) 2.288 0.654 0.654 weight 1.000 ! spec=13Cnoesy, no=2594, id=2146, vol=1.983000e+03
    or (segid "   A" and resid   71 and name HG21) (segid "   A" and resid   71 and name   HB)
    or (segid "   A" and resid   71 and name HG23) (segid "   A" and resid   71 and name   HB)
assign (segid "   B" and resid   71 and name HG22) (segid "   B" and resid   71 and name   HB) 2.288 0.654 0.654 weight 1.000 ! spec=13Cnoesy, no=2594, id=2146, vol=1.983000e+03
    or (segid "   B" and resid   71 and name HG21) (segid "   B" and resid   71 and name   HB)
    or (segid "   B" and resid   71 and name HG23) (segid "   B" and resid   71 and name   HB)
assign (segid "   A" and resid   71 and name   HB) (segid "   A" and resid   71 and name HG11) 2.584 0.835 0.835 weight 1.000 ! spec=13Cnoesy, no=2596, id=2148, vol=2.000000e+03
assign (segid "   B" and resid   71 and name   HB) (segid "   B" and resid   71 and name HG11) 2.584 0.835 0.835 weight 1.000 ! spec=13Cnoesy, no=2596, id=2148, vol=2.000000e+03
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name   HA) 2.476 0.766 0.766 weight 1.000 ! spec=13Cnoesy, no=2597, id=2149, vol=5.648000e+03
assign (segid "   B" and resid   95 and name  HB2) (segid "   B" and resid   95 and name   HA) 2.476 0.766 0.766 weight 1.000 ! spec=13Cnoesy, no=2597, id=2149, vol=5.648000e+03
assign (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   95 and name   HA) 2.926 1.070 1.070 weight 1.000 ! spec=13Cnoesy, no=2598, id=2150, vol=3.693000e+03
assign (segid "   B" and resid   95 and name  HG2) (segid "   B" and resid   95 and name   HA) 2.926 1.070 1.070 weight 1.000 ! spec=13Cnoesy, no=2598, id=2150, vol=3.693000e+03
assign (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   95 and name   HA) 3.689 1.701 1.701 weight 1.000 ! spec=13Cnoesy, no=2601, id=2153, vol=9.392000e+02
assign (segid "   B" and resid   95 and name  HB1) (segid "   B" and resid   95 and name   HA) 3.689 1.701 1.701 weight 1.000 ! spec=13Cnoesy, no=2601, id=2153, vol=9.392000e+02
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   12 and name   HA) 3.173 1.259 1.259 weight 1.000 ! spec=13Cnoesy, no=2608, id=2158, vol=1.390000e+03
assign (segid "   B" and resid   12 and name  HB1) (segid "   B" and resid   12 and name   HA) 3.173 1.259 1.259 weight 1.000 ! spec=13Cnoesy, no=2608, id=2158, vol=1.390000e+03
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   12 and name   HN) 4.168 2.172 2.172 weight 1.000 ! spec=13Cnoesy, no=2609, id=2159, vol=1.483000e+03
assign (segid "   B" and resid   12 and name  HB1) (segid "   B" and resid   12 and name   HN) 4.168 2.172 2.172 weight 1.000 ! spec=13Cnoesy, no=2609, id=2159, vol=1.483000e+03
assign (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   42 and name HG12) 1.813 0.411 0.411 weight 1.000 ! spec=13Cnoesy, no=2620, id=2165, vol=6.219000e+03
    or (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   42 and name HG11)
    or (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   42 and name HG13)
assign (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   42 and name HG12) 1.813 0.411 0.411 weight 1.000 ! spec=13Cnoesy, no=2620, id=2165, vol=6.219000e+03
    or (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   42 and name HG11)
    or (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   42 and name HG13)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG12) 2.467 0.761 0.761 weight 1.000 ! spec=13Cnoesy, no=2621, id=2166, vol=2.020000e+03
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG11)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HG13)
assign (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name HG12) 2.467 0.761 0.761 weight 1.000 ! spec=13Cnoesy, no=2621, id=2166, vol=2.020000e+03
    or (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name HG11)
    or (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name HG13)
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   42 and name HG12) 3.944 1.945 1.945 weight 1.000 ! spec=13Cnoesy, no=2622, id=2167, vol=1.686000e+03
    or (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   42 and name HG11)
    or (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   42 and name HG13)
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   42 and name HG12) 3.944 1.945 1.945 weight 1.000 ! spec=13Cnoesy, no=2622, id=2167, vol=1.686000e+03
    or (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   42 and name HG11)
    or (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   42 and name HG13)
assign (segid "   A" and resid   42 and name HG12) (segid "   A" and resid   99 and name  HZ3) 3.071 1.179 1.179 weight 1.000 ! spec=13Cnoesy, no=2623, id=2168, vol=1.360000e+03
    or (segid "   A" and resid   42 and name HG11) (segid "   A" and resid   99 and name  HZ3)
    or (segid "   A" and resid   42 and name HG13) (segid "   A" and resid   99 and name  HZ3)
assign (segid "   B" and resid   42 and name HG12) (segid "   B" and resid   99 and name  HZ3) 3.071 1.179 1.179 weight 1.000 ! spec=13Cnoesy, no=2623, id=2168, vol=1.360000e+03
    or (segid "   B" and resid   42 and name HG11) (segid "   B" and resid   99 and name  HZ3)
    or (segid "   B" and resid   42 and name HG13) (segid "   B" and resid   99 and name  HZ3)
assign (segid "   A" and resid   42 and name HG12) (segid "   A" and resid   42 and name   HN) 2.644 0.874 0.874 weight 1.000 ! spec=13Cnoesy, no=2624, id=2169, vol=2.193000e+03
    or (segid "   A" and resid   42 and name HG11) (segid "   A" and resid   42 and name   HN)
    or (segid "   A" and resid   42 and name HG13) (segid "   A" and resid   42 and name   HN)
assign (segid "   B" and resid   42 and name HG12) (segid "   B" and resid   42 and name   HN) 2.644 0.874 0.874 weight 1.000 ! spec=13Cnoesy, no=2624, id=2169, vol=2.193000e+03
    or (segid "   B" and resid   42 and name HG11) (segid "   B" and resid   42 and name   HN)
    or (segid "   B" and resid   42 and name HG13) (segid "   B" and resid   42 and name   HN)
assign (segid "   A" and resid   90 and name HD12) (segid "   A" and resid   42 and name HG12) 1.912 1.912 4.088 weight 1.000 ! spec=13Cnoesy, no=2626, id=2171, vol=8.954000e+03
    or (segid "   A" and resid   90 and name HD12) (segid "   A" and resid   42 and name HG11)
    or (segid "   A" and resid   90 and name HD12) (segid "   A" and resid   42 and name HG13)
    or (segid "   A" and resid   90 and name HD11) (segid "   A" and resid   42 and name HG12)
    or (segid "   A" and resid   90 and name HD11) (segid "   A" and resid   42 and name HG11)
    or (segid "   A" and resid   90 and name HD11) (segid "   A" and resid   42 and name HG13)
    or (segid "   A" and resid   90 and name HD13) (segid "   A" and resid   42 and name HG12)
    or (segid "   A" and resid   90 and name HD13) (segid "   A" and resid   42 and name HG11)
    or (segid "   A" and resid   90 and name HD13) (segid "   A" and resid   42 and name HG13)
assign (segid "   B" and resid   90 and name HD12) (segid "   B" and resid   42 and name HG12) 1.912 1.912 4.088 weight 1.000 ! spec=13Cnoesy, no=2626, id=2171, vol=8.954000e+03
    or (segid "   B" and resid   90 and name HD12) (segid "   B" and resid   42 and name HG11)
    or (segid "   B" and resid   90 and name HD12) (segid "   B" and resid   42 and name HG13)
    or (segid "   B" and resid   90 and name HD11) (segid "   B" and resid   42 and name HG12)
    or (segid "   B" and resid   90 and name HD11) (segid "   B" and resid   42 and name HG11)
    or (segid "   B" and resid   90 and name HD11) (segid "   B" and resid   42 and name HG13)
    or (segid "   B" and resid   90 and name HD13) (segid "   B" and resid   42 and name HG12)
    or (segid "   B" and resid   90 and name HD13) (segid "   B" and resid   42 and name HG11)
    or (segid "   B" and resid   90 and name HD13) (segid "   B" and resid   42 and name HG13)
assign (segid "   A" and resid  113 and name  HB2) (segid "   A" and resid  113 and name   HA) 2.530 0.800 0.800 weight 1.000 ! spec=13Cnoesy, no=2633, id=2177, vol=4.329000e+03
assign (segid "   B" and resid  113 and name  HB2) (segid "   B" and resid  113 and name   HA) 2.530 0.800 0.800 weight 1.000 ! spec=13Cnoesy, no=2633, id=2177, vol=4.329000e+03
assign (segid "   A" and resid  113 and name   HA) (segid "   A" and resid  114 and name  HG2) 5.935 4.403 4.403 weight 1.000 ! spec=13Cnoesy, no=2634, id=2178, vol=7.246000e+02
assign (segid "   B" and resid  113 and name   HA) (segid "   B" and resid  114 and name  HG2) 5.935 4.403 4.403 weight 1.000 ! spec=13Cnoesy, no=2634, id=2178, vol=7.246000e+02
assign (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   52 and name   HN) 3.509 1.539 1.539 weight 1.000 ! spec=13Cnoesy, no=2636, id=2180, vol=6.844000e+02
assign (segid "   B" and resid   52 and name  HB2) (segid "   B" and resid   52 and name   HN) 3.509 1.539 1.539 weight 1.000 ! spec=13Cnoesy, no=2636, id=2180, vol=6.844000e+02
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   52 and name  HB2) 4.221 2.227 2.227 weight 1.000 ! spec=13Cnoesy, no=2637, id=2181, vol=5.381000e+02
assign (segid "   B" and resid   52 and name   HA) (segid "   B" and resid   52 and name  HB2) 4.221 2.227 2.227 weight 1.000 ! spec=13Cnoesy, no=2637, id=2181, vol=5.381000e+02
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HE1) 5.022 3.152 3.152 weight 1.000 ! spec=13Cnoesy, no=2642, id=2183, vol=5.054000e+02
assign (segid "   B" and resid   53 and name   HA) (segid "   B" and resid   53 and name  HE1) 5.022 3.152 3.152 weight 1.000 ! spec=13Cnoesy, no=2642, id=2183, vol=5.054000e+02
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name   HA) 3.912 1.913 1.913 weight 1.000 ! spec=13Cnoesy, no=2643, id=2184, vol=8.552000e+02
assign (segid "   B" and resid   53 and name  HB1) (segid "   B" and resid   53 and name   HA) 3.912 1.913 1.913 weight 1.000 ! spec=13Cnoesy, no=2643, id=2184, vol=8.552000e+02
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name   HZ) 4.746 2.816 2.816 weight 1.000 ! spec=13Cnoesy, no=2644, id=2185, vol=4.507000e+02
assign (segid "   B" and resid   53 and name   HA) (segid "   B" and resid   53 and name   HZ) 4.746 2.816 2.816 weight 1.000 ! spec=13Cnoesy, no=2644, id=2185, vol=4.507000e+02
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HB2) 3.397 1.443 1.443 weight 1.000 ! spec=13Cnoesy, no=2646, id=2187, vol=7.417000e+02
assign (segid "   B" and resid   53 and name   HA) (segid "   B" and resid   53 and name  HB2) 3.397 1.443 1.443 weight 1.000 ! spec=13Cnoesy, no=2646, id=2187, vol=7.417000e+02
assign (segid "   A" and resid   48 and name HG22) (segid "   A" and resid   48 and name   HA) 2.398 0.719 0.719 weight 1.000 ! spec=13Cnoesy, no=2648, id=2189, vol=3.495000e+03
    or (segid "   A" and resid   48 and name HG21) (segid "   A" and resid   48 and name   HA)
    or (segid "   A" and resid   48 and name HG23) (segid "   A" and resid   48 and name   HA)
assign (segid "   B" and resid   48 and name HG22) (segid "   B" and resid   48 and name   HA) 2.398 0.719 0.719 weight 1.000 ! spec=13Cnoesy, no=2648, id=2189, vol=3.495000e+03
    or (segid "   B" and resid   48 and name HG21) (segid "   B" and resid   48 and name   HA)
    or (segid "   B" and resid   48 and name HG23) (segid "   B" and resid   48 and name   HA)
assign (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   95 and name  HE1) 2.196 0.603 0.603 weight 1.000 ! spec=13Cnoesy, no=2652, id=2192, vol=6.315000e+03
assign (segid "   B" and resid   95 and name  HG2) (segid "   B" and resid   95 and name  HE1) 2.196 0.603 0.603 weight 1.000 ! spec=13Cnoesy, no=2652, id=2192, vol=6.315000e+03
assign (segid "   A" and resid   95 and name  HE1) (segid "   A" and resid   95 and name   HN) 5.529 3.821 3.821 weight 1.000 ! spec=13Cnoesy, no=2654, id=2194, vol=5.694000e+02
assign (segid "   B" and resid   95 and name  HE1) (segid "   B" and resid   95 and name   HN) 5.529 3.821 3.821 weight 1.000 ! spec=13Cnoesy, no=2654, id=2194, vol=5.694000e+02
assign (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   95 and name  HE1) 3.549 1.575 1.575 weight 1.000 ! spec=13Cnoesy, no=2655, id=2195, vol=5.424000e+03
assign (segid "   B" and resid   95 and name  HB1) (segid "   B" and resid   95 and name  HE1) 3.549 1.575 1.575 weight 1.000 ! spec=13Cnoesy, no=2655, id=2195, vol=5.424000e+03
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name  HB1) 4.444 2.468 2.468 weight 1.000 ! spec=13Cnoesy, no=2656, id=2196, vol=2.939000e+02
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   54 and name  HB1) 4.444 2.468 2.468 weight 1.000 ! spec=13Cnoesy, no=2656, id=2196, vol=2.939000e+02
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   19 and name   HA) 3.542 1.568 1.568 weight 1.000 ! spec=13Cnoesy, no=2659, id=2198, vol=1.205000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   19 and name   HA)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   19 and name   HA)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   19 and name   HA) 3.542 1.568 1.568 weight 1.000 ! spec=13Cnoesy, no=2659, id=2198, vol=1.205000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   19 and name   HA)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   19 and name   HA)
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name   HA) 3.587 1.608 1.608 weight 1.000 ! spec=13Cnoesy, no=2660, id=2199, vol=5.559000e+02
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   19 and name   HA) 3.587 1.608 1.608 weight 1.000 ! spec=13Cnoesy, no=2660, id=2199, vol=5.559000e+02
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   19 and name   HA) 3.269 1.335 1.335 weight 1.000 ! spec=13Cnoesy, no=2662, id=2201, vol=7.648000e+02
assign (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   19 and name   HA) 3.269 1.335 1.335 weight 1.000 ! spec=13Cnoesy, no=2662, id=2201, vol=7.648000e+02
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name  HB1) 4.075 2.076 2.076 weight 1.000 ! spec=13Cnoesy, no=2664, id=2203, vol=6.134000e+02
assign (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   19 and name  HB1) 4.075 2.076 2.076 weight 1.000 ! spec=13Cnoesy, no=2664, id=2203, vol=6.134000e+02
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   20 and name HG22) 3.561 1.586 1.586 weight 1.000 ! spec=13Cnoesy, no=2666, id=2204, vol=1.205000e+03
    or (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   20 and name HG21)
    or (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   20 and name HG23)
assign (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   20 and name HG22) 3.561 1.586 1.586 weight 1.000 ! spec=13Cnoesy, no=2666, id=2204, vol=1.205000e+03
    or (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   20 and name HG21)
    or (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   20 and name HG23)
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   20 and name HG22) 4.001 2.001 2.001 weight 1.000 ! spec=13Cnoesy, no=2674, id=2212, vol=1.396000e+03
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   20 and name HG21)
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   20 and name HG23)
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   20 and name HG22) 4.001 2.001 2.001 weight 1.000 ! spec=13Cnoesy, no=2674, id=2212, vol=1.396000e+03
    or (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   20 and name HG21)
    or (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   20 and name HG23)
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG22) 2.218 0.615 0.615 weight 1.000 ! spec=13Cnoesy, no=2679, id=2216, vol=6.532000e+03
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG21)
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG23)
assign (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   20 and name HG22) 2.218 0.615 0.615 weight 1.000 ! spec=13Cnoesy, no=2679, id=2216, vol=6.532000e+03
    or (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   20 and name HG21)
    or (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   20 and name HG23)
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   20 and name HG22) 4.306 2.318 2.318 weight 1.000 ! spec=13Cnoesy, no=2680, id=2217, vol=9.662000e+02
    or (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   20 and name HG21)
    or (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   20 and name HG23)
assign (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   20 and name HG22) 4.306 2.318 2.318 weight 1.000 ! spec=13Cnoesy, no=2680, id=2217, vol=9.662000e+02
    or (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   20 and name HG21)
    or (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   20 and name HG23)
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid  106 and name HG21) 1.852 0.429 0.429 weight 1.000 ! spec=13Cnoesy, no=2685, id=2222, vol=5.215000e+03
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid  106 and name HG22)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid  106 and name HG23)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid  106 and name HG21)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid  106 and name HG22)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid  106 and name HG23)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid  106 and name HG21)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid  106 and name HG22)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid  106 and name HG23)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid  106 and name HG21) 1.852 0.429 0.429 weight 1.000 ! spec=13Cnoesy, no=2685, id=2222, vol=5.215000e+03
    or (segid "   B" and resid   85 and name HG21) (segid "   B" and resid  106 and name HG22)
    or (segid "   B" and resid   85 and name HG21) (segid "   B" and resid  106 and name HG23)
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid  106 and name HG21)
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid  106 and name HG22)
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid  106 and name HG23)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid  106 and name HG21)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid  106 and name HG22)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid  106 and name HG23)
assign (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name HG21) 2.883 1.039 1.039 weight 1.000 ! spec=13Cnoesy, no=2686, id=2223, vol=2.066000e+03
    or (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name HG22)
    or (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name HG23)
assign (segid "   B" and resid  106 and name   HA) (segid "   B" and resid  106 and name HG21) 2.883 1.039 1.039 weight 1.000 ! spec=13Cnoesy, no=2686, id=2223, vol=2.066000e+03
    or (segid "   B" and resid  106 and name   HA) (segid "   B" and resid  106 and name HG22)
    or (segid "   B" and resid  106 and name   HA) (segid "   B" and resid  106 and name HG23)
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name   HA) 2.960 1.095 1.095 weight 1.000 ! spec=13Cnoesy, no=2690, id=2226, vol=3.134000e+03
assign (segid "   B" and resid   13 and name  HB2) (segid "   B" and resid   13 and name   HA) 2.960 1.095 1.095 weight 1.000 ! spec=13Cnoesy, no=2690, id=2226, vol=3.134000e+03
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   14 and name   HN) 4.692 2.751 2.751 weight 1.000 ! spec=13Cnoesy, no=2694, id=2230, vol=1.250000e+03
assign (segid "   B" and resid   13 and name  HB2) (segid "   B" and resid   14 and name   HN) 4.692 2.751 2.751 weight 1.000 ! spec=13Cnoesy, no=2694, id=2230, vol=1.250000e+03
assign (segid "   A" and resid  114 and name  HB2) (segid "   A" and resid  114 and name  HD1) 3.511 1.540 1.540 weight 1.000 ! spec=13Cnoesy, no=2700, id=2234, vol=1.864000e+03
assign (segid "   B" and resid  114 and name  HB2) (segid "   B" and resid  114 and name  HD1) 3.511 1.540 1.540 weight 1.000 ! spec=13Cnoesy, no=2700, id=2234, vol=1.864000e+03
assign (segid "   A" and resid  114 and name  HG2) (segid "   A" and resid  114 and name  HD1) 2.581 0.832 0.832 weight 1.000 ! spec=13Cnoesy, no=2701, id=2235, vol=2.845000e+03
assign (segid "   B" and resid  114 and name  HG2) (segid "   B" and resid  114 and name  HD1) 2.581 0.832 0.832 weight 1.000 ! spec=13Cnoesy, no=2701, id=2235, vol=2.845000e+03
assign (segid "   A" and resid   11 and name  HG2) (segid "   A" and resid   11 and name  HB2) 2.652 0.879 0.879 weight 1.000 ! spec=13Cnoesy, no=2706, id=2240, vol=4.773000e+03
assign (segid "   B" and resid   11 and name  HG2) (segid "   B" and resid   11 and name  HB2) 2.652 0.879 0.879 weight 1.000 ! spec=13Cnoesy, no=2706, id=2240, vol=4.773000e+03
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name  HB2) 4.078 2.079 2.079 weight 1.000 ! spec=13Cnoesy, no=2712, id=2246, vol=8.090000e+02
assign (segid "   B" and resid   16 and name   HA) (segid "   B" and resid   16 and name  HB2) 4.078 2.079 2.079 weight 1.000 ! spec=13Cnoesy, no=2712, id=2246, vol=8.090000e+02
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   16 and name   HN) 3.501 1.532 1.532 weight 1.000 ! spec=13Cnoesy, no=2713, id=2247, vol=9.733000e+02
assign (segid "   B" and resid   16 and name  HB2) (segid "   B" and resid   16 and name   HN) 3.501 1.532 1.532 weight 1.000 ! spec=13Cnoesy, no=2713, id=2247, vol=9.733000e+02
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   16 and name  HB2) 4.779 2.855 2.855 weight 1.000 ! spec=13Cnoesy, no=2714, id=2248, vol=1.204000e+03
assign (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   16 and name  HB2) 4.779 2.855 2.855 weight 1.000 ! spec=13Cnoesy, no=2714, id=2248, vol=1.204000e+03
assign (segid "   A" and resid   16 and name  HB1) (segid "   A" and resid   16 and name  HB2) 1.686 0.355 0.355 weight 1.000 ! spec=13Cnoesy, no=2715, id=2249, vol=1.795000e+04
assign (segid "   B" and resid   16 and name  HB1) (segid "   B" and resid   16 and name  HB2) 1.686 0.355 0.355 weight 1.000 ! spec=13Cnoesy, no=2715, id=2249, vol=1.795000e+04
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   38 and name   HA) 3.196 1.277 1.277 weight 1.000 ! spec=13Cnoesy, no=2716, id=2250, vol=9.492000e+02
assign (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   38 and name   HA) 3.196 1.277 1.277 weight 1.000 ! spec=13Cnoesy, no=2716, id=2250, vol=9.492000e+02
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid  108 and name   HA) 3.174 1.259 1.259 weight 1.000 ! spec=13Cnoesy, no=2723, id=2257, vol=9.776000e+02
assign (segid "   B" and resid   82 and name   HA) (segid "   B" and resid  108 and name   HA) 3.174 1.259 1.259 weight 1.000 ! spec=13Cnoesy, no=2723, id=2257, vol=9.776000e+02
assign (segid "   A" and resid  108 and name  HB1) (segid "   A" and resid  108 and name   HA) 3.698 1.709 1.709 weight 1.000 ! spec=13Cnoesy, no=2724, id=2258, vol=3.897000e+02
assign (segid "   B" and resid  108 and name  HB1) (segid "   B" and resid  108 and name   HA) 3.698 1.709 1.709 weight 1.000 ! spec=13Cnoesy, no=2724, id=2258, vol=3.897000e+02
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   79 and name   HA) 4.806 2.888 2.888 weight 1.000 ! spec=13Cnoesy, no=2744, id=2265, vol=7.447000e+02
assign (segid "   B" and resid   62 and name   HA) (segid "   B" and resid   79 and name   HA) 4.806 2.888 2.888 weight 1.000 ! spec=13Cnoesy, no=2744, id=2265, vol=7.447000e+02
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name  HB1) 1.947 0.474 0.474 weight 1.000 ! spec=13Cnoesy, no=2747, id=2267, vol=7.477000e+03
assign (segid "   B" and resid   66 and name  HB2) (segid "   B" and resid   66 and name  HB1) 1.947 0.474 0.474 weight 1.000 ! spec=13Cnoesy, no=2747, id=2267, vol=7.477000e+03
assign (segid "   A" and resid   56 and name   HB) (segid "   A" and resid   56 and name HG21) 2.501 0.782 0.782 weight 1.000 ! spec=13Cnoesy, no=2751, id=2270, vol=1.867000e+03
    or (segid "   A" and resid   56 and name   HB) (segid "   A" and resid   56 and name HG22)
    or (segid "   A" and resid   56 and name   HB) (segid "   A" and resid   56 and name HG23)
assign (segid "   B" and resid   56 and name   HB) (segid "   B" and resid   56 and name HG21) 2.501 0.782 0.782 weight 1.000 ! spec=13Cnoesy, no=2751, id=2270, vol=1.867000e+03
    or (segid "   B" and resid   56 and name   HB) (segid "   B" and resid   56 and name HG22)
    or (segid "   B" and resid   56 and name   HB) (segid "   B" and resid   56 and name HG23)
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name HG21) 2.691 0.905 0.905 weight 1.000 ! spec=13Cnoesy, no=2754, id=2273, vol=2.120000e+03
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name HG22)
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name HG23)
assign (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   56 and name HG21) 2.691 0.905 0.905 weight 1.000 ! spec=13Cnoesy, no=2754, id=2273, vol=2.120000e+03
    or (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   56 and name HG22)
    or (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   56 and name HG23)
assign (segid "   A" and resid  107 and name   HA) (segid "   A" and resid   56 and name HG21) 2.793 0.975 0.975 weight 1.000 ! spec=13Cnoesy, no=2755, id=2274, vol=1.698000e+03
    or (segid "   A" and resid  107 and name   HA) (segid "   A" and resid   56 and name HG22)
    or (segid "   A" and resid  107 and name   HA) (segid "   A" and resid   56 and name HG23)
assign (segid "   B" and resid  107 and name   HA) (segid "   B" and resid   56 and name HG21) 2.793 0.975 0.975 weight 1.000 ! spec=13Cnoesy, no=2755, id=2274, vol=1.698000e+03
    or (segid "   B" and resid  107 and name   HA) (segid "   B" and resid   56 and name HG22)
    or (segid "   B" and resid  107 and name   HA) (segid "   B" and resid   56 and name HG23)
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name  HB2) 2.180 0.594 0.594 weight 1.000 ! spec=13Cnoesy, no=2757, id=2276, vol=4.699000e+03
    or (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name  HB3)
assign (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   28 and name  HB2) 2.180 0.594 0.594 weight 1.000 ! spec=13Cnoesy, no=2757, id=2276, vol=4.699000e+03
    or (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   28 and name  HB1)
    or (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   28 and name  HB3)
assign (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   42 and name HG22) 1.935 0.468 0.468 weight 1.000 ! spec=13Cnoesy, no=2768, id=2287, vol=4.017000e+03
    or (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   42 and name HG23)
assign (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   42 and name HG22) 1.935 0.468 0.468 weight 1.000 ! spec=13Cnoesy, no=2768, id=2287, vol=4.017000e+03
    or (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   42 and name HG23)
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   42 and name HG22) 3.447 1.485 1.485 weight 1.000 ! spec=13Cnoesy, no=2769, id=2288, vol=1.080000e+03
    or (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   42 and name HG21)
    or (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   42 and name HG23)
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   42 and name HG22) 3.447 1.485 1.485 weight 1.000 ! spec=13Cnoesy, no=2769, id=2288, vol=1.080000e+03
    or (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   42 and name HG21)
    or (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   42 and name HG23)
assign (segid "   A" and resid   42 and name HG22) (segid "   A" and resid   99 and name  HZ3) 3.823 1.827 1.827 weight 1.000 ! spec=13Cnoesy, no=2771, id=2290, vol=1.196000e+03
    or (segid "   A" and resid   42 and name HG21) (segid "   A" and resid   99 and name  HZ3)
    or (segid "   A" and resid   42 and name HG23) (segid "   A" and resid   99 and name  HZ3)
assign (segid "   B" and resid   42 and name HG22) (segid "   B" and resid   99 and name  HZ3) 3.823 1.827 1.827 weight 1.000 ! spec=13Cnoesy, no=2771, id=2290, vol=1.196000e+03
    or (segid "   B" and resid   42 and name HG21) (segid "   B" and resid   99 and name  HZ3)
    or (segid "   B" and resid   42 and name HG23) (segid "   B" and resid   99 and name  HZ3)
assign (segid "   A" and resid   42 and name HG22) (segid "   A" and resid   42 and name   HN) 2.703 0.913 0.913 weight 1.000 ! spec=13Cnoesy, no=2772, id=2291, vol=1.607000e+03
    or (segid "   A" and resid   42 and name HG21) (segid "   A" and resid   42 and name   HN)
    or (segid "   A" and resid   42 and name HG23) (segid "   A" and resid   42 and name   HN)
assign (segid "   B" and resid   42 and name HG22) (segid "   B" and resid   42 and name   HN) 2.703 0.913 0.913 weight 1.000 ! spec=13Cnoesy, no=2772, id=2291, vol=1.607000e+03
    or (segid "   B" and resid   42 and name HG21) (segid "   B" and resid   42 and name   HN)
    or (segid "   B" and resid   42 and name HG23) (segid "   B" and resid   42 and name   HN)
assign (segid "   A" and resid   42 and name HG22) (segid "   A" and resid   99 and name  HZ2) 3.428 1.469 1.469 weight 1.000 ! spec=13Cnoesy, no=2774, id=2293, vol=1.465000e+03
    or (segid "   A" and resid   42 and name HG21) (segid "   A" and resid   99 and name  HZ2)
    or (segid "   A" and resid   42 and name HG23) (segid "   A" and resid   99 and name  HZ2)
assign (segid "   B" and resid   42 and name HG22) (segid "   B" and resid   99 and name  HZ2) 3.428 1.469 1.469 weight 1.000 ! spec=13Cnoesy, no=2774, id=2293, vol=1.465000e+03
    or (segid "   B" and resid   42 and name HG21) (segid "   B" and resid   99 and name  HZ2)
    or (segid "   B" and resid   42 and name HG23) (segid "   B" and resid   99 and name  HZ2)
assign (segid "   A" and resid  115 and name  HB1) (segid "   A" and resid   76 and name   HN) 4.040 2.040 2.040 weight 1.000 ! spec=13Cnoesy, no=2784, id=2302, vol=2.171000e+03
assign (segid "   B" and resid  115 and name  HB1) (segid "   B" and resid   76 and name   HN) 4.040 2.040 2.040 weight 1.000 ! spec=13Cnoesy, no=2784, id=2302, vol=2.171000e+03
assign (segid "   A" and resid  115 and name  HB1) (segid "   A" and resid   75 and name   HA) 4.674 2.731 2.731 weight 1.000 ! spec=13Cnoesy, no=2787, id=2303, vol=6.593000e+02
assign (segid "   B" and resid  115 and name  HB1) (segid "   B" and resid   75 and name   HA) 4.674 2.731 2.731 weight 1.000 ! spec=13Cnoesy, no=2787, id=2303, vol=6.593000e+02
assign (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name  HE1) 5.986 4.480 4.480 weight 1.000 ! spec=13Cnoesy, no=2796, id=2311, vol=3.049000e+02
assign (segid "   B" and resid   75 and name  HB1) (segid "   B" and resid   75 and name  HE1) 5.986 4.480 4.480 weight 1.000 ! spec=13Cnoesy, no=2796, id=2311, vol=3.049000e+02
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name   HA) 3.118 1.215 1.215 weight 1.000 ! spec=13Cnoesy, no=2807, id=2321, vol=1.587000e+03
assign (segid "   B" and resid   77 and name  HB2) (segid "   B" and resid   77 and name   HA) 3.118 1.215 1.215 weight 1.000 ! spec=13Cnoesy, no=2807, id=2321, vol=1.587000e+03
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name  HB1) 3.008 1.131 1.131 weight 1.000 ! spec=13Cnoesy, no=2808, id=2322, vol=1.915000e+03
assign (segid "   B" and resid   77 and name   HA) (segid "   B" and resid   77 and name  HB1) 3.008 1.131 1.131 weight 1.000 ! spec=13Cnoesy, no=2808, id=2322, vol=1.915000e+03
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name  HB2) 3.554 1.579 1.579 weight 1.000 ! spec=13Cnoesy, no=2810, id=2323, vol=5.751000e+02
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   54 and name  HB2) 3.554 1.579 1.579 weight 1.000 ! spec=13Cnoesy, no=2810, id=2323, vol=5.751000e+02
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   54 and name   HZ) 5.322 3.540 3.540 weight 1.000 ! spec=13Cnoesy, no=2813, id=2326, vol=3.369000e+02
assign (segid "   B" and resid   54 and name  HB2) (segid "   B" and resid   54 and name   HZ) 5.322 3.540 3.540 weight 1.000 ! spec=13Cnoesy, no=2813, id=2326, vol=3.369000e+02
assign (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name  HD2) 3.040 1.155 1.155 weight 1.000 ! spec=13Cnoesy, no=2819, id=2331, vol=1.229000e+03
assign (segid "   B" and resid  100 and name   HA) (segid "   B" and resid  100 and name  HD2) 3.040 1.155 1.155 weight 1.000 ! spec=13Cnoesy, no=2819, id=2331, vol=1.229000e+03
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid  100 and name  HD2) 3.358 1.410 1.410 weight 1.000 ! spec=13Cnoesy, no=2820, id=2332, vol=1.895000e+03
assign (segid "   B" and resid  100 and name  HB2) (segid "   B" and resid  100 and name  HD2) 3.358 1.410 1.410 weight 1.000 ! spec=13Cnoesy, no=2820, id=2332, vol=1.895000e+03
assign (segid "   A" and resid  100 and name  HG1) (segid "   A" and resid  100 and name  HD2) 2.957 1.093 1.093 weight 1.000 ! spec=13Cnoesy, no=2821, id=2333, vol=3.009000e+03
assign (segid "   B" and resid  100 and name  HG1) (segid "   B" and resid  100 and name  HD2) 2.957 1.093 1.093 weight 1.000 ! spec=13Cnoesy, no=2821, id=2333, vol=3.009000e+03
assign (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name  HD2) 3.801 1.806 1.806 weight 1.000 ! spec=13Cnoesy, no=2823, id=2335, vol=2.620000e+03
assign (segid "   B" and resid  100 and name  HB1) (segid "   B" and resid  100 and name  HD2) 3.801 1.806 1.806 weight 1.000 ! spec=13Cnoesy, no=2823, id=2335, vol=2.620000e+03
assign (segid "   A" and resid  100 and name  HG2) (segid "   A" and resid  100 and name  HD2) 2.427 0.736 0.736 weight 1.000 ! spec=13Cnoesy, no=2826, id=2338, vol=3.795000e+03
assign (segid "   B" and resid  100 and name  HG2) (segid "   B" and resid  100 and name  HD2) 2.427 0.736 0.736 weight 1.000 ! spec=13Cnoesy, no=2826, id=2338, vol=3.795000e+03
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name  HB2) 1.650 0.340 0.340 weight 1.000 ! spec=13Cnoesy, no=2835, id=2346, vol=6.814000e+03
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   34 and name  HB2) 1.650 0.340 0.340 weight 1.000 ! spec=13Cnoesy, no=2835, id=2346, vol=6.814000e+03
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name   HN) 4.577 2.619 2.619 weight 1.000 ! spec=13Cnoesy, no=2842, id=2353, vol=5.196000e+02
assign (segid "   B" and resid   46 and name  HB2) (segid "   B" and resid   46 and name   HN) 4.577 2.619 2.619 weight 1.000 ! spec=13Cnoesy, no=2842, id=2353, vol=5.196000e+02
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   46 and name  HB2) 2.870 1.029 1.029 weight 1.000 ! spec=13Cnoesy, no=2843, id=2354, vol=4.085000e+03
assign (segid "   B" and resid   46 and name   HA) (segid "   B" and resid   46 and name  HB2) 2.870 1.029 1.029 weight 1.000 ! spec=13Cnoesy, no=2843, id=2354, vol=4.085000e+03
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   47 and name   HN) 5.066 3.208 3.208 weight 1.000 ! spec=13Cnoesy, no=2844, id=2355, vol=5.281000e+02
assign (segid "   B" and resid   46 and name  HB2) (segid "   B" and resid   47 and name   HN) 5.066 3.208 3.208 weight 1.000 ! spec=13Cnoesy, no=2844, id=2355, vol=5.281000e+02
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   59 and name  HD1) 2.442 0.746 0.746 weight 1.000 ! spec=13Cnoesy, no=2847, id=2358, vol=2.256000e+03
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   59 and name  HD1) 2.442 0.746 0.746 weight 1.000 ! spec=13Cnoesy, no=2847, id=2358, vol=2.256000e+03
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name  HD1) 2.999 1.124 1.124 weight 1.000 ! spec=13Cnoesy, no=2848, id=2359, vol=2.290000e+03
assign (segid "   B" and resid   59 and name  HB2) (segid "   B" and resid   59 and name  HD1) 2.999 1.124 1.124 weight 1.000 ! spec=13Cnoesy, no=2848, id=2359, vol=2.290000e+03
assign (segid "   A" and resid   59 and name  HD2) (segid "   A" and resid   59 and name  HD1) 1.138 1.138 4.862 weight 1.000 ! spec=13Cnoesy, no=2849, id=2360, vol=8.163000e+04
assign (segid "   B" and resid   59 and name  HD2) (segid "   B" and resid   59 and name  HD1) 1.138 1.138 4.862 weight 1.000 ! spec=13Cnoesy, no=2849, id=2360, vol=8.163000e+04
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   59 and name  HD1) 4.929 3.037 3.037 weight 1.000 ! spec=13Cnoesy, no=2851, id=2362, vol=1.066000e+03
assign (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   59 and name  HD1) 4.929 3.037 3.037 weight 1.000 ! spec=13Cnoesy, no=2851, id=2362, vol=1.066000e+03
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name  HD1) 3.250 1.320 1.320 weight 1.000 ! spec=13Cnoesy, no=2852, id=2363, vol=2.290000e+03
assign (segid "   B" and resid   59 and name  HG2) (segid "   B" and resid   59 and name  HD1) 3.250 1.320 1.320 weight 1.000 ! spec=13Cnoesy, no=2852, id=2363, vol=2.290000e+03
assign (segid "   A" and resid   59 and name  HG1) (segid "   A" and resid   59 and name  HD1) 2.128 0.566 0.566 weight 1.000 ! spec=13Cnoesy, no=2853, id=2364, vol=7.590000e+03
assign (segid "   B" and resid   59 and name  HG1) (segid "   B" and resid   59 and name  HD1) 2.128 0.566 0.566 weight 1.000 ! spec=13Cnoesy, no=2853, id=2364, vol=7.590000e+03
assign (segid "   A" and resid   59 and name  HD1) (segid "   A" and resid   59 and name  HB1) 2.159 0.582 0.582 weight 1.000 ! spec=13Cnoesy, no=2854, id=2365, vol=7.772000e+03
assign (segid "   B" and resid   59 and name  HD1) (segid "   B" and resid   59 and name  HB1) 2.159 0.582 0.582 weight 1.000 ! spec=13Cnoesy, no=2854, id=2365, vol=7.772000e+03
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name  HG1) 2.285 0.653 0.653 weight 1.000 ! spec=13Cnoesy, no=2856, id=2367, vol=1.318000e+04
assign (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   50 and name  HG1) 2.285 0.653 0.653 weight 1.000 ! spec=13Cnoesy, no=2856, id=2367, vol=1.318000e+04
assign (segid "   A" and resid   50 and name  HG1) (segid "   A" and resid   50 and name   HA) 4.438 2.462 2.462 weight 1.000 ! spec=13Cnoesy, no=2857, id=2368, vol=3.414000e+02
assign (segid "   B" and resid   50 and name  HG1) (segid "   B" and resid   50 and name   HA) 4.438 2.462 2.462 weight 1.000 ! spec=13Cnoesy, no=2857, id=2368, vol=3.414000e+02
assign (segid "   A" and resid   50 and name  HD1) (segid "   A" and resid   50 and name  HG1) 2.416 0.729 0.729 weight 1.000 ! spec=13Cnoesy, no=2859, id=2369, vol=5.038000e+03
assign (segid "   B" and resid   50 and name  HD1) (segid "   B" and resid   50 and name  HG1) 2.416 0.729 0.729 weight 1.000 ! spec=13Cnoesy, no=2859, id=2369, vol=5.038000e+03
assign (segid "   A" and resid  111 and name   HA) (segid "   A" and resid  111 and name HG12) 2.835 1.004 1.004 weight 1.000 ! spec=13Cnoesy, no=2869, id=2374, vol=1.830000e+03
    or (segid "   A" and resid  111 and name   HA) (segid "   A" and resid  111 and name HG11)
    or (segid "   A" and resid  111 and name   HA) (segid "   A" and resid  111 and name HG13)
assign (segid "   B" and resid  111 and name   HA) (segid "   B" and resid  111 and name HG12) 2.835 1.004 1.004 weight 1.000 ! spec=13Cnoesy, no=2869, id=2374, vol=1.830000e+03
    or (segid "   B" and resid  111 and name   HA) (segid "   B" and resid  111 and name HG11)
    or (segid "   B" and resid  111 and name   HA) (segid "   B" and resid  111 and name HG13)
assign (segid "   A" and resid  111 and name   HB) (segid "   A" and resid  111 and name HG12) 1.791 0.401 0.401 weight 1.000 ! spec=13Cnoesy, no=2871, id=2376, vol=6.765000e+03
    or (segid "   A" and resid  111 and name   HB) (segid "   A" and resid  111 and name HG11)
    or (segid "   A" and resid  111 and name   HB) (segid "   A" and resid  111 and name HG13)
assign (segid "   B" and resid  111 and name   HB) (segid "   B" and resid  111 and name HG12) 1.791 0.401 0.401 weight 1.000 ! spec=13Cnoesy, no=2871, id=2376, vol=6.765000e+03
    or (segid "   B" and resid  111 and name   HB) (segid "   B" and resid  111 and name HG11)
    or (segid "   B" and resid  111 and name   HB) (segid "   B" and resid  111 and name HG13)
assign (segid "   A" and resid  109 and name HG22) (segid "   A" and resid  111 and name HG12) 1.433 1.433 4.567 weight 1.000 ! spec=13Cnoesy, no=2872, id=2377, vol=7.011000e+03
    or (segid "   A" and resid  109 and name HG22) (segid "   A" and resid  111 and name HG11)
    or (segid "   A" and resid  109 and name HG22) (segid "   A" and resid  111 and name HG13)
    or (segid "   A" and resid  109 and name HG21) (segid "   A" and resid  111 and name HG12)
    or (segid "   A" and resid  109 and name HG21) (segid "   A" and resid  111 and name HG11)
    or (segid "   A" and resid  109 and name HG21) (segid "   A" and resid  111 and name HG13)
    or (segid "   A" and resid  109 and name HG23) (segid "   A" and resid  111 and name HG12)
    or (segid "   A" and resid  109 and name HG23) (segid "   A" and resid  111 and name HG11)
    or (segid "   A" and resid  109 and name HG23) (segid "   A" and resid  111 and name HG13)
assign (segid "   B" and resid  109 and name HG22) (segid "   B" and resid  111 and name HG12) 1.433 1.433 4.567 weight 1.000 ! spec=13Cnoesy, no=2872, id=2377, vol=7.011000e+03
    or (segid "   B" and resid  109 and name HG22) (segid "   B" and resid  111 and name HG11)
    or (segid "   B" and resid  109 and name HG22) (segid "   B" and resid  111 and name HG13)
    or (segid "   B" and resid  109 and name HG21) (segid "   B" and resid  111 and name HG12)
    or (segid "   B" and resid  109 and name HG21) (segid "   B" and resid  111 and name HG11)
    or (segid "   B" and resid  109 and name HG21) (segid "   B" and resid  111 and name HG13)
    or (segid "   B" and resid  109 and name HG23) (segid "   B" and resid  111 and name HG12)
    or (segid "   B" and resid  109 and name HG23) (segid "   B" and resid  111 and name HG11)
    or (segid "   B" and resid  109 and name HG23) (segid "   B" and resid  111 and name HG13)
assign (segid "   A" and resid  111 and name HG12) (segid "   A" and resid  112 and name   HN) 4.159 2.163 2.163 weight 1.000 ! spec=13Cnoesy, no=2875, id=2379, vol=1.134000e+03
    or (segid "   A" and resid  111 and name HG11) (segid "   A" and resid  112 and name   HN)
    or (segid "   A" and resid  111 and name HG13) (segid "   A" and resid  112 and name   HN)
assign (segid "   B" and resid  111 and name HG12) (segid "   B" and resid  112 and name   HN) 4.159 2.163 2.163 weight 1.000 ! spec=13Cnoesy, no=2875, id=2379, vol=1.134000e+03
    or (segid "   B" and resid  111 and name HG11) (segid "   B" and resid  112 and name   HN)
    or (segid "   B" and resid  111 and name HG13) (segid "   B" and resid  112 and name   HN)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name HG11) 3.547 1.573 1.573 weight 1.000 ! spec=13Cnoesy, no=2883, id=2387, vol=6.894000e+02
assign (segid "   B" and resid   71 and name   HA) (segid "   B" and resid   71 and name HG11) 3.547 1.573 1.573 weight 1.000 ! spec=13Cnoesy, no=2883, id=2387, vol=6.894000e+02
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   65 and name   HA) 4.190 2.194 2.194 weight 1.000 ! spec=13Cnoesy, no=2889, id=2392, vol=4.542000e+02
assign (segid "   B" and resid   62 and name  HB2) (segid "   B" and resid   65 and name   HA) 4.190 2.194 2.194 weight 1.000 ! spec=13Cnoesy, no=2889, id=2392, vol=4.542000e+02
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name HD12) 2.109 0.556 0.556 weight 1.000 ! spec=13Cnoesy, no=2892, id=2395, vol=7.181000e+03
    or (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name HD12) 2.109 0.556 0.556 weight 1.000 ! spec=13Cnoesy, no=2892, id=2395, vol=7.181000e+03
    or (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   39 and name HD12) 3.498 1.530 1.530 weight 1.000 ! spec=13Cnoesy, no=2894, id=2397, vol=1.144000e+03
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   39 and name HD12) 3.498 1.530 1.530 weight 1.000 ! spec=13Cnoesy, no=2894, id=2397, vol=1.144000e+03
    or (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   39 and name HD12) 1.453 1.453 4.547 weight 1.000 ! spec=13Cnoesy, no=2896, id=2399, vol=5.134000e+03
    or (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   39 and name HD13)
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   39 and name HD12)
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   39 and name HD13)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   39 and name HD12)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   39 and name HD12) 1.453 1.453 4.547 weight 1.000 ! spec=13Cnoesy, no=2896, id=2399, vol=5.134000e+03
    or (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   39 and name HD13)
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   39 and name HD12)
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   39 and name HD13)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   39 and name HD12)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   39 and name HD12) (segid "   A" and resid   98 and name   HN) 3.441 1.480 1.480 weight 1.000 ! spec=13Cnoesy, no=2900, id=2403, vol=1.148000e+03
    or (segid "   A" and resid   39 and name HD11) (segid "   A" and resid   98 and name   HN)
    or (segid "   A" and resid   39 and name HD13) (segid "   A" and resid   98 and name   HN)
assign (segid "   B" and resid   39 and name HD12) (segid "   B" and resid   98 and name   HN) 3.441 1.480 1.480 weight 1.000 ! spec=13Cnoesy, no=2900, id=2403, vol=1.148000e+03
    or (segid "   B" and resid   39 and name HD11) (segid "   B" and resid   98 and name   HN)
    or (segid "   B" and resid   39 and name HD13) (segid "   B" and resid   98 and name   HN)
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name HD12) 2.346 0.688 0.688 weight 1.000 ! spec=13Cnoesy, no=2901, id=2404, vol=3.551000e+03
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   39 and name  HB2) (segid "   B" and resid   39 and name HD12) 2.346 0.688 0.688 weight 1.000 ! spec=13Cnoesy, no=2901, id=2404, vol=3.551000e+03
    or (segid "   B" and resid   39 and name  HB2) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   39 and name  HB2) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   39 and name HD12) 1.804 0.407 0.407 weight 1.000 ! spec=13Cnoesy, no=2902, id=2405, vol=6.259000e+03
    or (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   39 and name HD12) 1.804 0.407 0.407 weight 1.000 ! spec=13Cnoesy, no=2902, id=2405, vol=6.259000e+03
    or (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   39 and name HD12) (segid "   A" and resid   39 and name   HN) 3.818 1.822 1.822 weight 1.000 ! spec=13Cnoesy, no=2904, id=2407, vol=1.563000e+03
    or (segid "   A" and resid   39 and name HD11) (segid "   A" and resid   39 and name   HN)
    or (segid "   A" and resid   39 and name HD13) (segid "   A" and resid   39 and name   HN)
assign (segid "   B" and resid   39 and name HD12) (segid "   B" and resid   39 and name   HN) 3.818 1.822 1.822 weight 1.000 ! spec=13Cnoesy, no=2904, id=2407, vol=1.563000e+03
    or (segid "   B" and resid   39 and name HD11) (segid "   B" and resid   39 and name   HN)
    or (segid "   B" and resid   39 and name HD13) (segid "   B" and resid   39 and name   HN)
assign (segid "   A" and resid   92 and name   HB) (segid "   A" and resid   39 and name HD12) 2.391 0.714 0.714 weight 1.000 ! spec=13Cnoesy, no=2905, id=2408, vol=2.134000e+03
    or (segid "   A" and resid   92 and name   HB) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   92 and name   HB) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   92 and name   HB) (segid "   B" and resid   39 and name HD12) 2.391 0.714 0.714 weight 1.000 ! spec=13Cnoesy, no=2905, id=2408, vol=2.134000e+03
    or (segid "   B" and resid   92 and name   HB) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   92 and name   HB) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   28 and name   HA) 3.536 1.563 1.563 weight 1.000 ! spec=13Cnoesy, no=2908, id=2410, vol=7.145000e+02
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   28 and name   HA)
assign (segid "   B" and resid   38 and name HG22) (segid "   B" and resid   28 and name   HA) 3.536 1.563 1.563 weight 1.000 ! spec=13Cnoesy, no=2908, id=2410, vol=7.145000e+02
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid   28 and name   HA)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid   28 and name   HA)
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   91 and name   HA) 3.877 1.879 1.879 weight 1.000 ! spec=13Cnoesy, no=2911, id=2413, vol=8.110000e+02
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   91 and name   HA)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   91 and name   HA)
assign (segid "   B" and resid   38 and name HG22) (segid "   B" and resid   91 and name   HA) 3.877 1.879 1.879 weight 1.000 ! spec=13Cnoesy, no=2911, id=2413, vol=8.110000e+02
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid   91 and name   HA)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid   91 and name   HA)
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name HG22) 1.670 0.349 0.349 weight 1.000 ! spec=13Cnoesy, no=2913, id=2415, vol=6.870000e+03
    or (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name HG23)
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HG22)
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name HG23)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   38 and name HG22)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   38 and name HG23)
assign (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   38 and name HG22) 1.670 0.349 0.349 weight 1.000 ! spec=13Cnoesy, no=2913, id=2415, vol=6.870000e+03
    or (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   38 and name HG23)
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   38 and name HG22)
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   38 and name HG23)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   38 and name HG22)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   38 and name HG23)
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name HG22) 1.940 0.471 0.471 weight 1.000 ! spec=13Cnoesy, no=2914, id=2416, vol=3.915000e+03
    or (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name HG23)
assign (segid "   B" and resid   38 and name   HB) (segid "   B" and resid   38 and name HG22) 1.940 0.471 0.471 weight 1.000 ! spec=13Cnoesy, no=2914, id=2416, vol=3.915000e+03
    or (segid "   B" and resid   38 and name   HB) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   38 and name   HB) (segid "   B" and resid   38 and name HG23)
assign (segid "   A" and resid  102 and name HG12) (segid "   A" and resid   38 and name HG22) 2.503 2.503 3.497 weight 1.000 ! spec=13Cnoesy, no=2915, id=2417, vol=2.837000e+03
    or (segid "   A" and resid  102 and name HG12) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid  102 and name HG12) (segid "   A" and resid   38 and name HG23)
assign (segid "   B" and resid  102 and name HG12) (segid "   B" and resid   38 and name HG22) 2.503 2.503 3.497 weight 1.000 ! spec=13Cnoesy, no=2915, id=2417, vol=2.837000e+03
    or (segid "   B" and resid  102 and name HG12) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid  102 and name HG12) (segid "   B" and resid   38 and name HG23)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   38 and name HG22) 3.278 1.344 1.344 weight 1.000 ! spec=13Cnoesy, no=2918, id=2420, vol=1.002000e+03
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   38 and name HG23)
assign (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   38 and name HG22) 3.278 1.344 1.344 weight 1.000 ! spec=13Cnoesy, no=2918, id=2420, vol=1.002000e+03
    or (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   38 and name HG23)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG22) 2.452 0.752 0.752 weight 1.000 ! spec=13Cnoesy, no=2920, id=2422, vol=1.992000e+03
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name HG23)
assign (segid "   B" and resid   38 and name   HA) (segid "   B" and resid   38 and name HG22) 2.452 0.752 0.752 weight 1.000 ! spec=13Cnoesy, no=2920, id=2422, vol=1.992000e+03
    or (segid "   B" and resid   38 and name   HA) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   38 and name   HA) (segid "   B" and resid   38 and name HG23)
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   38 and name HG22) 1.321 1.321 4.679 weight 1.000 ! spec=13Cnoesy, no=2921, id=2423, vol=7.272000e+03
    or (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   38 and name HG23)
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   38 and name HG22)
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   38 and name HG23)
    or (segid "   A" and resid   28 and name  HB3) (segid "   A" and resid   38 and name HG22)
    or (segid "   A" and resid   28 and name  HB3) (segid "   A" and resid   38 and name HG21)
    or (segid "   A" and resid   28 and name  HB3) (segid "   A" and resid   38 and name HG23)
assign (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   38 and name HG22) 1.321 1.321 4.679 weight 1.000 ! spec=13Cnoesy, no=2921, id=2423, vol=7.272000e+03
    or (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   38 and name HG23)
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   38 and name HG22)
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   38 and name HG23)
    or (segid "   B" and resid   28 and name  HB3) (segid "   B" and resid   38 and name HG22)
    or (segid "   B" and resid   28 and name  HB3) (segid "   B" and resid   38 and name HG21)
    or (segid "   B" and resid   28 and name  HB3) (segid "   B" and resid   38 and name HG23)
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name   HA) 3.189 1.271 1.271 weight 1.000 ! spec=13Cnoesy, no=2923, id=2425, vol=3.551000e+03
assign (segid "   B" and resid   35 and name  HB2) (segid "   B" and resid   35 and name   HA) 3.189 1.271 1.271 weight 1.000 ! spec=13Cnoesy, no=2923, id=2425, vol=3.551000e+03
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   35 and name  HB2) 4.200 2.205 2.205 weight 1.000 ! spec=13Cnoesy, no=2924, id=2426, vol=1.638000e+03
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   35 and name  HB2) 4.200 2.205 2.205 weight 1.000 ! spec=13Cnoesy, no=2924, id=2426, vol=1.638000e+03
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   44 and name HG22) 5.027 3.159 3.159 weight 1.000 ! spec=13Cnoesy, no=2933, id=2433, vol=1.150000e+03
    or (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   44 and name HG22) 5.027 3.159 3.159 weight 1.000 ! spec=13Cnoesy, no=2933, id=2433, vol=1.150000e+03
    or (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name HG22) 2.060 0.530 0.530 weight 1.000 ! spec=13Cnoesy, no=2934, id=2434, vol=4.187000e+03
    or (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name HG22) 2.060 0.530 0.530 weight 1.000 ! spec=13Cnoesy, no=2934, id=2434, vol=4.187000e+03
    or (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   44 and name HD12) (segid "   A" and resid   44 and name HG22) 2.169 0.588 0.588 weight 1.000 ! spec=13Cnoesy, no=2940, id=2439, vol=3.847000e+03
    or (segid "   A" and resid   44 and name HD12) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   44 and name HD12) (segid "   A" and resid   44 and name HG23)
    or (segid "   A" and resid   44 and name HD11) (segid "   A" and resid   44 and name HG22)
    or (segid "   A" and resid   44 and name HD11) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   44 and name HD11) (segid "   A" and resid   44 and name HG23)
    or (segid "   A" and resid   44 and name HD13) (segid "   A" and resid   44 and name HG22)
    or (segid "   A" and resid   44 and name HD13) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   44 and name HD13) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   44 and name HD12) (segid "   B" and resid   44 and name HG22) 2.169 0.588 0.588 weight 1.000 ! spec=13Cnoesy, no=2940, id=2439, vol=3.847000e+03
    or (segid "   B" and resid   44 and name HD12) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   44 and name HD12) (segid "   B" and resid   44 and name HG23)
    or (segid "   B" and resid   44 and name HD11) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   44 and name HD11) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   44 and name HD11) (segid "   B" and resid   44 and name HG23)
    or (segid "   B" and resid   44 and name HD13) (segid "   B" and resid   44 and name HG22)
    or (segid "   B" and resid   44 and name HD13) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   44 and name HD13) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   44 and name HG12) (segid "   A" and resid   44 and name HG22) 2.092 0.547 0.547 weight 1.000 ! spec=13Cnoesy, no=2942, id=2440, vol=7.011000e+03
    or (segid "   A" and resid   44 and name HG12) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   44 and name HG12) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   44 and name HG12) (segid "   B" and resid   44 and name HG22) 2.092 0.547 0.547 weight 1.000 ! spec=13Cnoesy, no=2942, id=2440, vol=7.011000e+03
    or (segid "   B" and resid   44 and name HG12) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   44 and name HG12) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG21) 1.753 0.384 0.384 weight 1.000 ! spec=13Cnoesy, no=2944, id=2442, vol=8.965000e+03
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG23)
assign (segid "   B" and resid   37 and name   HB) (segid "   B" and resid   37 and name HG21) 1.753 0.384 0.384 weight 1.000 ! spec=13Cnoesy, no=2944, id=2442, vol=8.965000e+03
    or (segid "   B" and resid   37 and name   HB) (segid "   B" and resid   37 and name HG22)
    or (segid "   B" and resid   37 and name   HB) (segid "   B" and resid   37 and name HG23)
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HE1) 5.163 3.332 3.332 weight 1.000 ! spec=13Cnoesy, no=2945, id=2443, vol=9.577000e+02
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   34 and name  HE1) 5.163 3.332 3.332 weight 1.000 ! spec=13Cnoesy, no=2945, id=2443, vol=9.577000e+02
assign (segid "   A" and resid   34 and name  HD2) (segid "   A" and resid   34 and name  HE1) 1.889 0.446 0.446 weight 1.000 ! spec=13Cnoesy, no=2946, id=2444, vol=1.668000e+04
assign (segid "   B" and resid   34 and name  HD2) (segid "   B" and resid   34 and name  HE1) 1.889 0.446 0.446 weight 1.000 ! spec=13Cnoesy, no=2946, id=2444, vol=1.668000e+04
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name  HE1) 4.330 2.343 2.343 weight 1.000 ! spec=13Cnoesy, no=2947, id=2445, vol=1.453000e+03
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   34 and name  HE1) 4.330 2.343 2.343 weight 1.000 ! spec=13Cnoesy, no=2947, id=2445, vol=1.453000e+03
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name  HE1) 2.178 0.593 0.593 weight 1.000 ! spec=13Cnoesy, no=2948, id=2446, vol=6.251000e+03
assign (segid "   B" and resid   34 and name  HG1) (segid "   B" and resid   34 and name  HE1) 2.178 0.593 0.593 weight 1.000 ! spec=13Cnoesy, no=2948, id=2446, vol=6.251000e+03
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name  HE1) 2.186 0.597 0.597 weight 1.000 ! spec=13Cnoesy, no=2949, id=2447, vol=5.745000e+03
assign (segid "   B" and resid   34 and name  HG2) (segid "   B" and resid   34 and name  HE1) 2.186 0.597 0.597 weight 1.000 ! spec=13Cnoesy, no=2949, id=2447, vol=5.745000e+03
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name  HE1) 3.505 1.536 1.536 weight 1.000 ! spec=13Cnoesy, no=2950, id=2448, vol=5.367000e+03
assign (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   34 and name  HE1) 3.505 1.536 1.536 weight 1.000 ! spec=13Cnoesy, no=2950, id=2448, vol=5.367000e+03
assign (segid "   A" and resid   58 and name  HB1) (segid "   A" and resid   59 and name  HB1) 5.170 3.341 3.341 weight 1.000 ! spec=13Cnoesy, no=2954, id=2451, vol=5.772000e+02
assign (segid "   B" and resid   58 and name  HB1) (segid "   B" and resid   59 and name  HB1) 5.170 3.341 3.341 weight 1.000 ! spec=13Cnoesy, no=2954, id=2451, vol=5.772000e+02
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    5 and name  HG2) 5.354 3.583 3.583 weight 1.000 ! spec=13Cnoesy, no=2965, id=2460, vol=5.964000e+02
assign (segid "   B" and resid    7 and name  HB2) (segid "   B" and resid    5 and name  HG2) 5.354 3.583 3.583 weight 1.000 ! spec=13Cnoesy, no=2965, id=2460, vol=5.964000e+02
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid   10 and name  HA1) 5.609 3.932 3.932 weight 1.000 ! spec=13Cnoesy, no=2969, id=2464, vol=4.028000e+02
assign (segid "   B" and resid    7 and name  HB2) (segid "   B" and resid   10 and name  HA1) 5.609 3.932 3.932 weight 1.000 ! spec=13Cnoesy, no=2969, id=2464, vol=4.028000e+02
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HB2) 3.075 1.182 1.182 weight 1.000 ! spec=13Cnoesy, no=2970, id=2465, vol=1.642000e+03
assign (segid "   B" and resid    7 and name   HA) (segid "   B" and resid    7 and name  HB2) 3.075 1.182 1.182 weight 1.000 ! spec=13Cnoesy, no=2970, id=2465, vol=1.642000e+03
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name  HE1) 4.576 2.617 2.617 weight 1.000 ! spec=13Cnoesy, no=2971, id=2466, vol=1.141000e+03
assign (segid "   B" and resid    7 and name  HB2) (segid "   B" and resid    7 and name  HE1) 4.576 2.617 2.617 weight 1.000 ! spec=13Cnoesy, no=2971, id=2466, vol=1.141000e+03
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name HD22) 2.049 0.525 0.525 weight 1.000 ! spec=13Cnoesy, no=2985, id=2475, vol=8.602000e+03
    or (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name HD23)
assign (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name HD22) 2.049 0.525 0.525 weight 1.000 ! spec=13Cnoesy, no=2985, id=2475, vol=8.602000e+03
    or (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name HD23)
assign (segid "   A" and resid   39 and name HD22) (segid "   A" and resid   41 and name   HN) 4.437 2.461 2.461 weight 1.000 ! spec=13Cnoesy, no=2987, id=2477, vol=7.698000e+02
    or (segid "   A" and resid   39 and name HD21) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   39 and name HD23) (segid "   A" and resid   41 and name   HN)
assign (segid "   B" and resid   39 and name HD22) (segid "   B" and resid   41 and name   HN) 4.437 2.461 2.461 weight 1.000 ! spec=13Cnoesy, no=2987, id=2477, vol=7.698000e+02
    or (segid "   B" and resid   39 and name HD21) (segid "   B" and resid   41 and name   HN)
    or (segid "   B" and resid   39 and name HD23) (segid "   B" and resid   41 and name   HN)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name HD22) 2.176 0.592 0.592 weight 1.000 ! spec=13Cnoesy, no=2990, id=2480, vol=5.809000e+03
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name HD23)
assign (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name HD22) 2.176 0.592 0.592 weight 1.000 ! spec=13Cnoesy, no=2990, id=2480, vol=5.809000e+03
    or (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name HD23)
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name HD22) 3.041 1.156 1.156 weight 1.000 ! spec=13Cnoesy, no=2991, id=2481, vol=2.901000e+03
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name HD23)
assign (segid "   B" and resid   39 and name  HB2) (segid "   B" and resid   39 and name HD22) 3.041 1.156 1.156 weight 1.000 ! spec=13Cnoesy, no=2991, id=2481, vol=2.901000e+03
    or (segid "   B" and resid   39 and name  HB2) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   39 and name  HB2) (segid "   B" and resid   39 and name HD23)
assign (segid "   A" and resid   39 and name HD22) (segid "   A" and resid   91 and name   HA) 4.105 2.107 2.107 weight 1.000 ! spec=13Cnoesy, no=2992, id=2482, vol=7.045000e+02
    or (segid "   A" and resid   39 and name HD21) (segid "   A" and resid   91 and name   HA)
    or (segid "   A" and resid   39 and name HD23) (segid "   A" and resid   91 and name   HA)
assign (segid "   B" and resid   39 and name HD22) (segid "   B" and resid   91 and name   HA) 4.105 2.107 2.107 weight 1.000 ! spec=13Cnoesy, no=2992, id=2482, vol=7.045000e+02
    or (segid "   B" and resid   39 and name HD21) (segid "   B" and resid   91 and name   HA)
    or (segid "   B" and resid   39 and name HD23) (segid "   B" and resid   91 and name   HA)
assign (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   39 and name HD22) 1.817 0.413 0.413 weight 1.000 ! spec=13Cnoesy, no=2993, id=2483, vol=5.906000e+03
    or (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   39 and name HD21)
    or (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   39 and name HD23)
assign (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   39 and name HD22) 1.817 0.413 0.413 weight 1.000 ! spec=13Cnoesy, no=2993, id=2483, vol=5.906000e+03
    or (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   39 and name HD21)
    or (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   39 and name HD23)
assign (segid "   A" and resid   39 and name HD22) (segid "   A" and resid   40 and name   HN) 3.862 1.864 1.864 weight 1.000 ! spec=13Cnoesy, no=2996, id=2486, vol=2.034000e+03
    or (segid "   A" and resid   39 and name HD21) (segid "   A" and resid   40 and name   HN)
    or (segid "   A" and resid   39 and name HD23) (segid "   A" and resid   40 and name   HN)
assign (segid "   B" and resid   39 and name HD22) (segid "   B" and resid   40 and name   HN) 3.862 1.864 1.864 weight 1.000 ! spec=13Cnoesy, no=2996, id=2486, vol=2.034000e+03
    or (segid "   B" and resid   39 and name HD21) (segid "   B" and resid   40 and name   HN)
    or (segid "   B" and resid   39 and name HD23) (segid "   B" and resid   40 and name   HN)
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name  HE1) 5.560 3.864 3.864 weight 1.000 ! spec=13Cnoesy, no=3004, id=2490, vol=3.480000e+02
assign (segid "   B" and resid   86 and name  HB2) (segid "   B" and resid   86 and name  HE1) 5.560 3.864 3.864 weight 1.000 ! spec=13Cnoesy, no=3004, id=2490, vol=3.480000e+02
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name HG21) 2.450 0.751 0.751 weight 1.000 ! spec=13Cnoesy, no=3005, id=2491, vol=2.941000e+03
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name HG22)
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name HG23)
assign (segid "   B" and resid   82 and name   HA) (segid "   B" and resid   82 and name HG21) 2.450 0.751 0.751 weight 1.000 ! spec=13Cnoesy, no=3005, id=2491, vol=2.941000e+03
    or (segid "   B" and resid   82 and name   HA) (segid "   B" and resid   82 and name HG22)
    or (segid "   B" and resid   82 and name   HA) (segid "   B" and resid   82 and name HG23)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG21) 2.218 0.615 0.615 weight 1.000 ! spec=13Cnoesy, no=3006, id=2492, vol=3.579000e+03
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG22)
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG23)
assign (segid "   B" and resid   82 and name   HB) (segid "   B" and resid   82 and name HG21) 2.218 0.615 0.615 weight 1.000 ! spec=13Cnoesy, no=3006, id=2492, vol=3.579000e+03
    or (segid "   B" and resid   82 and name   HB) (segid "   B" and resid   82 and name HG22)
    or (segid "   B" and resid   82 and name   HB) (segid "   B" and resid   82 and name HG23)
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid   56 and name   HB) 3.615 1.633 1.633 weight 1.000 ! spec=13Cnoesy, no=3010, id=2496, vol=9.463000e+02
assign (segid "   B" and resid  105 and name  HB2) (segid "   B" and resid   56 and name   HB) 3.615 1.633 1.633 weight 1.000 ! spec=13Cnoesy, no=3010, id=2496, vol=9.463000e+02
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  105 and name   HA) 3.280 1.345 1.345 weight 1.000 ! spec=13Cnoesy, no=3011, id=2497, vol=7.758000e+02
assign (segid "   B" and resid  105 and name  HB2) (segid "   B" and resid  105 and name   HA) 3.280 1.345 1.345 weight 1.000 ! spec=13Cnoesy, no=3011, id=2497, vol=7.758000e+02
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   50 and name   HN) 5.100 3.251 3.251 weight 1.000 ! spec=13Cnoesy, no=3012, id=2498, vol=1.005000e+03
assign (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   50 and name   HN) 5.100 3.251 3.251 weight 1.000 ! spec=13Cnoesy, no=3012, id=2498, vol=1.005000e+03
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name  HD2) 2.151 0.578 0.578 weight 1.000 ! spec=13Cnoesy, no=3014, id=2500, vol=9.408000e+03
assign (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   50 and name  HD2) 2.151 0.578 0.578 weight 1.000 ! spec=13Cnoesy, no=3014, id=2500, vol=9.408000e+03
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   50 and name  HD2) 4.309 2.321 2.321 weight 1.000 ! spec=13Cnoesy, no=3015, id=2501, vol=2.281000e+03
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   50 and name  HD2) 4.309 2.321 2.321 weight 1.000 ! spec=13Cnoesy, no=3015, id=2501, vol=2.281000e+03
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   50 and name   HA) 5.794 4.196 4.196 weight 1.000 ! spec=13Cnoesy, no=3016, id=2502, vol=3.550000e+02
assign (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   50 and name   HA) 5.794 4.196 4.196 weight 1.000 ! spec=13Cnoesy, no=3016, id=2502, vol=3.550000e+02
assign (segid "   A" and resid   50 and name  HG2) (segid "   A" and resid   50 and name  HD2) 2.385 0.711 0.711 weight 1.000 ! spec=13Cnoesy, no=3018, id=2504, vol=5.407000e+03
assign (segid "   B" and resid   50 and name  HG2) (segid "   B" and resid   50 and name  HD2) 2.385 0.711 0.711 weight 1.000 ! spec=13Cnoesy, no=3018, id=2504, vol=5.407000e+03
assign (segid "   A" and resid   50 and name  HG1) (segid "   A" and resid   50 and name  HD2) 2.834 1.004 1.004 weight 1.000 ! spec=13Cnoesy, no=3020, id=2505, vol=5.713000e+03
assign (segid "   B" and resid   50 and name  HG1) (segid "   B" and resid   50 and name  HD2) 2.834 1.004 1.004 weight 1.000 ! spec=13Cnoesy, no=3020, id=2505, vol=5.713000e+03
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name   HA) 3.372 1.422 1.422 weight 1.000 ! spec=13Cnoesy, no=3021, id=2506, vol=1.425000e+03
assign (segid "   B" and resid    9 and name  HG2) (segid "   B" and resid    9 and name   HA) 3.372 1.422 1.422 weight 1.000 ! spec=13Cnoesy, no=3021, id=2506, vol=1.425000e+03
assign (segid "   A" and resid    9 and name  HG1) (segid "   A" and resid    9 and name   HA) 3.695 1.707 1.707 weight 1.000 ! spec=13Cnoesy, no=3023, id=2507, vol=1.302000e+03
assign (segid "   B" and resid    9 and name  HG1) (segid "   B" and resid    9 and name   HA) 3.695 1.707 1.707 weight 1.000 ! spec=13Cnoesy, no=3023, id=2507, vol=1.302000e+03
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    9 and name   HA) 2.960 1.095 1.095 weight 1.000 ! spec=13Cnoesy, no=3025, id=2509, vol=2.239000e+03
assign (segid "   B" and resid    9 and name  HB1) (segid "   B" and resid    9 and name   HA) 2.960 1.095 1.095 weight 1.000 ! spec=13Cnoesy, no=3025, id=2509, vol=2.239000e+03
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   29 and name   HN) 4.155 2.158 2.158 weight 1.000 ! spec=13Cnoesy, no=3028, id=2512, vol=5.070000e+02
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   29 and name   HN)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   29 and name   HN) 4.155 2.158 2.158 weight 1.000 ! spec=13Cnoesy, no=3028, id=2512, vol=5.070000e+02
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   29 and name   HN)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   29 and name   HN)
assign (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name  HD1) 4.396 2.415 2.415 weight 1.000 ! spec=13CnoesyARO, no=2, id=6482, vol=5.637000e+02
assign (segid "   B" and resid  101 and name   HA) (segid "   B" and resid  101 and name  HD1) 4.396 2.415 2.415 weight 1.000 ! spec=13CnoesyARO, no=2, id=6482, vol=5.637000e+02
assign (segid "   A" and resid   31 and name HG22) (segid "   A" and resid  101 and name  HD1) 4.801 2.881 2.881 weight 1.000 ! spec=13CnoesyARO, no=3, id=6483, vol=3.927000e+02
    or (segid "   A" and resid   31 and name HG21) (segid "   A" and resid  101 and name  HD1)
    or (segid "   A" and resid   31 and name HG23) (segid "   A" and resid  101 and name  HD1)
assign (segid "   B" and resid   31 and name HG22) (segid "   B" and resid  101 and name  HD1) 4.801 2.881 2.881 weight 1.000 ! spec=13CnoesyARO, no=3, id=6483, vol=3.927000e+02
    or (segid "   B" and resid   31 and name HG21) (segid "   B" and resid  101 and name  HD1)
    or (segid "   B" and resid   31 and name HG23) (segid "   B" and resid  101 and name  HD1)
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  101 and name  HD1) 3.761 1.769 1.769 weight 1.000 ! spec=13CnoesyARO, no=4, id=6484, vol=1.211000e+03
assign (segid "   B" and resid  101 and name  HB2) (segid "   B" and resid  101 and name  HD1) 3.761 1.769 1.769 weight 1.000 ! spec=13CnoesyARO, no=4, id=6484, vol=1.211000e+03
assign (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  101 and name  HD1) 4.395 2.415 2.415 weight 1.000 ! spec=13CnoesyARO, no=6, id=6485, vol=4.143000e+02
assign (segid "   B" and resid  101 and name  HB1) (segid "   B" and resid  101 and name  HD1) 4.395 2.415 2.415 weight 1.000 ! spec=13CnoesyARO, no=6, id=6485, vol=4.143000e+02
assign (segid "   A" and resid   86 and name   HZ) (segid "   A" and resid   86 and name  HE1) 3.700 1.712 1.712 weight 1.000 ! spec=13CnoesyARO, no=7, id=6486, vol=1.069000e+03
assign (segid "   B" and resid   86 and name   HZ) (segid "   B" and resid   86 and name  HE1) 3.700 1.712 1.712 weight 1.000 ! spec=13CnoesyARO, no=7, id=6486, vol=1.069000e+03
assign (segid "   A" and resid   86 and name  HD1) (segid "   A" and resid   86 and name  HE1) 3.780 1.786 1.786 weight 1.000 ! spec=13CnoesyARO, no=8, id=6487, vol=2.909000e+03
assign (segid "   B" and resid   86 and name  HD1) (segid "   B" and resid   86 and name  HE1) 3.780 1.786 1.786 weight 1.000 ! spec=13CnoesyARO, no=8, id=6487, vol=2.909000e+03
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name  HE1) 4.996 3.120 3.120 weight 1.000 ! spec=13CnoesyARO, no=9, id=6488, vol=4.585000e+02
assign (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   86 and name  HE1) 4.996 3.120 3.120 weight 1.000 ! spec=13CnoesyARO, no=9, id=6488, vol=4.585000e+02
assign (segid "   A" and resid   31 and name HG12) (segid "   A" and resid   86 and name  HE1) 6.104 4.657 4.657 weight 1.000 ! spec=13CnoesyARO, no=12, id=6491, vol=3.035000e+02
assign (segid "   B" and resid   31 and name HG12) (segid "   B" and resid   86 and name  HE1) 6.104 4.657 4.657 weight 1.000 ! spec=13CnoesyARO, no=12, id=6491, vol=3.035000e+02
assign (segid "   A" and resid   86 and name  HD1) (segid "   A" and resid   85 and name   HA) 4.116 2.118 2.118 weight 1.000 ! spec=13CnoesyARO, no=14, id=6492, vol=1.270000e+03
assign (segid "   B" and resid   86 and name  HD1) (segid "   B" and resid   85 and name   HA) 4.116 2.118 2.118 weight 1.000 ! spec=13CnoesyARO, no=14, id=6492, vol=1.270000e+03
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name  HD1) 4.202 2.207 2.207 weight 1.000 ! spec=13CnoesyARO, no=15, id=6493, vol=6.177000e+02
assign (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   86 and name  HD1) 4.202 2.207 2.207 weight 1.000 ! spec=13CnoesyARO, no=15, id=6493, vol=6.177000e+02
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   86 and name  HD1) 3.456 1.493 1.493 weight 1.000 ! spec=13CnoesyARO, no=17, id=6495, vol=2.176000e+03
assign (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   86 and name  HD1) 3.456 1.493 1.493 weight 1.000 ! spec=13CnoesyARO, no=17, id=6495, vol=2.176000e+03
assign (segid "   A" and resid   86 and name  HD1) (segid "   A" and resid  103 and name  HG1) 4.825 2.911 2.911 weight 1.000 ! spec=13CnoesyARO, no=18, id=6496, vol=9.989000e+02
assign (segid "   B" and resid   86 and name  HD1) (segid "   B" and resid  103 and name  HG1) 4.825 2.911 2.911 weight 1.000 ! spec=13CnoesyARO, no=18, id=6496, vol=9.989000e+02
assign (segid "   A" and resid   86 and name  HD1) (segid "   A" and resid   86 and name  HB2) 4.152 2.155 2.155 weight 1.000 ! spec=13CnoesyARO, no=21, id=6497, vol=6.633000e+02
assign (segid "   B" and resid   86 and name  HD1) (segid "   B" and resid   86 and name  HB2) 4.152 2.155 2.155 weight 1.000 ! spec=13CnoesyARO, no=21, id=6497, vol=6.633000e+02
assign (segid "   A" and resid   79 and name  HE1) (segid "   A" and resid   79 and name   HN) 5.215 3.399 3.399 weight 1.000 ! spec=13CnoesyARO, no=23, id=6499, vol=2.910000e+02
assign (segid "   B" and resid   79 and name  HE1) (segid "   B" and resid   79 and name   HN) 5.215 3.399 3.399 weight 1.000 ! spec=13CnoesyARO, no=23, id=6499, vol=2.910000e+02
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   79 and name  HE1) 5.240 3.432 3.432 weight 1.000 ! spec=13CnoesyARO, no=24, id=6500, vol=3.847000e+02
assign (segid "   B" and resid   79 and name  HB1) (segid "   B" and resid   79 and name  HE1) 5.240 3.432 3.432 weight 1.000 ! spec=13CnoesyARO, no=24, id=6500, vol=3.847000e+02
assign (segid "   A" and resid   79 and name  HD1) (segid "   A" and resid   79 and name  HE1) 3.161 1.249 1.249 weight 1.000 ! spec=13CnoesyARO, no=25, id=6501, vol=9.408000e+03
assign (segid "   B" and resid   79 and name  HD1) (segid "   B" and resid   79 and name  HE1) 3.161 1.249 1.249 weight 1.000 ! spec=13CnoesyARO, no=25, id=6501, vol=9.408000e+03
assign (segid "   A" and resid   81 and name   HB) (segid "   A" and resid   79 and name  HE1) 3.769 1.776 1.776 weight 1.000 ! spec=13CnoesyARO, no=26, id=6502, vol=1.790000e+03
assign (segid "   B" and resid   81 and name   HB) (segid "   B" and resid   79 and name  HE1) 3.769 1.776 1.776 weight 1.000 ! spec=13CnoesyARO, no=26, id=6502, vol=1.790000e+03
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   79 and name  HE1) 5.149 3.314 3.314 weight 1.000 ! spec=13CnoesyARO, no=27, id=6503, vol=4.360000e+02
assign (segid "   B" and resid   79 and name  HB2) (segid "   B" and resid   79 and name  HE1) 5.149 3.314 3.314 weight 1.000 ! spec=13CnoesyARO, no=27, id=6503, vol=4.360000e+02
assign (segid "   A" and resid   79 and name  HE1) (segid "   A" and resid   81 and name HG21) 3.595 1.615 1.615 weight 1.000 ! spec=13CnoesyARO, no=28, id=6504, vol=2.378000e+03
    or (segid "   A" and resid   79 and name  HE1) (segid "   A" and resid   81 and name HG22)
    or (segid "   A" and resid   79 and name  HE1) (segid "   A" and resid   81 and name HG23)
assign (segid "   B" and resid   79 and name  HE1) (segid "   B" and resid   81 and name HG21) 3.595 1.615 1.615 weight 1.000 ! spec=13CnoesyARO, no=28, id=6504, vol=2.378000e+03
    or (segid "   B" and resid   79 and name  HE1) (segid "   B" and resid   81 and name HG22)
    or (segid "   B" and resid   79 and name  HE1) (segid "   B" and resid   81 and name HG23)
assign (segid "   A" and resid  111 and name HG22) (segid "   A" and resid   79 and name  HE1) 3.108 1.207 1.207 weight 1.000 ! spec=13CnoesyARO, no=29, id=6505, vol=1.918000e+03
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid   79 and name  HE1)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid   79 and name  HE1)
assign (segid "   B" and resid  111 and name HG22) (segid "   B" and resid   79 and name  HE1) 3.108 1.207 1.207 weight 1.000 ! spec=13CnoesyARO, no=29, id=6505, vol=1.918000e+03
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid   79 and name  HE1)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid   79 and name  HE1)
assign (segid "   A" and resid  111 and name HG12) (segid "   A" and resid   79 and name  HE1) 3.540 1.567 1.567 weight 1.000 ! spec=13CnoesyARO, no=30, id=6506, vol=1.487000e+03
    or (segid "   A" and resid  111 and name HG11) (segid "   A" and resid   79 and name  HE1)
    or (segid "   A" and resid  111 and name HG13) (segid "   A" and resid   79 and name  HE1)
assign (segid "   B" and resid  111 and name HG12) (segid "   B" and resid   79 and name  HE1) 3.540 1.567 1.567 weight 1.000 ! spec=13CnoesyARO, no=30, id=6506, vol=1.487000e+03
    or (segid "   B" and resid  111 and name HG11) (segid "   B" and resid   79 and name  HE1)
    or (segid "   B" and resid  111 and name HG13) (segid "   B" and resid   79 and name  HE1)
assign (segid "   A" and resid  111 and name HG12) (segid "   A" and resid   79 and name  HD1) 3.744 1.752 1.752 weight 1.000 ! spec=13CnoesyARO, no=31, id=6507, vol=1.121000e+03
    or (segid "   A" and resid  111 and name HG11) (segid "   A" and resid   79 and name  HD1)
    or (segid "   A" and resid  111 and name HG13) (segid "   A" and resid   79 and name  HD1)
assign (segid "   B" and resid  111 and name HG12) (segid "   B" and resid   79 and name  HD1) 3.744 1.752 1.752 weight 1.000 ! spec=13CnoesyARO, no=31, id=6507, vol=1.121000e+03
    or (segid "   B" and resid  111 and name HG11) (segid "   B" and resid   79 and name  HD1)
    or (segid "   B" and resid  111 and name HG13) (segid "   B" and resid   79 and name  HD1)
assign (segid "   A" and resid   79 and name  HD1) (segid "   A" and resid   81 and name   HN) 5.242 3.434 3.434 weight 1.000 ! spec=13CnoesyARO, no=32, id=6508, vol=3.097000e+02
assign (segid "   B" and resid   79 and name  HD1) (segid "   B" and resid   81 and name   HN) 5.242 3.434 3.434 weight 1.000 ! spec=13CnoesyARO, no=32, id=6508, vol=3.097000e+02
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   79 and name  HD1) 3.522 1.551 1.551 weight 1.000 ! spec=13CnoesyARO, no=34, id=6510, vol=1.932000e+03
assign (segid "   B" and resid   79 and name  HB1) (segid "   B" and resid   79 and name  HD1) 3.522 1.551 1.551 weight 1.000 ! spec=13CnoesyARO, no=34, id=6510, vol=1.932000e+03
assign (segid "   A" and resid   81 and name   HB) (segid "   A" and resid   79 and name  HD1) 3.533 1.560 1.560 weight 1.000 ! spec=13CnoesyARO, no=35, id=6511, vol=1.986000e+03
assign (segid "   B" and resid   81 and name   HB) (segid "   B" and resid   79 and name  HD1) 3.533 1.560 1.560 weight 1.000 ! spec=13CnoesyARO, no=35, id=6511, vol=1.986000e+03
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   79 and name  HD1) 3.499 1.530 1.530 weight 1.000 ! spec=13CnoesyARO, no=36, id=6512, vol=2.077000e+03
assign (segid "   B" and resid   79 and name  HB2) (segid "   B" and resid   79 and name  HD1) 3.499 1.530 1.530 weight 1.000 ! spec=13CnoesyARO, no=36, id=6512, vol=2.077000e+03
assign (segid "   A" and resid  111 and name HG22) (segid "   A" and resid   79 and name  HD1) 3.701 1.712 1.712 weight 1.000 ! spec=13CnoesyARO, no=38, id=6514, vol=8.552000e+02
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid   79 and name  HD1)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid   79 and name  HD1)
assign (segid "   B" and resid  111 and name HG22) (segid "   B" and resid   79 and name  HD1) 3.701 1.712 1.712 weight 1.000 ! spec=13CnoesyARO, no=38, id=6514, vol=8.552000e+02
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid   79 and name  HD1)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid   79 and name  HD1)
assign (segid "   A" and resid   79 and name  HD1) (segid "   A" and resid   79 and name   HA) 3.723 1.732 1.732 weight 1.000 ! spec=13CnoesyARO, no=39, id=6515, vol=2.808000e+03
assign (segid "   B" and resid   79 and name  HD1) (segid "   B" and resid   79 and name   HA) 3.723 1.732 1.732 weight 1.000 ! spec=13CnoesyARO, no=39, id=6515, vol=2.808000e+03
assign (segid "   A" and resid   54 and name   HZ) (segid "   A" and resid   54 and name  HE1) 3.793 1.799 1.799 weight 1.000 ! spec=13CnoesyARO, no=40, id=6516, vol=9.137000e+02
assign (segid "   B" and resid   54 and name   HZ) (segid "   B" and resid   54 and name  HE1) 3.793 1.799 1.799 weight 1.000 ! spec=13CnoesyARO, no=40, id=6516, vol=9.137000e+02
assign (segid "   A" and resid   54 and name  HD1) (segid "   A" and resid   54 and name  HB1) 4.154 2.157 2.157 weight 1.000 ! spec=13CnoesyARO, no=44, id=6519, vol=6.904000e+02
assign (segid "   B" and resid   54 and name  HD1) (segid "   B" and resid   54 and name  HB1) 4.154 2.157 2.157 weight 1.000 ! spec=13CnoesyARO, no=44, id=6519, vol=6.904000e+02
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   54 and name  HD1) 4.845 2.934 2.934 weight 1.000 ! spec=13CnoesyARO, no=45, id=6520, vol=2.764000e+02
assign (segid "   B" and resid   54 and name  HB2) (segid "   B" and resid   54 and name  HD1) 4.845 2.934 2.934 weight 1.000 ! spec=13CnoesyARO, no=45, id=6520, vol=2.764000e+02
assign (segid "   A" and resid   54 and name  HD1) (segid "   A" and resid   54 and name   HZ) 4.280 2.290 2.290 weight 1.000 ! spec=13CnoesyARO, no=46, id=6521, vol=1.076000e+03
assign (segid "   B" and resid   54 and name  HD1) (segid "   B" and resid   54 and name   HZ) 4.280 2.290 2.290 weight 1.000 ! spec=13CnoesyARO, no=46, id=6521, vol=1.076000e+03
assign (segid "   A" and resid   53 and name  HE1) (segid "   A" and resid   53 and name  HD1) 4.432 2.456 2.456 weight 1.000 ! spec=13CnoesyARO, no=53, id=6523, vol=1.017000e+03
assign (segid "   B" and resid   53 and name  HE1) (segid "   B" and resid   53 and name  HD1) 4.432 2.456 2.456 weight 1.000 ! spec=13CnoesyARO, no=53, id=6523, vol=1.017000e+03
assign (segid "   A" and resid   53 and name  HE1) (segid "   A" and resid   53 and name   HZ) 3.187 1.270 1.270 weight 1.000 ! spec=13CnoesyARO, no=56, id=6524, vol=2.210000e+03
assign (segid "   B" and resid   53 and name  HE1) (segid "   B" and resid   53 and name   HZ) 3.187 1.270 1.270 weight 1.000 ! spec=13CnoesyARO, no=56, id=6524, vol=2.210000e+03
assign (segid "   A" and resid   53 and name   HZ) (segid "   A" and resid   53 and name  HD1) 4.354 2.370 2.370 weight 1.000 ! spec=13CnoesyARO, no=58, id=6526, vol=8.221000e+02
assign (segid "   B" and resid   53 and name   HZ) (segid "   B" and resid   53 and name  HD1) 4.354 2.370 2.370 weight 1.000 ! spec=13CnoesyARO, no=58, id=6526, vol=8.221000e+02
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid  104 and name HG22) 3.576 1.598 1.598 weight 1.000 ! spec=13CnoesyARO, no=60, id=6528, vol=1.186000e+03
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid  104 and name HG21)
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid  104 and name HG23)
assign (segid "   B" and resid   53 and name  HD1) (segid "   B" and resid  104 and name HG22) 3.576 1.598 1.598 weight 1.000 ! spec=13CnoesyARO, no=60, id=6528, vol=1.186000e+03
    or (segid "   B" and resid   53 and name  HD1) (segid "   B" and resid  104 and name HG21)
    or (segid "   B" and resid   53 and name  HD1) (segid "   B" and resid  104 and name HG23)
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid   53 and name  HD1) 4.173 2.177 2.177 weight 1.000 ! spec=13CnoesyARO, no=61, id=6529, vol=6.572000e+02
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid   53 and name  HD1)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid   53 and name  HD1)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid   53 and name  HD1) 4.173 2.177 2.177 weight 1.000 ! spec=13CnoesyARO, no=61, id=6529, vol=6.572000e+02
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid   53 and name  HD1)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid   53 and name  HD1)
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   53 and name  HD1) 2.882 1.039 1.039 weight 1.000 ! spec=13CnoesyARO, no=62, id=6530, vol=1.573000e+03
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   53 and name  HD1)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   53 and name  HD1)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   53 and name  HD1) 2.882 1.039 1.039 weight 1.000 ! spec=13CnoesyARO, no=62, id=6530, vol=1.573000e+03
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   53 and name  HD1)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   53 and name  HD1)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   53 and name  HD1) 4.991 3.113 3.113 weight 1.000 ! spec=13CnoesyARO, no=63, id=6531, vol=7.236000e+02
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   53 and name  HD1)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   53 and name  HD1)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   53 and name  HD1) 4.991 3.113 3.113 weight 1.000 ! spec=13CnoesyARO, no=63, id=6531, vol=7.236000e+02
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   53 and name  HD1)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   53 and name  HD1)
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   53 and name  HD1) 4.771 2.845 2.845 weight 1.000 ! spec=13CnoesyARO, no=64, id=6532, vol=5.061000e+02
assign (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   53 and name  HD1) 4.771 2.845 2.845 weight 1.000 ! spec=13CnoesyARO, no=64, id=6532, vol=5.061000e+02
assign (segid "   A" and resid   87 and name   HB) (segid "   A" and resid   53 and name  HD1) 3.344 1.398 1.398 weight 1.000 ! spec=13CnoesyARO, no=67, id=6534, vol=4.038000e+02
assign (segid "   B" and resid   87 and name   HB) (segid "   B" and resid   53 and name  HD1) 3.344 1.398 1.398 weight 1.000 ! spec=13CnoesyARO, no=67, id=6534, vol=4.038000e+02
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   53 and name  HB1) 4.117 2.118 2.118 weight 1.000 ! spec=13CnoesyARO, no=68, id=6535, vol=5.523000e+02
assign (segid "   B" and resid   53 and name  HD1) (segid "   B" and resid   53 and name  HB1) 4.117 2.118 2.118 weight 1.000 ! spec=13CnoesyARO, no=68, id=6535, vol=5.523000e+02
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   25 and name   HN) 5.170 3.341 3.341 weight 1.000 ! spec=13CnoesyARO, no=70, id=6536, vol=2.771000e+02
assign (segid "   B" and resid   53 and name  HD1) (segid "   B" and resid   25 and name   HN) 5.170 3.341 3.341 weight 1.000 ! spec=13CnoesyARO, no=70, id=6536, vol=2.771000e+02
assign (segid "   A" and resid   87 and name HG22) (segid "   A" and resid   53 and name  HD1) 2.979 1.109 1.109 weight 1.000 ! spec=13CnoesyARO, no=71, id=6537, vol=2.063000e+03
    or (segid "   A" and resid   87 and name HG21) (segid "   A" and resid   53 and name  HD1)
    or (segid "   A" and resid   87 and name HG23) (segid "   A" and resid   53 and name  HD1)
assign (segid "   B" and resid   87 and name HG22) (segid "   B" and resid   53 and name  HD1) 2.979 1.109 1.109 weight 1.000 ! spec=13CnoesyARO, no=71, id=6537, vol=2.063000e+03
    or (segid "   B" and resid   87 and name HG21) (segid "   B" and resid   53 and name  HD1)
    or (segid "   B" and resid   87 and name HG23) (segid "   B" and resid   53 and name  HD1)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HD1) 4.731 2.798 2.798 weight 1.000 ! spec=13CnoesyARO, no=72, id=6538, vol=3.842000e+02
assign (segid "   B" and resid   53 and name   HA) (segid "   B" and resid   53 and name  HD1) 4.731 2.798 2.798 weight 1.000 ! spec=13CnoesyARO, no=72, id=6538, vol=3.842000e+02
assign (segid "   A" and resid   52 and name  HE1) (segid "   A" and resid   52 and name   HN) 5.265 3.466 3.466 weight 1.000 ! spec=13CnoesyARO, no=78, id=6539, vol=2.771000e+02
assign (segid "   B" and resid   52 and name  HE1) (segid "   B" and resid   52 and name   HN) 5.265 3.466 3.466 weight 1.000 ! spec=13CnoesyARO, no=78, id=6539, vol=2.771000e+02
assign (segid "   A" and resid   52 and name  HE1) (segid "   A" and resid   52 and name   HA) 5.488 3.765 3.765 weight 1.000 ! spec=13CnoesyARO, no=81, id=6541, vol=2.864000e+02
assign (segid "   B" and resid   52 and name  HE1) (segid "   B" and resid   52 and name   HA) 5.488 3.765 3.765 weight 1.000 ! spec=13CnoesyARO, no=81, id=6541, vol=2.864000e+02
assign (segid "   A" and resid   52 and name  HD1) (segid "   A" and resid   52 and name  HE1) 2.748 0.944 0.944 weight 1.000 ! spec=13CnoesyARO, no=82, id=6542, vol=2.179000e+04
assign (segid "   B" and resid   52 and name  HD1) (segid "   B" and resid   52 and name  HE1) 2.748 0.944 0.944 weight 1.000 ! spec=13CnoesyARO, no=82, id=6542, vol=2.179000e+04
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   52 and name  HE1) 3.223 1.298 1.298 weight 1.000 ! spec=13CnoesyARO, no=83, id=6543, vol=3.545000e+03
assign (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   52 and name  HE1) 3.223 1.298 1.298 weight 1.000 ! spec=13CnoesyARO, no=83, id=6543, vol=3.545000e+03
assign (segid "   A" and resid   52 and name  HE1) (segid "   A" and resid   52 and name  HB1) 3.806 1.811 1.811 weight 1.000 ! spec=13CnoesyARO, no=84, id=6544, vol=2.199000e+03
assign (segid "   B" and resid   52 and name  HE1) (segid "   B" and resid   52 and name  HB1) 3.806 1.811 1.811 weight 1.000 ! spec=13CnoesyARO, no=84, id=6544, vol=2.199000e+03
assign (segid "   A" and resid   50 and name  HG2) (segid "   A" and resid   52 and name  HE1) 4.054 2.054 2.054 weight 1.000 ! spec=13CnoesyARO, no=85, id=6545, vol=1.342000e+03
assign (segid "   B" and resid   50 and name  HG2) (segid "   B" and resid   52 and name  HE1) 4.054 2.054 2.054 weight 1.000 ! spec=13CnoesyARO, no=85, id=6545, vol=1.342000e+03
assign (segid "   A" and resid   52 and name  HE1) (segid "   A" and resid   50 and name  HD1) 4.117 2.119 2.119 weight 1.000 ! spec=13CnoesyARO, no=86, id=6546, vol=2.616000e+03
assign (segid "   B" and resid   52 and name  HE1) (segid "   B" and resid   50 and name  HD1) 4.117 2.119 2.119 weight 1.000 ! spec=13CnoesyARO, no=86, id=6546, vol=2.616000e+03
assign (segid "   A" and resid   52 and name  HE1) (segid "   A" and resid   52 and name  HB2) 3.793 1.798 1.798 weight 1.000 ! spec=13CnoesyARO, no=87, id=6547, vol=2.199000e+03
assign (segid "   B" and resid   52 and name  HE1) (segid "   B" and resid   52 and name  HB2) 3.793 1.798 1.798 weight 1.000 ! spec=13CnoesyARO, no=87, id=6547, vol=2.199000e+03
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   52 and name  HE1) 3.602 1.621 1.621 weight 1.000 ! spec=13CnoesyARO, no=88, id=6548, vol=2.199000e+03
assign (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   52 and name  HE1) 3.602 1.621 1.621 weight 1.000 ! spec=13CnoesyARO, no=88, id=6548, vol=2.199000e+03
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name  HD1) 5.323 3.542 3.542 weight 1.000 ! spec=13CnoesyARO, no=89, id=6549, vol=6.954000e+02
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   52 and name  HD1) 5.323 3.542 3.542 weight 1.000 ! spec=13CnoesyARO, no=89, id=6549, vol=6.954000e+02
assign (segid "   A" and resid   52 and name  HD1) (segid "   A" and resid   52 and name   HN) 4.410 2.431 2.431 weight 1.000 ! spec=13CnoesyARO, no=90, id=6550, vol=5.644000e+02
assign (segid "   B" and resid   52 and name  HD1) (segid "   B" and resid   52 and name   HN) 4.410 2.431 2.431 weight 1.000 ! spec=13CnoesyARO, no=90, id=6550, vol=5.644000e+02
assign (segid "   A" and resid   52 and name  HD1) (segid "   A" and resid   52 and name  HB1) 3.480 1.513 1.513 weight 1.000 ! spec=13CnoesyARO, no=93, id=6551, vol=1.746000e+03
assign (segid "   B" and resid   52 and name  HD1) (segid "   B" and resid   52 and name  HB1) 3.480 1.513 1.513 weight 1.000 ! spec=13CnoesyARO, no=93, id=6551, vol=1.746000e+03
assign (segid "   A" and resid   52 and name  HD1) (segid "   A" and resid   52 and name  HB2) 3.424 1.466 1.466 weight 1.000 ! spec=13CnoesyARO, no=95, id=6552, vol=1.746000e+03
assign (segid "   B" and resid   52 and name  HD1) (segid "   B" and resid   52 and name  HB2) 3.424 1.466 1.466 weight 1.000 ! spec=13CnoesyARO, no=95, id=6552, vol=1.746000e+03
assign (segid "   A" and resid   50 and name  HD2) (segid "   A" and resid   52 and name  HD1) 3.801 1.806 1.806 weight 1.000 ! spec=13CnoesyARO, no=96, id=6553, vol=1.746000e+03
assign (segid "   B" and resid   50 and name  HD2) (segid "   B" and resid   52 and name  HD1) 3.801 1.806 1.806 weight 1.000 ! spec=13CnoesyARO, no=96, id=6553, vol=1.746000e+03
assign (segid "   A" and resid   53 and name   HZ) (segid "   A" and resid   53 and name  HB2) 4.990 3.113 3.113 weight 1.000 ! spec=13CnoesyARO, no=99, id=6554, vol=2.871000e+02
assign (segid "   B" and resid   53 and name   HZ) (segid "   B" and resid   53 and name  HB2) 4.990 3.113 3.113 weight 1.000 ! spec=13CnoesyARO, no=99, id=6554, vol=2.871000e+02
assign (segid "   A" and resid   49 and name   HZ) (segid "   A" and resid   49 and name   HA) 5.157 3.324 3.324 weight 1.000 ! spec=13CnoesyARO, no=101, id=6555, vol=3.084000e+02
assign (segid "   B" and resid   49 and name   HZ) (segid "   B" and resid   49 and name   HA) 5.157 3.324 3.324 weight 1.000 ! spec=13CnoesyARO, no=101, id=6555, vol=3.084000e+02
assign (segid "   A" and resid   49 and name  HD1) (segid "   A" and resid   49 and name  HE1) 3.098 1.199 1.199 weight 1.000 ! spec=13CnoesyARO, no=106, id=6556, vol=1.065000e+04
assign (segid "   B" and resid   49 and name  HD1) (segid "   B" and resid   49 and name  HE1) 3.098 1.199 1.199 weight 1.000 ! spec=13CnoesyARO, no=106, id=6556, vol=1.065000e+04
assign (segid "   A" and resid   49 and name  HE1) (segid "   A" and resid   49 and name   HZ) 4.854 2.945 2.945 weight 1.000 ! spec=13CnoesyARO, no=108, id=6557, vol=2.618000e+02
assign (segid "   B" and resid   49 and name  HE1) (segid "   B" and resid   49 and name   HZ) 4.854 2.945 2.945 weight 1.000 ! spec=13CnoesyARO, no=108, id=6557, vol=2.618000e+02
assign (segid "   A" and resid   49 and name  HE1) (segid "   A" and resid   42 and name HG12) 4.161 2.164 2.164 weight 1.000 ! spec=13CnoesyARO, no=115, id=6560, vol=6.141000e+02
    or (segid "   A" and resid   49 and name  HE1) (segid "   A" and resid   42 and name HG11)
    or (segid "   A" and resid   49 and name  HE1) (segid "   A" and resid   42 and name HG13)
assign (segid "   B" and resid   49 and name  HE1) (segid "   B" and resid   42 and name HG12) 4.161 2.164 2.164 weight 1.000 ! spec=13CnoesyARO, no=115, id=6560, vol=6.141000e+02
    or (segid "   B" and resid   49 and name  HE1) (segid "   B" and resid   42 and name HG11)
    or (segid "   B" and resid   49 and name  HE1) (segid "   B" and resid   42 and name HG13)
assign (segid "   A" and resid   49 and name   HZ) (segid "   A" and resid   49 and name  HD1) 5.154 3.321 3.321 weight 1.000 ! spec=13CnoesyARO, no=116, id=6561, vol=4.168000e+02
assign (segid "   B" and resid   49 and name   HZ) (segid "   B" and resid   49 and name  HD1) 5.154 3.321 3.321 weight 1.000 ! spec=13CnoesyARO, no=116, id=6561, vol=4.168000e+02
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name  HD1) 3.599 1.619 1.619 weight 1.000 ! spec=13CnoesyARO, no=117, id=6562, vol=1.696000e+03
assign (segid "   B" and resid   49 and name  HB1) (segid "   B" and resid   49 and name  HD1) 3.599 1.619 1.619 weight 1.000 ! spec=13CnoesyARO, no=117, id=6562, vol=1.696000e+03
assign (segid "   A" and resid   49 and name  HD1) (segid "   A" and resid   49 and name   HA) 3.875 1.877 1.877 weight 1.000 ! spec=13CnoesyARO, no=118, id=6563, vol=1.730000e+03
assign (segid "   B" and resid   49 and name  HD1) (segid "   B" and resid   49 and name   HA) 3.875 1.877 1.877 weight 1.000 ! spec=13CnoesyARO, no=118, id=6563, vol=1.730000e+03
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   49 and name  HD1) 3.435 1.475 1.475 weight 1.000 ! spec=13CnoesyARO, no=120, id=6564, vol=7.688000e+02
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   49 and name  HD1) 3.435 1.475 1.475 weight 1.000 ! spec=13CnoesyARO, no=120, id=6564, vol=7.688000e+02
assign (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   49 and name  HD1) 3.784 1.790 1.790 weight 1.000 ! spec=13CnoesyARO, no=121, id=6565, vol=1.244000e+03
assign (segid "   B" and resid   49 and name  HB2) (segid "   B" and resid   49 and name  HD1) 3.784 1.790 1.790 weight 1.000 ! spec=13CnoesyARO, no=121, id=6565, vol=1.244000e+03
assign (segid "   A" and resid   49 and name  HD1) (segid "   A" and resid   44 and name   HN) 3.597 3.597 2.403 weight 1.000 ! spec=13CnoesyARO, no=123, id=6566, vol=1.431000e+03
assign (segid "   B" and resid   49 and name  HD1) (segid "   B" and resid   44 and name   HN) 3.597 3.597 2.403 weight 1.000 ! spec=13CnoesyARO, no=123, id=6566, vol=1.431000e+03
assign (segid "   A" and resid   44 and name HD12) (segid "   A" and resid   49 and name  HD1) 3.501 1.532 1.532 weight 1.000 ! spec=13CnoesyARO, no=124, id=6567, vol=1.284000e+03
    or (segid "   A" and resid   44 and name HD11) (segid "   A" and resid   49 and name  HD1)
    or (segid "   A" and resid   44 and name HD13) (segid "   A" and resid   49 and name  HD1)
assign (segid "   B" and resid   44 and name HD12) (segid "   B" and resid   49 and name  HD1) 3.501 1.532 1.532 weight 1.000 ! spec=13CnoesyARO, no=124, id=6567, vol=1.284000e+03
    or (segid "   B" and resid   44 and name HD11) (segid "   B" and resid   49 and name  HD1)
    or (segid "   B" and resid   44 and name HD13) (segid "   B" and resid   49 and name  HD1)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name  HD1) 4.137 2.139 2.139 weight 1.000 ! spec=13CnoesyARO, no=125, id=6568, vol=9.748000e+02
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   49 and name  HD1) 4.137 2.139 2.139 weight 1.000 ! spec=13CnoesyARO, no=125, id=6568, vol=9.748000e+02
assign (segid "   A" and resid   42 and name HG22) (segid "   A" and resid   49 and name  HD1) 3.729 1.738 1.738 weight 1.000 ! spec=13CnoesyARO, no=126, id=6569, vol=1.258000e+03
    or (segid "   A" and resid   42 and name HG21) (segid "   A" and resid   49 and name  HD1)
    or (segid "   A" and resid   42 and name HG23) (segid "   A" and resid   49 and name  HD1)
assign (segid "   B" and resid   42 and name HG22) (segid "   B" and resid   49 and name  HD1) 3.729 1.738 1.738 weight 1.000 ! spec=13CnoesyARO, no=126, id=6569, vol=1.258000e+03
    or (segid "   B" and resid   42 and name HG21) (segid "   B" and resid   49 and name  HD1)
    or (segid "   B" and resid   42 and name HG23) (segid "   B" and resid   49 and name  HD1)
assign (segid "   A" and resid   12 and name   HZ) (segid "   A" and resid   12 and name  HD1) 4.501 2.532 2.532 weight 1.000 ! spec=13CnoesyARO, no=129, id=6571, vol=7.758000e+02
assign (segid "   B" and resid   12 and name   HZ) (segid "   B" and resid   12 and name  HD1) 4.501 2.532 2.532 weight 1.000 ! spec=13CnoesyARO, no=129, id=6571, vol=7.758000e+02
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name  HD1) 5.002 3.128 3.128 weight 1.000 ! spec=13CnoesyARO, no=130, id=6572, vol=9.634000e+02
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   12 and name  HD1) 5.002 3.128 3.128 weight 1.000 ! spec=13CnoesyARO, no=130, id=6572, vol=9.634000e+02
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   12 and name  HD1) 3.722 1.732 1.732 weight 1.000 ! spec=13CnoesyARO, no=131, id=6573, vol=1.205000e+03
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   12 and name  HD1) 3.722 1.732 1.732 weight 1.000 ! spec=13CnoesyARO, no=131, id=6573, vol=1.205000e+03
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HD1) 3.945 1.946 1.946 weight 1.000 ! spec=13CnoesyARO, no=133, id=6574, vol=1.135000e+03
assign (segid "   B" and resid   12 and name   HA) (segid "   B" and resid   12 and name  HD1) 3.945 1.946 1.946 weight 1.000 ! spec=13CnoesyARO, no=133, id=6574, vol=1.135000e+03
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   12 and name  HD1) 3.743 1.752 1.752 weight 1.000 ! spec=13CnoesyARO, no=135, id=6576, vol=1.120000e+03
assign (segid "   B" and resid   12 and name  HB1) (segid "   B" and resid   12 and name  HD1) 3.743 1.752 1.752 weight 1.000 ! spec=13CnoesyARO, no=135, id=6576, vol=1.120000e+03
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HE1) 4.258 2.267 2.267 weight 1.000 ! spec=13CnoesyARO, no=138, id=6577, vol=9.805000e+02
assign (segid "   B" and resid   12 and name   HA) (segid "   B" and resid   12 and name  HE1) 4.258 2.267 2.267 weight 1.000 ! spec=13CnoesyARO, no=138, id=6577, vol=9.805000e+02
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   12 and name  HE1) 4.584 2.627 2.627 weight 1.000 ! spec=13CnoesyARO, no=140, id=6579, vol=7.196000e+02
assign (segid "   B" and resid   12 and name  HB1) (segid "   B" and resid   12 and name  HE1) 4.584 2.627 2.627 weight 1.000 ! spec=13CnoesyARO, no=140, id=6579, vol=7.196000e+02
assign (segid "   A" and resid   12 and name   HZ) (segid "   A" and resid   12 and name   HA) 4.517 2.550 2.550 weight 1.000 ! spec=13CnoesyARO, no=143, id=6580, vol=4.450000e+02
assign (segid "   B" and resid   12 and name   HZ) (segid "   B" and resid   12 and name   HA) 4.517 2.550 2.550 weight 1.000 ! spec=13CnoesyARO, no=143, id=6580, vol=4.450000e+02
assign (segid "   A" and resid    7 and name   HZ) (segid "   A" and resid    7 and name  HE1) 3.480 1.513 1.513 weight 1.000 ! spec=13CnoesyARO, no=146, id=6581, vol=2.094000e+03
assign (segid "   B" and resid    7 and name   HZ) (segid "   B" and resid    7 and name  HE1) 3.480 1.513 1.513 weight 1.000 ! spec=13CnoesyARO, no=146, id=6581, vol=2.094000e+03
assign (segid "   A" and resid    7 and name  HD1) (segid "   A" and resid    7 and name  HE1) 2.193 0.601 0.601 weight 1.000 ! spec=13CnoesyARO, no=147, id=6582, vol=8.587000e+04
assign (segid "   B" and resid    7 and name  HD1) (segid "   B" and resid    7 and name  HE1) 2.193 0.601 0.601 weight 1.000 ! spec=13CnoesyARO, no=147, id=6582, vol=8.587000e+04
assign (segid "   A" and resid    7 and name  HD1) (segid "   A" and resid   12 and name   HN) 4.563 2.603 2.603 weight 1.000 ! spec=13CnoesyARO, no=153, id=6585, vol=1.025000e+03
assign (segid "   B" and resid    7 and name  HD1) (segid "   B" and resid   12 and name   HN) 4.563 2.603 2.603 weight 1.000 ! spec=13CnoesyARO, no=153, id=6585, vol=1.025000e+03
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    7 and name  HD1) 3.660 1.675 1.675 weight 1.000 ! spec=13CnoesyARO, no=154, id=6586, vol=2.276000e+03
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    7 and name  HD1)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    7 and name  HD1)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    7 and name  HD1) 3.660 1.675 1.675 weight 1.000 ! spec=13CnoesyARO, no=154, id=6586, vol=2.276000e+03
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    7 and name  HD1)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    7 and name  HD1)
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name  HD1) 3.336 1.391 1.391 weight 1.000 ! spec=13CnoesyARO, no=156, id=6588, vol=2.458000e+03
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    7 and name  HD1) 3.336 1.391 1.391 weight 1.000 ! spec=13CnoesyARO, no=156, id=6588, vol=2.458000e+03
assign (segid "   A" and resid    7 and name  HD1) (segid "   A" and resid   11 and name  HG1) 4.921 3.027 3.027 weight 1.000 ! spec=13CnoesyARO, no=157, id=6589, vol=8.723000e+02
assign (segid "   B" and resid    7 and name  HD1) (segid "   B" and resid   11 and name  HG1) 4.921 3.027 3.027 weight 1.000 ! spec=13CnoesyARO, no=157, id=6589, vol=8.723000e+02
assign (segid "   A" and resid    7 and name  HD1) (segid "   A" and resid    7 and name   HA) 3.542 1.568 1.568 weight 1.000 ! spec=13CnoesyARO, no=159, id=6591, vol=2.833000e+03
assign (segid "   B" and resid    7 and name  HD1) (segid "   B" and resid    7 and name   HA) 3.542 1.568 1.568 weight 1.000 ! spec=13CnoesyARO, no=159, id=6591, vol=2.833000e+03
assign (segid "   A" and resid    6 and name   HB) (segid "   A" and resid    7 and name  HD1) 4.756 2.827 2.827 weight 1.000 ! spec=13CnoesyARO, no=160, id=6592, vol=8.271000e+02
assign (segid "   B" and resid    6 and name   HB) (segid "   B" and resid    7 and name  HD1) 4.756 2.827 2.827 weight 1.000 ! spec=13CnoesyARO, no=160, id=6592, vol=8.271000e+02
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name  HD1) 3.328 1.385 1.385 weight 1.000 ! spec=13CnoesyARO, no=161, id=6593, vol=2.660000e+03
assign (segid "   B" and resid    7 and name  HB2) (segid "   B" and resid    7 and name  HD1) 3.328 1.385 1.385 weight 1.000 ! spec=13CnoesyARO, no=161, id=6593, vol=2.660000e+03
assign (segid "   A" and resid    8 and name  HE1) (segid "   A" and resid    8 and name  HB1) 5.422 3.674 3.674 weight 1.000 ! spec=13CnoesyARO, no=166, id=6594, vol=4.663000e+02
assign (segid "   B" and resid    8 and name  HE1) (segid "   B" and resid    8 and name  HB1) 5.422 3.674 3.674 weight 1.000 ! spec=13CnoesyARO, no=166, id=6594, vol=4.663000e+02
assign (segid "   A" and resid    4 and name  HE1) (segid "   A" and resid    4 and name   HA) 5.761 4.149 4.149 weight 1.000 ! spec=13CnoesyARO, no=175, id=6595, vol=3.806000e+02
assign (segid "   B" and resid    4 and name  HE1) (segid "   B" and resid    4 and name   HA) 5.761 4.149 4.149 weight 1.000 ! spec=13CnoesyARO, no=175, id=6595, vol=3.806000e+02
assign (segid "   A" and resid   99 and name  HZ3) (segid "   A" and resid   99 and name  HD1) 5.031 3.164 3.164 weight 1.000 ! spec=13CnoesyARO, no=197, id=6597, vol=7.939000e+02
assign (segid "   B" and resid   99 and name  HZ3) (segid "   B" and resid   99 and name  HD1) 5.031 3.164 3.164 weight 1.000 ! spec=13CnoesyARO, no=197, id=6597, vol=7.939000e+02
assign (segid "   A" and resid   99 and name  HZ3) (segid "   A" and resid   99 and name  HE1) 5.443 3.704 3.704 weight 1.000 ! spec=13CnoesyARO, no=199, id=6598, vol=2.636000e+02
assign (segid "   B" and resid   99 and name  HZ3) (segid "   B" and resid   99 and name  HE1) 5.443 3.704 3.704 weight 1.000 ! spec=13CnoesyARO, no=199, id=6598, vol=2.636000e+02
assign (segid "   A" and resid   99 and name  HD1) (segid "   A" and resid   99 and name  HE3) 3.490 1.522 1.522 weight 1.000 ! spec=13CnoesyARO, no=204, id=6599, vol=7.533000e+03
assign (segid "   B" and resid   99 and name  HD1) (segid "   B" and resid   99 and name  HE3) 3.490 1.522 1.522 weight 1.000 ! spec=13CnoesyARO, no=204, id=6599, vol=7.533000e+03
assign (segid "   A" and resid   76 and name  HD1) (segid "   A" and resid   76 and name  HB2) 3.939 1.939 1.939 weight 1.000 ! spec=13CnoesyARO, no=221, id=6600, vol=8.170000e+02
assign (segid "   B" and resid   76 and name  HD1) (segid "   B" and resid   76 and name  HB2) 3.939 1.939 1.939 weight 1.000 ! spec=13CnoesyARO, no=221, id=6600, vol=8.170000e+02
assign (segid "   A" and resid   76 and name  HD1) (segid "   A" and resid   76 and name  HZ2) 3.877 1.879 1.879 weight 1.000 ! spec=13CnoesyARO, no=222, id=6601, vol=2.350000e+03
assign (segid "   B" and resid   76 and name  HD1) (segid "   B" and resid   76 and name  HZ2) 3.877 1.879 1.879 weight 1.000 ! spec=13CnoesyARO, no=222, id=6601, vol=2.350000e+03
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   76 and name  HD1) 3.614 1.632 1.632 weight 1.000 ! spec=13CnoesyARO, no=223, id=6602, vol=2.889000e+02
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   76 and name  HD1)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   76 and name  HD1)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   76 and name  HD1) 3.614 1.632 1.632 weight 1.000 ! spec=13CnoesyARO, no=223, id=6602, vol=2.889000e+02
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   76 and name  HD1)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   76 and name  HD1)
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name  HD2) 3.759 1.766 1.766 weight 1.000 ! spec=13CnoesyARO, no=226, id=6603, vol=1.946000e+03
assign (segid "   B" and resid    4 and name  HB1) (segid "   B" and resid    4 and name  HD2) 3.759 1.766 1.766 weight 1.000 ! spec=13CnoesyARO, no=226, id=6603, vol=1.946000e+03
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    4 and name  HD2) 4.125 2.127 2.127 weight 1.000 ! spec=13CnoesyARO, no=227, id=6604, vol=1.006000e+03
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    4 and name  HD2)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    4 and name  HD2)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    4 and name  HD2) 4.125 2.127 2.127 weight 1.000 ! spec=13CnoesyARO, no=227, id=6604, vol=1.006000e+03
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    4 and name  HD2)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    4 and name  HD2)
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    4 and name  HD2) 2.952 1.089 1.089 weight 1.000 ! spec=13CnoesyARO, no=230, id=6606, vol=1.374000e+03
assign (segid "   B" and resid    4 and name  HB2) (segid "   B" and resid    4 and name  HD2) 2.952 1.089 1.089 weight 1.000 ! spec=13CnoesyARO, no=230, id=6606, vol=1.374000e+03
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    4 and name  HD2) 4.060 2.060 2.060 weight 1.000 ! spec=13CnoesyARO, no=231, id=6607, vol=1.182000e+03
assign (segid "   B" and resid    4 and name   HA) (segid "   B" and resid    4 and name  HD2) 4.060 2.060 2.060 weight 1.000 ! spec=13CnoesyARO, no=231, id=6607, vol=1.182000e+03
assign (segid "   A" and resid   90 and name HD22) (segid "   A" and resid   99 and name  HD1) 4.827 2.912 2.912 weight 1.000 ! spec=13CnoesyARO, no=232, id=6608, vol=2.828000e+02
    or (segid "   A" and resid   90 and name HD21) (segid "   A" and resid   99 and name  HD1)
    or (segid "   A" and resid   90 and name HD23) (segid "   A" and resid   99 and name  HD1)
assign (segid "   B" and resid   90 and name HD22) (segid "   B" and resid   99 and name  HD1) 4.827 2.912 2.912 weight 1.000 ! spec=13CnoesyARO, no=232, id=6608, vol=2.828000e+02
    or (segid "   B" and resid   90 and name HD21) (segid "   B" and resid   99 and name  HD1)
    or (segid "   B" and resid   90 and name HD23) (segid "   B" and resid   99 and name  HD1)
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid   99 and name  HD1) 3.653 1.668 1.668 weight 1.000 ! spec=13CnoesyARO, no=234, id=6610, vol=5.288000e+02
assign (segid "   B" and resid   99 and name  HB1) (segid "   B" and resid   99 and name  HD1) 3.653 1.668 1.668 weight 1.000 ! spec=13CnoesyARO, no=234, id=6610, vol=5.288000e+02
assign (segid "   A" and resid    7 and name   HZ) (segid "   A" and resid    7 and name  HB2) 4.923 3.029 3.029 weight 1.000 ! spec=13CnoesyARO, no=237, id=6611, vol=4.199000e+02
assign (segid "   B" and resid    7 and name   HZ) (segid "   B" and resid    7 and name  HB2) 4.923 3.029 3.029 weight 1.000 ! spec=13CnoesyARO, no=237, id=6611, vol=4.199000e+02
assign (segid "   A" and resid   76 and name  HE3) (segid "   A" and resid   76 and name  HB2) 3.336 1.391 1.391 weight 1.000 ! spec=13CnoesyARO, no=238, id=6612, vol=6.113000e+02
assign (segid "   B" and resid   76 and name  HE3) (segid "   B" and resid   76 and name  HB2) 3.336 1.391 1.391 weight 1.000 ! spec=13CnoesyARO, no=238, id=6612, vol=6.113000e+02
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid   76 and name  HE3) 3.719 1.729 1.729 weight 1.000 ! spec=13CnoesyARO, no=239, id=6613, vol=1.042000e+03
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid   76 and name  HE3)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid   76 and name  HE3)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid   76 and name  HE3) 3.719 1.729 1.729 weight 1.000 ! spec=13CnoesyARO, no=239, id=6613, vol=1.042000e+03
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid   76 and name  HE3)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid   76 and name  HE3)
assign (segid "   A" and resid   49 and name   HZ) (segid "   A" and resid   49 and name  HB2) 4.296 2.307 2.307 weight 1.000 ! spec=13CnoesyARO, no=241, id=6615, vol=9.719000e+02
assign (segid "   B" and resid   49 and name   HZ) (segid "   B" and resid   49 and name  HB2) 4.296 2.307 2.307 weight 1.000 ! spec=13CnoesyARO, no=241, id=6615, vol=9.719000e+02
assign (segid "   A" and resid   21 and name  HZ2) (segid "   A" and resid   21 and name  HZ3) 5.011 3.139 3.139 weight 1.000 ! spec=13CnoesyARO, no=246, id=6617, vol=6.924000e+02
assign (segid "   B" and resid   21 and name  HZ2) (segid "   B" and resid   21 and name  HZ3) 5.011 3.139 3.139 weight 1.000 ! spec=13CnoesyARO, no=246, id=6617, vol=6.924000e+02
assign (segid "   A" and resid   21 and name  HZ2) (segid "   A" and resid   21 and name  HE3) 4.593 2.637 2.637 weight 1.000 ! spec=13CnoesyARO, no=247, id=6618, vol=7.075000e+02
assign (segid "   B" and resid   21 and name  HZ2) (segid "   B" and resid   21 and name  HE3) 4.593 2.637 2.637 weight 1.000 ! spec=13CnoesyARO, no=247, id=6618, vol=7.075000e+02
assign (segid "   A" and resid   21 and name  HZ2) (segid "   A" and resid   21 and name  HD1) 5.213 3.398 3.398 weight 1.000 ! spec=13CnoesyARO, no=250, id=6620, vol=6.814000e+02
assign (segid "   B" and resid   21 and name  HZ2) (segid "   B" and resid   21 and name  HD1) 5.213 3.398 3.398 weight 1.000 ! spec=13CnoesyARO, no=250, id=6620, vol=6.814000e+02
assign (segid "   A" and resid   21 and name  HZ2) (segid "   A" and resid   21 and name  HH2) 3.163 1.251 1.251 weight 1.000 ! spec=13CnoesyARO, no=251, id=6621, vol=1.447000e+03
assign (segid "   B" and resid   21 and name  HZ2) (segid "   B" and resid   21 and name  HH2) 3.163 1.251 1.251 weight 1.000 ! spec=13CnoesyARO, no=251, id=6621, vol=1.447000e+03
assign (segid "   A" and resid   21 and name  HZ2) (segid "   A" and resid   54 and name  HB2) 3.705 1.716 1.716 weight 1.000 ! spec=13CnoesyARO, no=252, id=6622, vol=8.231000e+02
assign (segid "   B" and resid   21 and name  HZ2) (segid "   B" and resid   54 and name  HB2) 3.705 1.716 1.716 weight 1.000 ! spec=13CnoesyARO, no=252, id=6622, vol=8.231000e+02
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name  HD2) 3.971 1.971 1.971 weight 1.000 ! spec=13CnoesyARO, no=255, id=6624, vol=6.452000e+02
assign (segid "   B" and resid    8 and name   HA) (segid "   B" and resid    8 and name  HD2) 3.971 1.971 1.971 weight 1.000 ! spec=13CnoesyARO, no=255, id=6624, vol=6.452000e+02
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name  HD2) 3.130 1.225 1.225 weight 1.000 ! spec=13CnoesyARO, no=256, id=6625, vol=1.248000e+03
assign (segid "   B" and resid    8 and name  HB2) (segid "   B" and resid    8 and name  HD2) 3.130 1.225 1.225 weight 1.000 ! spec=13CnoesyARO, no=256, id=6625, vol=1.248000e+03
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name  HD2) 3.883 1.885 1.885 weight 1.000 ! spec=13CnoesyARO, no=257, id=6626, vol=1.402000e+03
assign (segid "   B" and resid    8 and name  HB1) (segid "   B" and resid    8 and name  HD2) 3.883 1.885 1.885 weight 1.000 ! spec=13CnoesyARO, no=257, id=6626, vol=1.402000e+03
assign (segid "   A" and resid   86 and name   HZ) (segid "   A" and resid  103 and name  HB1) 2.756 0.949 0.949 weight 1.000 ! spec=13CnoesyARO, no=259, id=6627, vol=2.046000e+03
assign (segid "   B" and resid   86 and name   HZ) (segid "   B" and resid  103 and name  HB1) 2.756 0.949 0.949 weight 1.000 ! spec=13CnoesyARO, no=259, id=6627, vol=2.046000e+03
assign (segid "   A" and resid   99 and name  HZ3) (segid "   A" and resid   99 and name  HE3) 3.300 1.362 1.362 weight 1.000 ! spec=13CnoesyARO, no=267, id=6629, vol=6.184000e+02
assign (segid "   B" and resid   99 and name  HZ3) (segid "   B" and resid   99 and name  HE3) 3.300 1.362 1.362 weight 1.000 ! spec=13CnoesyARO, no=267, id=6629, vol=6.184000e+02
assign (segid "   A" and resid   84 and name  HD2) (segid "   A" and resid   84 and name  HB1) 4.325 2.339 2.339 weight 1.000 ! spec=13CnoesyARO, no=275, id=6635, vol=3.158000e+02
assign (segid "   B" and resid   84 and name  HD2) (segid "   B" and resid   84 and name  HB1) 4.325 2.339 2.339 weight 1.000 ! spec=13CnoesyARO, no=275, id=6635, vol=3.158000e+02
assign (segid "   A" and resid   84 and name  HD2) (segid "   A" and resid   84 and name  HB2) 4.006 2.006 2.006 weight 1.000 ! spec=13CnoesyARO, no=276, id=6636, vol=3.686000e+02
assign (segid "   B" and resid   84 and name  HD2) (segid "   B" and resid   84 and name  HB2) 4.006 2.006 2.006 weight 1.000 ! spec=13CnoesyARO, no=276, id=6636, vol=3.686000e+02
assign (segid "   A" and resid   21 and name  HZ3) (segid "   A" and resid   21 and name  HE3) 3.161 1.249 1.249 weight 1.000 ! spec=13CnoesyARO, no=279, id=6639, vol=1.000000e+03
assign (segid "   B" and resid   21 and name  HZ3) (segid "   B" and resid   21 and name  HE3) 3.161 1.249 1.249 weight 1.000 ! spec=13CnoesyARO, no=279, id=6639, vol=1.000000e+03
assign (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   21 and name  HE3) 4.824 2.909 2.909 weight 1.000 ! spec=13CnoesyARO, no=281, id=6640, vol=8.602000e+02
assign (segid "   B" and resid   21 and name  HB1) (segid "   B" and resid   21 and name  HE3) 4.824 2.909 2.909 weight 1.000 ! spec=13CnoesyARO, no=281, id=6640, vol=8.602000e+02
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name  HE3) 3.184 1.267 1.267 weight 1.000 ! spec=13CnoesyARO, no=282, id=6641, vol=8.602000e+02
assign (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   21 and name  HE3) 3.184 1.267 1.267 weight 1.000 ! spec=13CnoesyARO, no=282, id=6641, vol=8.602000e+02
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name   HZ) 4.766 2.840 2.840 weight 1.000 ! spec=13CnoesyARO, no=284, id=6642, vol=3.520000e+02
assign (segid "   B" and resid   53 and name  HB1) (segid "   B" and resid   53 and name   HZ) 4.766 2.840 2.840 weight 1.000 ! spec=13CnoesyARO, no=284, id=6642, vol=3.520000e+02
assign (segid "   A" and resid   76 and name  HZ3) (segid "   A" and resid  114 and name   HN) 3.302 1.363 1.363 weight 1.000 ! spec=13CnoesyARO, no=290, id=6643, vol=1.270000e+03
assign (segid "   B" and resid   76 and name  HZ3) (segid "   B" and resid  114 and name   HN) 3.302 1.363 1.363 weight 1.000 ! spec=13CnoesyARO, no=290, id=6643, vol=1.270000e+03
assign (segid "   A" and resid   99 and name  HZ3) (segid "   A" and resid   99 and name  HZ2) 4.260 2.268 2.268 weight 1.000 ! spec=13CnoesyARO, no=293, id=6644, vol=8.895000e+02
assign (segid "   B" and resid   99 and name  HZ3) (segid "   B" and resid   99 and name  HZ2) 4.260 2.268 2.268 weight 1.000 ! spec=13CnoesyARO, no=293, id=6644, vol=8.895000e+02
assign (segid "   A" and resid   90 and name HD12) (segid "   A" and resid   99 and name  HZ2) 3.432 1.472 1.472 weight 1.000 ! spec=13CnoesyARO, no=295, id=6646, vol=3.510000e+02
    or (segid "   A" and resid   90 and name HD11) (segid "   A" and resid   99 and name  HZ2)
    or (segid "   A" and resid   90 and name HD13) (segid "   A" and resid   99 and name  HZ2)
assign (segid "   B" and resid   90 and name HD12) (segid "   B" and resid   99 and name  HZ2) 3.432 1.472 1.472 weight 1.000 ! spec=13CnoesyARO, no=295, id=6646, vol=3.510000e+02
    or (segid "   B" and resid   90 and name HD11) (segid "   B" and resid   99 and name  HZ2)
    or (segid "   B" and resid   90 and name HD13) (segid "   B" and resid   99 and name  HZ2)
assign (segid "   A" and resid   42 and name HG12) (segid "   A" and resid   99 and name  HZ2) 3.641 1.657 1.657 weight 1.000 ! spec=13CnoesyARO, no=296, id=6647, vol=8.512000e+02
    or (segid "   A" and resid   42 and name HG11) (segid "   A" and resid   99 and name  HZ2)
    or (segid "   A" and resid   42 and name HG13) (segid "   A" and resid   99 and name  HZ2)
assign (segid "   B" and resid   42 and name HG12) (segid "   B" and resid   99 and name  HZ2) 3.641 1.657 1.657 weight 1.000 ! spec=13CnoesyARO, no=296, id=6647, vol=8.512000e+02
    or (segid "   B" and resid   42 and name HG11) (segid "   B" and resid   99 and name  HZ2)
    or (segid "   B" and resid   42 and name HG13) (segid "   B" and resid   99 and name  HZ2)
assign (segid "   A" and resid   75 and name  HD2) (segid "   A" and resid   75 and name  HE1) 5.318 3.536 3.536 weight 1.000 ! spec=13CnoesyARO, no=299, id=6650, vol=3.329000e+02
assign (segid "   B" and resid   75 and name  HD2) (segid "   B" and resid   75 and name  HE1) 5.318 3.536 3.536 weight 1.000 ! spec=13CnoesyARO, no=299, id=6650, vol=3.329000e+02
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name  HD2) 3.532 1.560 1.560 weight 1.000 ! spec=13CnoesyARO, no=300, id=6651, vol=7.959000e+02
assign (segid "   B" and resid   75 and name  HB2) (segid "   B" and resid   75 and name  HD2) 3.532 1.560 1.560 weight 1.000 ! spec=13CnoesyARO, no=300, id=6651, vol=7.959000e+02
assign (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name  HD2) 3.499 1.531 1.531 weight 1.000 ! spec=13CnoesyARO, no=304, id=6652, vol=8.522000e+02
assign (segid "   B" and resid   75 and name  HB1) (segid "   B" and resid   75 and name  HD2) 3.499 1.531 1.531 weight 1.000 ! spec=13CnoesyARO, no=304, id=6652, vol=8.522000e+02
assign (segid "   A" and resid   21 and name  HD1) (segid "   A" and resid   21 and name  HB1) 3.256 1.325 1.325 weight 1.000 ! spec=13CnoesyARO, no=308, id=6655, vol=9.336000e+02
assign (segid "   B" and resid   21 and name  HD1) (segid "   B" and resid   21 and name  HB1) 3.256 1.325 1.325 weight 1.000 ! spec=13CnoesyARO, no=308, id=6655, vol=9.336000e+02
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name  HD1) 4.548 2.585 2.585 weight 1.000 ! spec=13CnoesyARO, no=309, id=6656, vol=7.939000e+02
assign (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   21 and name  HD1) 4.548 2.585 2.585 weight 1.000 ! spec=13CnoesyARO, no=309, id=6656, vol=7.939000e+02
assign (segid "   A" and resid    8 and name  HE1) (segid "   A" and resid    8 and name  HB2) 5.224 3.411 3.411 weight 1.000 ! spec=13CnoesyARO, no=313, id=6658, vol=8.110000e+02
assign (segid "   B" and resid    8 and name  HE1) (segid "   B" and resid    8 and name  HB2) 5.224 3.411 3.411 weight 1.000 ! spec=13CnoesyARO, no=313, id=6658, vol=8.110000e+02
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   53 and name  HD1) 3.604 1.624 1.624 weight 1.000 ! spec=13CnoesyARO, no=314, id=6659, vol=7.860000e+02
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   53 and name  HD1)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   53 and name  HD1)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   53 and name  HD1) 3.604 1.624 1.624 weight 1.000 ! spec=13CnoesyARO, no=314, id=6659, vol=7.860000e+02
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   53 and name  HD1)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   53 and name  HD1)
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   60 and name   HN) 3.412 1.455 1.455 weight 1.000 ! spec=15Nn...5deg, no=1, id=5644, vol=2.757000e+02
    or (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   60 and name   HN)
    or (segid "   A" and resid   60 and name  HB3) (segid "   A" and resid   60 and name   HN)
assign (segid "   B" and resid   60 and name  HB2) (segid "   B" and resid   60 and name   HN) 3.412 1.455 1.455 weight 1.000 ! spec=15Nn...5deg, no=1, id=5644, vol=2.757000e+02
    or (segid "   B" and resid   60 and name  HB1) (segid "   B" and resid   60 and name   HN)
    or (segid "   B" and resid   60 and name  HB3) (segid "   B" and resid   60 and name   HN)
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name   HA) 3.024 1.143 1.143 weight 1.000 ! spec=15Nn...5deg, no=2, id=5645, vol=4.386000e+02
assign (segid "   B" and resid   60 and name   HN) (segid "   B" and resid   60 and name   HA) 3.024 1.143 1.143 weight 1.000 ! spec=15Nn...5deg, no=2, id=5645, vol=4.386000e+02
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name   HN) 3.122 1.219 1.219 weight 1.000 ! spec=15Nn...5deg, no=4, id=5647, vol=4.436000e+02
assign (segid "   B" and resid   64 and name   HA) (segid "   B" and resid   64 and name   HN) 3.122 1.219 1.219 weight 1.000 ! spec=15Nn...5deg, no=4, id=5647, vol=4.436000e+02
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   64 and name   HN) 4.349 2.364 2.364 weight 1.000 ! spec=15Nn...5deg, no=5, id=5648, vol=3.600000e+02
assign (segid "   B" and resid   63 and name  HB1) (segid "   B" and resid   64 and name   HN) 4.349 2.364 2.364 weight 1.000 ! spec=15Nn...5deg, no=5, id=5648, vol=3.600000e+02
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   64 and name   HN) 3.326 1.383 1.383 weight 1.000 ! spec=15Nn...5deg, no=7, id=5650, vol=3.590000e+02
assign (segid "   B" and resid   62 and name  HB2) (segid "   B" and resid   64 and name   HN) 3.326 1.383 1.383 weight 1.000 ! spec=15Nn...5deg, no=7, id=5650, vol=3.590000e+02
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   64 and name   HN) 2.068 0.534 0.534 weight 1.000 ! spec=15Nn...5deg, no=11, id=5654, vol=1.308000e+03
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   64 and name   HN)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   64 and name   HN)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   64 and name   HN) 2.068 0.534 0.534 weight 1.000 ! spec=15Nn...5deg, no=11, id=5654, vol=1.308000e+03
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   64 and name   HN)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   64 and name   HN)
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name   HN) 3.425 1.466 1.466 weight 1.000 ! spec=15Nn...5deg, no=12, id=5655, vol=3.283000e+02
assign (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   14 and name   HN) 3.425 1.466 1.466 weight 1.000 ! spec=15Nn...5deg, no=12, id=5655, vol=3.283000e+02
assign (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   14 and name   HN) 2.471 0.763 0.763 weight 1.000 ! spec=15Nn...5deg, no=13, id=5656, vol=6.028000e+02
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   14 and name   HN)
assign (segid "   B" and resid   14 and name HG22) (segid "   B" and resid   14 and name   HN) 2.471 0.763 0.763 weight 1.000 ! spec=15Nn...5deg, no=13, id=5656, vol=6.028000e+02
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid   14 and name   HN)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid   14 and name   HN)
assign (segid "   A" and resid   14 and name HG12) (segid "   A" and resid   14 and name   HN) 2.471 0.763 0.763 weight 1.000 ! spec=15Nn...5deg, no=15, id=5657, vol=6.063000e+02
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid   14 and name   HN)
assign (segid "   B" and resid   14 and name HG12) (segid "   B" and resid   14 and name   HN) 2.471 0.763 0.763 weight 1.000 ! spec=15Nn...5deg, no=15, id=5657, vol=6.063000e+02
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid   14 and name   HN)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid   14 and name   HN)
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   14 and name   HN) 2.852 1.017 1.017 weight 1.000 ! spec=15Nn...5deg, no=16, id=5658, vol=5.104000e+02
assign (segid "   B" and resid   13 and name   HA) (segid "   B" and resid   14 and name   HN) 2.852 1.017 1.017 weight 1.000 ! spec=15Nn...5deg, no=16, id=5658, vol=5.104000e+02
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   14 and name   HN) 4.279 2.289 2.289 weight 1.000 ! spec=15Nn...5deg, no=18, id=5660, vol=3.017000e+02
assign (segid "   B" and resid   13 and name  HB1) (segid "   B" and resid   14 and name   HN) 4.279 2.289 2.289 weight 1.000 ! spec=15Nn...5deg, no=18, id=5660, vol=3.017000e+02
assign (segid "   A" and resid   11 and name  HG2) (segid "   A" and resid   12 and name   HN) 4.315 2.328 2.328 weight 1.000 ! spec=15Nn...5deg, no=26, id=5667, vol=4.997000e+02
assign (segid "   B" and resid   11 and name  HG2) (segid "   B" and resid   12 and name   HN) 4.315 2.328 2.328 weight 1.000 ! spec=15Nn...5deg, no=26, id=5667, vol=4.997000e+02
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   12 and name   HN) 4.973 3.092 3.092 weight 1.000 ! spec=15Nn...5deg, no=28, id=5668, vol=2.462000e+02
assign (segid "   B" and resid   11 and name  HB1) (segid "   B" and resid   12 and name   HN) 4.973 3.092 3.092 weight 1.000 ! spec=15Nn...5deg, no=28, id=5668, vol=2.462000e+02
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   73 and name   HN) 4.846 2.935 2.935 weight 1.000 ! spec=15Nn...5deg, no=36, id=5672, vol=3.565000e+02
assign (segid "   B" and resid   74 and name  HB2) (segid "   B" and resid   73 and name   HN) 4.846 2.935 2.935 weight 1.000 ! spec=15Nn...5deg, no=36, id=5672, vol=3.565000e+02
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   73 and name   HN) 4.658 2.712 2.712 weight 1.000 ! spec=15Nn...5deg, no=40, id=5675, vol=4.542000e+02
assign (segid "   B" and resid   72 and name  HB2) (segid "   B" and resid   73 and name   HN) 4.658 2.712 2.712 weight 1.000 ! spec=15Nn...5deg, no=40, id=5675, vol=4.542000e+02
assign (segid "   A" and resid   71 and name HG22) (segid "   A" and resid   73 and name   HN) 3.227 1.302 1.302 weight 1.000 ! spec=15Nn...5deg, no=44, id=5679, vol=4.393000e+02
    or (segid "   A" and resid   71 and name HG21) (segid "   A" and resid   73 and name   HN)
    or (segid "   A" and resid   71 and name HG23) (segid "   A" and resid   73 and name   HN)
assign (segid "   B" and resid   71 and name HG22) (segid "   B" and resid   73 and name   HN) 3.227 1.302 1.302 weight 1.000 ! spec=15Nn...5deg, no=44, id=5679, vol=4.393000e+02
    or (segid "   B" and resid   71 and name HG21) (segid "   B" and resid   73 and name   HN)
    or (segid "   B" and resid   71 and name HG23) (segid "   B" and resid   73 and name   HN)
assign (segid "   A" and resid  105 and name   HN) (segid "   A" and resid  104 and name HG11) 3.658 1.673 1.673 weight 1.000 ! spec=15Nn...5deg, no=48, id=5682, vol=2.416000e+02
assign (segid "   B" and resid  105 and name   HN) (segid "   B" and resid  104 and name HG11) 3.658 1.673 1.673 weight 1.000 ! spec=15Nn...5deg, no=48, id=5682, vol=2.416000e+02
assign (segid "   A" and resid  105 and name   HN) (segid "   A" and resid  105 and name  HB1) 2.780 0.966 0.966 weight 1.000 ! spec=15Nn...5deg, no=51, id=5684, vol=5.729000e+02
assign (segid "   B" and resid  105 and name   HN) (segid "   B" and resid  105 and name  HB1) 2.780 0.966 0.966 weight 1.000 ! spec=15Nn...5deg, no=51, id=5684, vol=5.729000e+02
assign (segid "   A" and resid  104 and name   HB) (segid "   A" and resid  105 and name   HN) 2.768 0.958 0.958 weight 1.000 ! spec=15Nn...5deg, no=52, id=5685, vol=5.886000e+02
assign (segid "   B" and resid  104 and name   HB) (segid "   B" and resid  105 and name   HN) 2.768 0.958 0.958 weight 1.000 ! spec=15Nn...5deg, no=52, id=5685, vol=5.886000e+02
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  105 and name   HN) 3.739 1.748 1.748 weight 1.000 ! spec=15Nn...5deg, no=54, id=5687, vol=5.886000e+02
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  105 and name   HN)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  105 and name   HN)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  105 and name   HN) 3.739 1.748 1.748 weight 1.000 ! spec=15Nn...5deg, no=54, id=5687, vol=5.886000e+02
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  105 and name   HN)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  105 and name   HN)
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  105 and name   HN) 3.929 1.930 1.930 weight 1.000 ! spec=15Nn...5deg, no=56, id=5689, vol=5.331000e+02
assign (segid "   B" and resid  105 and name  HB2) (segid "   B" and resid  105 and name   HN) 3.929 1.930 1.930 weight 1.000 ! spec=15Nn...5deg, no=56, id=5689, vol=5.331000e+02
assign (segid "   A" and resid   33 and name  HA1) (segid "   A" and resid   33 and name   HN) 3.016 1.137 1.137 weight 1.000 ! spec=15Nn...5deg, no=57, id=5690, vol=1.002000e+03
assign (segid "   B" and resid   33 and name  HA1) (segid "   B" and resid   33 and name   HN) 3.016 1.137 1.137 weight 1.000 ! spec=15Nn...5deg, no=57, id=5690, vol=1.002000e+03
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   33 and name   HN) 2.979 1.109 1.109 weight 1.000 ! spec=15Nn...5deg, no=60, id=5692, vol=5.523000e+02
assign (segid "   B" and resid   32 and name  HB2) (segid "   B" and resid   33 and name   HN) 2.979 1.109 1.109 weight 1.000 ! spec=15Nn...5deg, no=60, id=5692, vol=5.523000e+02
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   33 and name   HN) 2.685 0.901 0.901 weight 1.000 ! spec=15Nn...5deg, no=61, id=5693, vol=8.867000e+02
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   33 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   33 and name   HN)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   33 and name   HN) 2.685 0.901 0.901 weight 1.000 ! spec=15Nn...5deg, no=61, id=5693, vol=8.867000e+02
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   33 and name   HN)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   33 and name   HN)
assign (segid "   A" and resid   33 and name  HA2) (segid "   A" and resid   33 and name   HN) 2.382 0.709 0.709 weight 1.000 ! spec=15Nn...5deg, no=64, id=5696, vol=1.189000e+03
assign (segid "   B" and resid   33 and name  HA2) (segid "   B" and resid   33 and name   HN) 2.382 0.709 0.709 weight 1.000 ! spec=15Nn...5deg, no=64, id=5696, vol=1.189000e+03
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   73 and name   HN) 3.970 1.970 1.970 weight 1.000 ! spec=15Nn...5deg, no=71, id=5699, vol=3.027000e+02
assign (segid "   B" and resid   76 and name   HN) (segid "   B" and resid   73 and name   HN) 3.970 1.970 1.970 weight 1.000 ! spec=15Nn...5deg, no=71, id=5699, vol=3.027000e+02
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   76 and name   HN) 2.924 1.069 1.069 weight 1.000 ! spec=15Nn...5deg, no=73, id=5701, vol=3.716000e+02
assign (segid "   B" and resid   76 and name   HA) (segid "   B" and resid   76 and name   HN) 2.924 1.069 1.069 weight 1.000 ! spec=15Nn...5deg, no=73, id=5701, vol=3.716000e+02
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid  112 and name HD22) 4.305 2.316 2.316 weight 1.000 ! spec=15Nn...5deg, no=74, id=5702, vol=3.198000e+02
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid   76 and name   HN) (segid "   B" and resid  112 and name HD22) 4.305 2.316 2.316 weight 1.000 ! spec=15Nn...5deg, no=74, id=5702, vol=3.198000e+02
    or (segid "   B" and resid   76 and name   HN) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid   76 and name   HN) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name   HN) 4.005 2.005 2.005 weight 1.000 ! spec=15Nn...5deg, no=78, id=5706, vol=3.163000e+02
assign (segid "   B" and resid   77 and name   HN) (segid "   B" and resid   76 and name   HN) 4.005 2.005 2.005 weight 1.000 ! spec=15Nn...5deg, no=78, id=5706, vol=3.163000e+02
assign (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   76 and name   HN) 2.778 0.965 0.965 weight 1.000 ! spec=15Nn...5deg, no=80, id=5708, vol=4.571000e+02
assign (segid "   B" and resid   76 and name  HB1) (segid "   B" and resid   76 and name   HN) 2.778 0.965 0.965 weight 1.000 ! spec=15Nn...5deg, no=80, id=5708, vol=4.571000e+02
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name   HN) 3.692 1.704 1.704 weight 1.000 ! spec=15Nn...5deg, no=82, id=5710, vol=5.288000e+02
assign (segid "   B" and resid   76 and name  HB2) (segid "   B" and resid   76 and name   HN) 3.692 1.704 1.704 weight 1.000 ! spec=15Nn...5deg, no=82, id=5710, vol=5.288000e+02
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   75 and name   HA) 3.481 1.515 1.515 weight 1.000 ! spec=15Nn...5deg, no=83, id=5711, vol=3.912000e+02
assign (segid "   B" and resid   76 and name   HN) (segid "   B" and resid   75 and name   HA) 3.481 1.515 1.515 weight 1.000 ! spec=15Nn...5deg, no=83, id=5711, vol=3.912000e+02
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name   HA) 3.927 1.928 1.928 weight 1.000 ! spec=15Nn...5deg, no=89, id=5715, vol=1.342000e+03
assign (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    7 and name   HA) 3.927 1.928 1.928 weight 1.000 ! spec=15Nn...5deg, no=89, id=5715, vol=1.342000e+03
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name  HD1) 3.798 1.803 1.803 weight 1.000 ! spec=15Nn...5deg, no=90, id=5716, vol=2.668000e+02
assign (segid "   B" and resid    6 and name   HN) (segid "   B" and resid    5 and name  HD1) 3.798 1.803 1.803 weight 1.000 ! spec=15Nn...5deg, no=90, id=5716, vol=2.668000e+02
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    6 and name   HN) 3.892 1.893 1.893 weight 1.000 ! spec=15Nn...5deg, no=95, id=5721, vol=3.600000e+02
assign (segid "   B" and resid    4 and name   HA) (segid "   B" and resid    6 and name   HN) 3.892 1.893 1.893 weight 1.000 ! spec=15Nn...5deg, no=95, id=5721, vol=3.600000e+02
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   37 and name   HB) 2.384 0.710 0.710 weight 1.000 ! spec=15Nn...5deg, no=101, id=5726, vol=7.799000e+02
assign (segid "   B" and resid   92 and name   HN) (segid "   B" and resid   37 and name   HB) 2.384 0.710 0.710 weight 1.000 ! spec=15Nn...5deg, no=101, id=5726, vol=7.799000e+02
assign (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   92 and name   HN) 3.199 1.279 1.279 weight 1.000 ! spec=15Nn...5deg, no=102, id=5727, vol=3.480000e+02
assign (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   92 and name   HN) 3.199 1.279 1.279 weight 1.000 ! spec=15Nn...5deg, no=102, id=5727, vol=3.480000e+02
assign (segid "   A" and resid   91 and name   HB) (segid "   A" and resid   92 and name   HN) 2.412 0.728 0.728 weight 1.000 ! spec=15Nn...5deg, no=104, id=5729, vol=8.867000e+02
assign (segid "   B" and resid   91 and name   HB) (segid "   B" and resid   92 and name   HN) 2.412 0.728 0.728 weight 1.000 ! spec=15Nn...5deg, no=104, id=5729, vol=8.867000e+02
assign (segid "   A" and resid   39 and name HD22) (segid "   A" and resid   92 and name   HN) 3.015 1.136 1.136 weight 1.000 ! spec=15Nn...5deg, no=105, id=5730, vol=5.637000e+02
    or (segid "   A" and resid   39 and name HD21) (segid "   A" and resid   92 and name   HN)
    or (segid "   A" and resid   39 and name HD23) (segid "   A" and resid   92 and name   HN)
assign (segid "   B" and resid   39 and name HD22) (segid "   B" and resid   92 and name   HN) 3.015 1.136 1.136 weight 1.000 ! spec=15Nn...5deg, no=105, id=5730, vol=5.637000e+02
    or (segid "   B" and resid   39 and name HD21) (segid "   B" and resid   92 and name   HN)
    or (segid "   B" and resid   39 and name HD23) (segid "   B" and resid   92 and name   HN)
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   56 and name   HN) 4.449 2.475 2.475 weight 1.000 ! spec=15Nn...5deg, no=110, id=5733, vol=2.931000e+02
assign (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   56 and name   HN) 4.449 2.475 2.475 weight 1.000 ! spec=15Nn...5deg, no=110, id=5733, vol=2.931000e+02
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name   HN) 2.734 0.934 0.934 weight 1.000 ! spec=15Nn...5deg, no=111, id=5734, vol=7.587000e+02
assign (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   56 and name   HN) 2.734 0.934 0.934 weight 1.000 ! spec=15Nn...5deg, no=111, id=5734, vol=7.587000e+02
assign (segid "   A" and resid   55 and name  HG1) (segid "   A" and resid   56 and name   HN) 5.538 3.834 3.834 weight 1.000 ! spec=15Nn...5deg, no=112, id=5735, vol=2.423000e+02
assign (segid "   B" and resid   55 and name  HG1) (segid "   B" and resid   56 and name   HN) 5.538 3.834 3.834 weight 1.000 ! spec=15Nn...5deg, no=112, id=5735, vol=2.423000e+02
assign (segid "   A" and resid   56 and name HG21) (segid "   A" and resid   56 and name   HN) 4.126 2.128 2.128 weight 1.000 ! spec=15Nn...5deg, no=113, id=5736, vol=2.387000e+02
    or (segid "   A" and resid   56 and name HG22) (segid "   A" and resid   56 and name   HN)
    or (segid "   A" and resid   56 and name HG23) (segid "   A" and resid   56 and name   HN)
assign (segid "   B" and resid   56 and name HG21) (segid "   B" and resid   56 and name   HN) 4.126 2.128 2.128 weight 1.000 ! spec=15Nn...5deg, no=113, id=5736, vol=2.387000e+02
    or (segid "   B" and resid   56 and name HG22) (segid "   B" and resid   56 and name   HN)
    or (segid "   B" and resid   56 and name HG23) (segid "   B" and resid   56 and name   HN)
assign (segid "   A" and resid  106 and name   HA) (segid "   A" and resid   56 and name   HN) 3.273 1.339 1.339 weight 1.000 ! spec=15Nn...5deg, no=114, id=5737, vol=3.877000e+02
assign (segid "   B" and resid  106 and name   HA) (segid "   B" and resid   56 and name   HN) 3.273 1.339 1.339 weight 1.000 ! spec=15Nn...5deg, no=114, id=5737, vol=3.877000e+02
assign (segid "   A" and resid   56 and name   HB) (segid "   A" and resid   56 and name   HN) 3.202 1.281 1.281 weight 1.000 ! spec=15Nn...5deg, no=116, id=5738, vol=2.661000e+02
assign (segid "   B" and resid   56 and name   HB) (segid "   B" and resid   56 and name   HN) 3.202 1.281 1.281 weight 1.000 ! spec=15Nn...5deg, no=116, id=5738, vol=2.661000e+02
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   43 and name   HN) 2.119 0.561 0.561 weight 1.000 ! spec=15Nn...5deg, no=118, id=5740, vol=9.066000e+02
assign (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   43 and name   HN) 2.119 0.561 0.561 weight 1.000 ! spec=15Nn...5deg, no=118, id=5740, vol=9.066000e+02
assign (segid "   A" and resid   42 and name HG22) (segid "   A" and resid   43 and name   HN) 3.161 1.249 1.249 weight 1.000 ! spec=15Nn...5deg, no=119, id=5741, vol=6.261000e+02
    or (segid "   A" and resid   42 and name HG21) (segid "   A" and resid   43 and name   HN)
    or (segid "   A" and resid   42 and name HG23) (segid "   A" and resid   43 and name   HN)
assign (segid "   B" and resid   42 and name HG22) (segid "   B" and resid   43 and name   HN) 3.161 1.249 1.249 weight 1.000 ! spec=15Nn...5deg, no=119, id=5741, vol=6.261000e+02
    or (segid "   B" and resid   42 and name HG21) (segid "   B" and resid   43 and name   HN)
    or (segid "   B" and resid   42 and name HG23) (segid "   B" and resid   43 and name   HN)
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   43 and name   HN) 3.274 1.340 1.340 weight 1.000 ! spec=15Nn...5deg, no=122, id=5742, vol=2.608000e+02
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   43 and name   HN) 3.274 1.340 1.340 weight 1.000 ! spec=15Nn...5deg, no=122, id=5742, vol=2.608000e+02
assign (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   43 and name   HN) 2.778 0.964 0.964 weight 1.000 ! spec=15Nn...5deg, no=123, id=5743, vol=5.751000e+02
assign (segid "   B" and resid   43 and name  HB2) (segid "   B" and resid   43 and name   HN) 2.778 0.964 0.964 weight 1.000 ! spec=15Nn...5deg, no=123, id=5743, vol=5.751000e+02
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name   HN) 2.954 1.091 1.091 weight 1.000 ! spec=15Nn...5deg, no=128, id=5747, vol=9.577000e+02
assign (segid "   B" and resid   93 and name   HA) (segid "   B" and resid   93 and name   HN) 2.954 1.091 1.091 weight 1.000 ! spec=15Nn...5deg, no=128, id=5747, vol=9.577000e+02
assign (segid "   A" and resid   92 and name   HB) (segid "   A" and resid   93 and name   HN) 4.434 2.458 2.458 weight 1.000 ! spec=15Nn...5deg, no=131, id=5749, vol=4.663000e+02
assign (segid "   B" and resid   92 and name   HB) (segid "   B" and resid   93 and name   HN) 4.434 2.458 2.458 weight 1.000 ! spec=15Nn...5deg, no=131, id=5749, vol=4.663000e+02
assign (segid "   A" and resid   93 and name   HN) (segid "   A" and resid   93 and name  HB2) 3.605 1.624 1.624 weight 1.000 ! spec=15Nn...5deg, no=132, id=5750, vol=3.661000e+02
assign (segid "   B" and resid   93 and name   HN) (segid "   B" and resid   93 and name  HB2) 3.605 1.624 1.624 weight 1.000 ! spec=15Nn...5deg, no=132, id=5750, vol=3.661000e+02
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   93 and name   HN) 2.482 0.770 0.770 weight 1.000 ! spec=15Nn...5deg, no=133, id=5751, vol=9.165000e+02
assign (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   93 and name   HN) 2.482 0.770 0.770 weight 1.000 ! spec=15Nn...5deg, no=133, id=5751, vol=9.165000e+02
assign (segid "   A" and resid   67 and name  HA2) (segid "   A" and resid   67 and name   HN) 2.636 0.869 0.869 weight 1.000 ! spec=15Nn...5deg, no=138, id=5753, vol=7.738000e+02
assign (segid "   B" and resid   67 and name  HA2) (segid "   B" and resid   67 and name   HN) 2.636 0.869 0.869 weight 1.000 ! spec=15Nn...5deg, no=138, id=5753, vol=7.738000e+02
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name  HA1) 3.052 1.164 1.164 weight 1.000 ! spec=15Nn...5deg, no=142, id=5756, vol=4.184000e+02
assign (segid "   B" and resid   67 and name   HN) (segid "   B" and resid   67 and name  HA1) 3.052 1.164 1.164 weight 1.000 ! spec=15Nn...5deg, no=142, id=5756, vol=4.184000e+02
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   67 and name   HN) 2.178 0.593 0.593 weight 1.000 ! spec=15Nn...5deg, no=143, id=5757, vol=1.006000e+03
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   67 and name   HN)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   67 and name   HN)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   67 and name   HN) 2.178 0.593 0.593 weight 1.000 ! spec=15Nn...5deg, no=143, id=5757, vol=1.006000e+03
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   67 and name   HN)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   67 and name   HN)
assign (segid "   A" and resid  113 and name   HN) (segid "   A" and resid   76 and name  HE1) 4.970 3.087 3.087 weight 1.000 ! spec=15Nn...5deg, no=144, id=5758, vol=2.366000e+02
assign (segid "   B" and resid  113 and name   HN) (segid "   B" and resid   76 and name  HE1) 4.970 3.087 3.087 weight 1.000 ! spec=15Nn...5deg, no=144, id=5758, vol=2.366000e+02
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  113 and name   HN) 2.554 0.816 0.816 weight 1.000 ! spec=15Nn...5deg, no=146, id=5760, vol=5.530000e+02
assign (segid "   B" and resid  112 and name   HA) (segid "   B" and resid  113 and name   HN) 2.554 0.816 0.816 weight 1.000 ! spec=15Nn...5deg, no=146, id=5760, vol=5.530000e+02
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid  113 and name   HN) 3.656 1.670 1.670 weight 1.000 ! spec=15Nn...5deg, no=148, id=5762, vol=4.414000e+02
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid  113 and name   HN)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid  113 and name   HN)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid  113 and name   HN) 3.656 1.670 1.670 weight 1.000 ! spec=15Nn...5deg, no=148, id=5762, vol=4.414000e+02
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid  113 and name   HN)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid  113 and name   HN)
assign (segid "   A" and resid  113 and name   HN) (segid "   A" and resid   78 and name   HA) 3.941 1.941 1.941 weight 1.000 ! spec=15Nn...5deg, no=149, id=5763, vol=2.238000e+02
assign (segid "   B" and resid  113 and name   HN) (segid "   B" and resid   78 and name   HA) 3.941 1.941 1.941 weight 1.000 ! spec=15Nn...5deg, no=149, id=5763, vol=2.238000e+02
assign (segid "   A" and resid  113 and name   HA) (segid "   A" and resid  113 and name   HN) 3.006 1.130 1.130 weight 1.000 ! spec=15Nn...5deg, no=150, id=5764, vol=4.898000e+02
assign (segid "   B" and resid  113 and name   HA) (segid "   B" and resid  113 and name   HN) 3.006 1.130 1.130 weight 1.000 ! spec=15Nn...5deg, no=150, id=5764, vol=4.898000e+02
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid  101 and name  HB1) 4.461 2.487 2.487 weight 1.000 ! spec=15Nn...5deg, no=152, id=5765, vol=2.380000e+02
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid  101 and name  HB1) 4.461 2.487 2.487 weight 1.000 ! spec=15Nn...5deg, no=152, id=5765, vol=2.380000e+02
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name   HN) 3.130 1.224 1.224 weight 1.000 ! spec=15Nn...5deg, no=153, id=5766, vol=3.897000e+02
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   31 and name   HN) 3.130 1.224 1.224 weight 1.000 ! spec=15Nn...5deg, no=153, id=5766, vol=3.897000e+02
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   33 and name   HN) 4.201 2.206 2.206 weight 1.000 ! spec=15Nn...5deg, no=154, id=5767, vol=2.828000e+02
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   33 and name   HN) 4.201 2.206 2.206 weight 1.000 ! spec=15Nn...5deg, no=154, id=5767, vol=2.828000e+02
assign (segid "   A" and resid   31 and name   HB) (segid "   A" and resid   31 and name   HN) 2.632 0.866 0.866 weight 1.000 ! spec=15Nn...5deg, no=156, id=5769, vol=4.876000e+02
assign (segid "   B" and resid   31 and name   HB) (segid "   B" and resid   31 and name   HN) 2.632 0.866 0.866 weight 1.000 ! spec=15Nn...5deg, no=156, id=5769, vol=4.876000e+02
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name   HN) 2.896 1.048 1.048 weight 1.000 ! spec=15Nn...5deg, no=157, id=5770, vol=4.199000e+02
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid   31 and name   HN) 2.896 1.048 1.048 weight 1.000 ! spec=15Nn...5deg, no=157, id=5770, vol=4.199000e+02
assign (segid "   A" and resid   31 and name HD12) (segid "   A" and resid   31 and name   HN) 4.084 2.085 2.085 weight 1.000 ! spec=15Nn...5deg, no=161, id=5774, vol=3.314000e+02
    or (segid "   A" and resid   31 and name HD11) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   31 and name HD13) (segid "   A" and resid   31 and name   HN)
assign (segid "   B" and resid   31 and name HD12) (segid "   B" and resid   31 and name   HN) 4.084 2.085 2.085 weight 1.000 ! spec=15Nn...5deg, no=161, id=5774, vol=3.314000e+02
    or (segid "   B" and resid   31 and name HD11) (segid "   B" and resid   31 and name   HN)
    or (segid "   B" and resid   31 and name HD13) (segid "   B" and resid   31 and name   HN)
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   31 and name   HN) 3.617 1.635 1.635 weight 1.000 ! spec=15Nn...5deg, no=162, id=5775, vol=3.470000e+02
assign (segid "   B" and resid   30 and name  HB2) (segid "   B" and resid   31 and name   HN) 3.617 1.635 1.635 weight 1.000 ! spec=15Nn...5deg, no=162, id=5775, vol=3.470000e+02
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   32 and name  HG1) 3.092 1.195 1.195 weight 1.000 ! spec=15Nn...5deg, no=164, id=5776, vol=4.876000e+02
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   32 and name  HG1) 3.092 1.195 1.195 weight 1.000 ! spec=15Nn...5deg, no=164, id=5776, vol=4.876000e+02
assign (segid "   A" and resid   31 and name HG22) (segid "   A" and resid   31 and name   HN) 2.223 0.618 0.618 weight 1.000 ! spec=15Nn...5deg, no=165, id=5777, vol=8.452000e+02
    or (segid "   A" and resid   31 and name HG21) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   31 and name HG23) (segid "   A" and resid   31 and name   HN)
assign (segid "   B" and resid   31 and name HG22) (segid "   B" and resid   31 and name   HN) 2.223 0.618 0.618 weight 1.000 ! spec=15Nn...5deg, no=165, id=5777, vol=8.452000e+02
    or (segid "   B" and resid   31 and name HG21) (segid "   B" and resid   31 and name   HN)
    or (segid "   B" and resid   31 and name HG23) (segid "   B" and resid   31 and name   HN)
assign (segid "   A" and resid   50 and name  HG1) (segid "   A" and resid   50 and name   HN) 2.728 0.930 0.930 weight 1.000 ! spec=15Nn...5deg, no=170, id=5780, vol=5.679000e+02
assign (segid "   B" and resid   50 and name  HG1) (segid "   B" and resid   50 and name   HN) 2.728 0.930 0.930 weight 1.000 ! spec=15Nn...5deg, no=170, id=5780, vol=5.679000e+02
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name   HN) 3.224 1.299 1.299 weight 1.000 ! spec=15Nn...5deg, no=172, id=5782, vol=2.839000e+02
assign (segid "   B" and resid   50 and name   HA) (segid "   B" and resid   50 and name   HN) 3.224 1.299 1.299 weight 1.000 ! spec=15Nn...5deg, no=172, id=5782, vol=2.839000e+02
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name   HN) 2.750 0.945 0.945 weight 1.000 ! spec=15Nn...5deg, no=173, id=5783, vol=1.056000e+03
assign (segid "   B" and resid   50 and name  HB2) (segid "   B" and resid   50 and name   HN) 2.750 0.945 0.945 weight 1.000 ! spec=15Nn...5deg, no=173, id=5783, vol=1.056000e+03
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name  HB2) 3.751 1.759 1.759 weight 1.000 ! spec=15Nn...5deg, no=181, id=5790, vol=3.384000e+02
assign (segid "   B" and resid   81 and name   HN) (segid "   B" and resid   80 and name  HB2) 3.751 1.759 1.759 weight 1.000 ! spec=15Nn...5deg, no=181, id=5790, vol=3.384000e+02
assign (segid "   A" and resid  111 and name HG12) (segid "   A" and resid   81 and name   HN) 3.221 1.297 1.297 weight 1.000 ! spec=15Nn...5deg, no=182, id=5791, vol=2.597000e+02
    or (segid "   A" and resid  111 and name HG11) (segid "   A" and resid   81 and name   HN)
    or (segid "   A" and resid  111 and name HG13) (segid "   A" and resid   81 and name   HN)
assign (segid "   B" and resid  111 and name HG12) (segid "   B" and resid   81 and name   HN) 3.221 1.297 1.297 weight 1.000 ! spec=15Nn...5deg, no=182, id=5791, vol=2.597000e+02
    or (segid "   B" and resid  111 and name HG11) (segid "   B" and resid   81 and name   HN)
    or (segid "   B" and resid  111 and name HG13) (segid "   B" and resid   81 and name   HN)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name   HA) 3.174 1.259 1.259 weight 1.000 ! spec=15Nn...5deg, no=185, id=5793, vol=3.912000e+02
assign (segid "   B" and resid   81 and name   HN) (segid "   B" and resid   81 and name   HA) 3.174 1.259 1.259 weight 1.000 ! spec=15Nn...5deg, no=185, id=5793, vol=3.912000e+02
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   52 and name   HN) 3.252 1.322 1.322 weight 1.000 ! spec=15Nn...5deg, no=188, id=5795, vol=3.736000e+02
assign (segid "   B" and resid   51 and name   HA) (segid "   B" and resid   52 and name   HN) 3.252 1.322 1.322 weight 1.000 ! spec=15Nn...5deg, no=188, id=5795, vol=3.736000e+02
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   22 and name   HN) 2.348 0.689 0.689 weight 1.000 ! spec=15Nn...5deg, no=192, id=5798, vol=8.110000e+02
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   22 and name   HN)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   22 and name   HN) 2.348 0.689 0.689 weight 1.000 ! spec=15Nn...5deg, no=192, id=5798, vol=8.110000e+02
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   22 and name   HN)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   22 and name   HN)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   22 and name   HN) 4.179 2.183 2.183 weight 1.000 ! spec=15Nn...5deg, no=193, id=5799, vol=3.278000e+02
assign (segid "   B" and resid   53 and name   HA) (segid "   B" and resid   22 and name   HN) 4.179 2.183 2.183 weight 1.000 ! spec=15Nn...5deg, no=193, id=5799, vol=3.278000e+02
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   23 and name  HA1) 4.248 2.255 2.255 weight 1.000 ! spec=15Nn...5deg, no=194, id=5800, vol=3.324000e+02
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   23 and name  HA1) 4.248 2.255 2.255 weight 1.000 ! spec=15Nn...5deg, no=194, id=5800, vol=3.324000e+02
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HB1) 4.452 2.477 2.477 weight 1.000 ! spec=15Nn...5deg, no=196, id=5801, vol=4.239000e+02
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   21 and name  HB1) 4.452 2.477 2.477 weight 1.000 ! spec=15Nn...5deg, no=196, id=5801, vol=4.239000e+02
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   22 and name   HN) 3.849 1.852 1.852 weight 1.000 ! spec=15Nn...5deg, no=197, id=5802, vol=2.412000e+02
    or (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   22 and name HG13) (segid "   A" and resid   22 and name   HN)
assign (segid "   B" and resid   22 and name HG12) (segid "   B" and resid   22 and name   HN) 3.849 1.852 1.852 weight 1.000 ! spec=15Nn...5deg, no=197, id=5802, vol=2.412000e+02
    or (segid "   B" and resid   22 and name HG11) (segid "   B" and resid   22 and name   HN)
    or (segid "   B" and resid   22 and name HG13) (segid "   B" and resid   22 and name   HN)
assign (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   22 and name   HN) 3.621 3.621 2.379 weight 1.000 ! spec=15Nn...5deg, no=200, id=5804, vol=5.168000e+02
    or (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   22 and name   HN)
assign (segid "   B" and resid   20 and name HG22) (segid "   B" and resid   22 and name   HN) 3.621 3.621 2.379 weight 1.000 ! spec=15Nn...5deg, no=200, id=5804, vol=5.168000e+02
    or (segid "   B" and resid   20 and name HG21) (segid "   B" and resid   22 and name   HN)
    or (segid "   B" and resid   20 and name HG23) (segid "   B" and resid   22 and name   HN)
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   22 and name   HN) 2.492 0.776 0.776 weight 1.000 ! spec=15Nn...5deg, no=202, id=5806, vol=8.110000e+02
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   22 and name   HN) 2.492 0.776 0.776 weight 1.000 ! spec=15Nn...5deg, no=202, id=5806, vol=8.110000e+02
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   22 and name   HN) 2.501 0.782 0.782 weight 1.000 ! spec=15Nn...5deg, no=204, id=5807, vol=5.509000e+02
assign (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   22 and name   HN) 2.501 0.782 0.782 weight 1.000 ! spec=15Nn...5deg, no=204, id=5807, vol=5.509000e+02
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   53 and name  HD1) 5.020 3.149 3.149 weight 1.000 ! spec=15Nn...5deg, no=205, id=5808, vol=3.314000e+02
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   53 and name  HD1) 5.020 3.149 3.149 weight 1.000 ! spec=15Nn...5deg, no=205, id=5808, vol=3.314000e+02
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HA) 2.812 0.988 0.988 weight 1.000 ! spec=15Nn...5deg, no=208, id=5809, vol=8.351000e+02
assign (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    7 and name   HA) 2.812 0.988 0.988 weight 1.000 ! spec=15Nn...5deg, no=208, id=5809, vol=8.351000e+02
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name   HA) 2.764 0.955 0.955 weight 1.000 ! spec=15Nn...5deg, no=209, id=5810, vol=5.701000e+02
assign (segid "   B" and resid    8 and name   HN) (segid "   B" and resid    8 and name   HA) 2.764 0.955 0.955 weight 1.000 ! spec=15Nn...5deg, no=209, id=5810, vol=5.701000e+02
assign (segid "   A" and resid  107 and name   HA) (segid "   A" and resid  108 and name   HN) 2.561 0.820 0.820 weight 1.000 ! spec=15Nn...5deg, no=211, id=5811, vol=1.063000e+03
assign (segid "   B" and resid  107 and name   HA) (segid "   B" and resid  108 and name   HN) 2.561 0.820 0.820 weight 1.000 ! spec=15Nn...5deg, no=211, id=5811, vol=1.063000e+03
assign (segid "   A" and resid  108 and name   HA) (segid "   A" and resid  108 and name   HN) 3.032 1.149 1.149 weight 1.000 ! spec=15Nn...5deg, no=212, id=5812, vol=5.047000e+02
assign (segid "   B" and resid  108 and name   HA) (segid "   B" and resid  108 and name   HN) 3.032 1.149 1.149 weight 1.000 ! spec=15Nn...5deg, no=212, id=5812, vol=5.047000e+02
assign (segid "   A" and resid  107 and name  HB2) (segid "   A" and resid  108 and name   HN) 2.274 0.646 0.646 weight 1.000 ! spec=15Nn...5deg, no=215, id=5814, vol=1.858000e+03
    or (segid "   A" and resid  107 and name  HB1) (segid "   A" and resid  108 and name   HN)
    or (segid "   A" and resid  107 and name  HB3) (segid "   A" and resid  108 and name   HN)
assign (segid "   B" and resid  107 and name  HB2) (segid "   B" and resid  108 and name   HN) 2.274 0.646 0.646 weight 1.000 ! spec=15Nn...5deg, no=215, id=5814, vol=1.858000e+03
    or (segid "   B" and resid  107 and name  HB1) (segid "   B" and resid  108 and name   HN)
    or (segid "   B" and resid  107 and name  HB3) (segid "   B" and resid  108 and name   HN)
assign (segid "   A" and resid   56 and name HG21) (segid "   A" and resid  108 and name   HN) 3.137 1.230 1.230 weight 1.000 ! spec=15Nn...5deg, no=216, id=5815, vol=6.733000e+02
    or (segid "   A" and resid   56 and name HG22) (segid "   A" and resid  108 and name   HN)
    or (segid "   A" and resid   56 and name HG23) (segid "   A" and resid  108 and name   HN)
assign (segid "   B" and resid   56 and name HG21) (segid "   B" and resid  108 and name   HN) 3.137 1.230 1.230 weight 1.000 ! spec=15Nn...5deg, no=216, id=5815, vol=6.733000e+02
    or (segid "   B" and resid   56 and name HG22) (segid "   B" and resid  108 and name   HN)
    or (segid "   B" and resid   56 and name HG23) (segid "   B" and resid  108 and name   HN)
assign (segid "   A" and resid  108 and name   HN) (segid "   A" and resid  108 and name  HB1) 3.684 1.696 1.696 weight 1.000 ! spec=15Nn...5deg, no=217, id=5816, vol=4.083000e+02
assign (segid "   B" and resid  108 and name   HN) (segid "   B" and resid  108 and name  HB1) 3.684 1.696 1.696 weight 1.000 ! spec=15Nn...5deg, no=217, id=5816, vol=4.083000e+02
assign (segid "   A" and resid  106 and name   HN) (segid "   A" and resid  106 and name   HB) 3.732 1.741 1.741 weight 1.000 ! spec=15Nn...5deg, no=220, id=5818, vol=2.547000e+02
assign (segid "   B" and resid  106 and name   HN) (segid "   B" and resid  106 and name   HB) 3.732 1.741 1.741 weight 1.000 ! spec=15Nn...5deg, no=220, id=5818, vol=2.547000e+02
assign (segid "   A" and resid  106 and name HG21) (segid "   A" and resid  106 and name   HN) 2.664 0.887 0.887 weight 1.000 ! spec=15Nn...5deg, no=221, id=5819, vol=5.843000e+02
    or (segid "   A" and resid  106 and name HG22) (segid "   A" and resid  106 and name   HN)
    or (segid "   A" and resid  106 and name HG23) (segid "   A" and resid  106 and name   HN)
assign (segid "   B" and resid  106 and name HG21) (segid "   B" and resid  106 and name   HN) 2.664 0.887 0.887 weight 1.000 ! spec=15Nn...5deg, no=221, id=5819, vol=5.843000e+02
    or (segid "   B" and resid  106 and name HG22) (segid "   B" and resid  106 and name   HN)
    or (segid "   B" and resid  106 and name HG23) (segid "   B" and resid  106 and name   HN)
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   16 and name  HB2) 3.590 1.611 1.611 weight 1.000 ! spec=15Nn...5deg, no=226, id=5822, vol=4.239000e+02
assign (segid "   B" and resid   59 and name   HN) (segid "   B" and resid   16 and name  HB2) 3.590 1.611 1.611 weight 1.000 ! spec=15Nn...5deg, no=226, id=5822, vol=4.239000e+02
assign (segid "   A" and resid   59 and name  HG1) (segid "   A" and resid   59 and name   HN) 2.365 0.699 0.699 weight 1.000 ! spec=15Nn...5deg, no=227, id=5823, vol=8.050000e+02
assign (segid "   B" and resid   59 and name  HG1) (segid "   B" and resid   59 and name   HN) 2.365 0.699 0.699 weight 1.000 ! spec=15Nn...5deg, no=227, id=5823, vol=8.050000e+02
assign (segid "   A" and resid   59 and name  HB1) (segid "   A" and resid   59 and name   HN) 2.415 0.729 0.729 weight 1.000 ! spec=15Nn...5deg, no=231, id=5827, vol=9.151000e+02
assign (segid "   B" and resid   59 and name  HB1) (segid "   B" and resid   59 and name   HN) 2.415 0.729 0.729 weight 1.000 ! spec=15Nn...5deg, no=231, id=5827, vol=9.151000e+02
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   59 and name  HD2) 4.599 2.644 2.644 weight 1.000 ! spec=15Nn...5deg, no=232, id=5828, vol=5.360000e+02
assign (segid "   B" and resid   59 and name   HN) (segid "   B" and resid   59 and name  HD2) 4.599 2.644 2.644 weight 1.000 ! spec=15Nn...5deg, no=232, id=5828, vol=5.360000e+02
assign (segid "   A" and resid   59 and name   HA) (segid "   A" and resid   59 and name   HN) 2.988 1.116 1.116 weight 1.000 ! spec=15Nn...5deg, no=233, id=5829, vol=5.871000e+02
assign (segid "   B" and resid   59 and name   HA) (segid "   B" and resid   59 and name   HN) 2.988 1.116 1.116 weight 1.000 ! spec=15Nn...5deg, no=233, id=5829, vol=5.871000e+02
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid  108 and name  HB1) 4.307 2.319 2.319 weight 1.000 ! spec=15Nn...5deg, no=234, id=5830, vol=4.239000e+02
assign (segid "   B" and resid   59 and name   HN) (segid "   B" and resid  108 and name  HB1) 4.307 2.319 2.319 weight 1.000 ! spec=15Nn...5deg, no=234, id=5830, vol=4.239000e+02
assign (segid "   A" and resid   59 and name   HN) (segid "   A" and resid   58 and name   HN) 4.040 2.040 2.040 weight 1.000 ! spec=15Nn...5deg, no=236, id=5831, vol=2.775000e+02
assign (segid "   B" and resid   59 and name   HN) (segid "   B" and resid   58 and name   HN) 4.040 2.040 2.040 weight 1.000 ! spec=15Nn...5deg, no=236, id=5831, vol=2.775000e+02
assign (segid "   A" and resid   42 and name HG22) (segid "   A" and resid   44 and name   HN) 3.338 1.393 1.393 weight 1.000 ! spec=15Nn...5deg, no=238, id=5833, vol=3.791000e+02
    or (segid "   A" and resid   42 and name HG21) (segid "   A" and resid   44 and name   HN)
    or (segid "   A" and resid   42 and name HG23) (segid "   A" and resid   44 and name   HN)
assign (segid "   B" and resid   42 and name HG22) (segid "   B" and resid   44 and name   HN) 3.338 1.393 1.393 weight 1.000 ! spec=15Nn...5deg, no=238, id=5833, vol=3.791000e+02
    or (segid "   B" and resid   42 and name HG21) (segid "   B" and resid   44 and name   HN)
    or (segid "   B" and resid   42 and name HG23) (segid "   B" and resid   44 and name   HN)
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name   HN) 3.002 1.126 1.126 weight 1.000 ! spec=15Nn...5deg, no=243, id=5834, vol=5.658000e+02
assign (segid "   B" and resid   44 and name   HA) (segid "   B" and resid   44 and name   HN) 3.002 1.126 1.126 weight 1.000 ! spec=15Nn...5deg, no=243, id=5834, vol=5.658000e+02
assign (segid "   A" and resid   44 and name   HB) (segid "   A" and resid   44 and name   HN) 2.611 0.852 0.852 weight 1.000 ! spec=15Nn...5deg, no=244, id=5835, vol=7.658000e+02
assign (segid "   B" and resid   44 and name   HB) (segid "   B" and resid   44 and name   HN) 2.611 0.852 0.852 weight 1.000 ! spec=15Nn...5deg, no=244, id=5835, vol=7.658000e+02
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   44 and name   HN) 2.225 0.619 0.619 weight 1.000 ! spec=15Nn...5deg, no=245, id=5836, vol=1.887000e+03
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   44 and name   HN) 2.225 0.619 0.619 weight 1.000 ! spec=15Nn...5deg, no=245, id=5836, vol=1.887000e+03
assign (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   44 and name   HN) 4.802 2.882 2.882 weight 1.000 ! spec=15Nn...5deg, no=246, id=5837, vol=3.610000e+02
assign (segid "   B" and resid   43 and name  HB2) (segid "   B" and resid   44 and name   HN) 4.802 2.882 2.882 weight 1.000 ! spec=15Nn...5deg, no=246, id=5837, vol=3.610000e+02
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   48 and name HG22) 3.381 1.429 1.429 weight 1.000 ! spec=15Nn...5deg, no=253, id=5842, vol=4.791000e+02
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   48 and name HG21)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   48 and name HG23)
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   48 and name HG22) 3.381 1.429 1.429 weight 1.000 ! spec=15Nn...5deg, no=253, id=5842, vol=4.791000e+02
    or (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   48 and name HG21)
    or (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   48 and name HG23)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   91 and name   HA) 4.208 2.213 2.213 weight 1.000 ! spec=15Nn...5deg, no=255, id=5844, vol=2.095000e+02
assign (segid "   B" and resid   38 and name   HN) (segid "   B" and resid   91 and name   HA) 4.208 2.213 2.213 weight 1.000 ! spec=15Nn...5deg, no=255, id=5844, vol=2.095000e+02
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   38 and name   HN) 2.310 0.667 0.667 weight 1.000 ! spec=15Nn...5deg, no=256, id=5845, vol=9.677000e+02
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   38 and name   HN)
assign (segid "   B" and resid   38 and name HG22) (segid "   B" and resid   38 and name   HN) 2.310 0.667 0.667 weight 1.000 ! spec=15Nn...5deg, no=256, id=5845, vol=9.677000e+02
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid   38 and name   HN)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid   38 and name   HN)
assign (segid "   A" and resid   27 and name HG21) (segid "   A" and resid   38 and name   HN) 2.902 1.052 1.052 weight 1.000 ! spec=15Nn...5deg, no=259, id=5847, vol=1.773000e+03
    or (segid "   A" and resid   27 and name HG22) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   27 and name HG23) (segid "   A" and resid   38 and name   HN)
assign (segid "   B" and resid   27 and name HG21) (segid "   B" and resid   38 and name   HN) 2.902 1.052 1.052 weight 1.000 ! spec=15Nn...5deg, no=259, id=5847, vol=1.773000e+03
    or (segid "   B" and resid   27 and name HG22) (segid "   B" and resid   38 and name   HN)
    or (segid "   B" and resid   27 and name HG23) (segid "   B" and resid   38 and name   HN)
assign (segid "   A" and resid   38 and name   HB) (segid "   A" and resid   38 and name   HN) 2.412 0.727 0.727 weight 1.000 ! spec=15Nn...5deg, no=261, id=5849, vol=6.613000e+02
assign (segid "   B" and resid   38 and name   HB) (segid "   B" and resid   38 and name   HN) 2.412 0.727 0.727 weight 1.000 ! spec=15Nn...5deg, no=261, id=5849, vol=6.613000e+02
assign (segid "   A" and resid   38 and name HG12) (segid "   A" and resid   38 and name   HN) 3.250 1.320 1.320 weight 1.000 ! spec=15Nn...5deg, no=263, id=5850, vol=6.163000e+02
    or (segid "   A" and resid   38 and name HG11) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   38 and name HG13) (segid "   A" and resid   38 and name   HN)
assign (segid "   B" and resid   38 and name HG12) (segid "   B" and resid   38 and name   HN) 3.250 1.320 1.320 weight 1.000 ! spec=15Nn...5deg, no=263, id=5850, vol=6.163000e+02
    or (segid "   B" and resid   38 and name HG11) (segid "   B" and resid   38 and name   HN)
    or (segid "   B" and resid   38 and name HG13) (segid "   B" and resid   38 and name   HN)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   38 and name   HN) 3.170 1.256 1.256 weight 1.000 ! spec=15Nn...5deg, no=266, id=5853, vol=2.846000e+02
assign (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   38 and name   HN) 3.170 1.256 1.256 weight 1.000 ! spec=15Nn...5deg, no=266, id=5853, vol=2.846000e+02
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name   HN) 3.188 1.270 1.270 weight 1.000 ! spec=15Nn...5deg, no=267, id=5854, vol=2.202000e+02
assign (segid "   B" and resid   38 and name   HA) (segid "   B" and resid   38 and name   HN) 3.188 1.270 1.270 weight 1.000 ! spec=15Nn...5deg, no=267, id=5854, vol=2.202000e+02
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   38 and name   HN) 2.217 0.614 0.614 weight 1.000 ! spec=15Nn...5deg, no=269, id=5855, vol=1.517000e+03
assign (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   38 and name   HN) 2.217 0.614 0.614 weight 1.000 ! spec=15Nn...5deg, no=269, id=5855, vol=1.517000e+03
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name  HG1) 4.658 2.712 2.712 weight 1.000 ! spec=15Nn...5deg, no=275, id=5859, vol=3.049000e+02
assign (segid "   B" and resid   70 and name   HN) (segid "   B" and resid   69 and name  HG1) 4.658 2.712 2.712 weight 1.000 ! spec=15Nn...5deg, no=275, id=5859, vol=3.049000e+02
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name  HG2) 4.654 2.707 2.707 weight 1.000 ! spec=15Nn...5deg, no=277, id=5861, vol=2.643000e+02
assign (segid "   B" and resid   70 and name   HN) (segid "   B" and resid   69 and name  HG2) 4.654 2.707 2.707 weight 1.000 ! spec=15Nn...5deg, no=277, id=5861, vol=2.643000e+02
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   70 and name   HN) 4.018 2.018 2.018 weight 1.000 ! spec=15Nn...5deg, no=280, id=5863, vol=2.277000e+02
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   70 and name   HN)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   70 and name   HN)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   70 and name   HN) 4.018 2.018 2.018 weight 1.000 ! spec=15Nn...5deg, no=280, id=5863, vol=2.277000e+02
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   70 and name   HN)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   70 and name   HN)
assign (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   37 and name   HN) 2.280 0.650 0.650 weight 1.000 ! spec=15Nn...5deg, no=281, id=5864, vol=8.552000e+02
assign (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   37 and name   HN) 2.280 0.650 0.650 weight 1.000 ! spec=15Nn...5deg, no=281, id=5864, vol=8.552000e+02
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   92 and name   HN) 3.028 1.146 1.146 weight 1.000 ! spec=15Nn...5deg, no=282, id=5865, vol=4.148000e+02
assign (segid "   B" and resid   37 and name   HN) (segid "   B" and resid   92 and name   HN) 3.028 1.146 1.146 weight 1.000 ! spec=15Nn...5deg, no=282, id=5865, vol=4.148000e+02
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   37 and name   HN) 3.296 1.358 1.358 weight 1.000 ! spec=15Nn...5deg, no=284, id=5867, vol=8.200000e+02
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   37 and name   HN)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   37 and name   HN) 3.296 1.358 1.358 weight 1.000 ! spec=15Nn...5deg, no=284, id=5867, vol=8.200000e+02
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   37 and name   HN)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   37 and name   HN)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   37 and name   HN) 2.309 0.667 0.667 weight 1.000 ! spec=15Nn...5deg, no=285, id=5868, vol=1.716000e+03
assign (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   37 and name   HN) 2.309 0.667 0.667 weight 1.000 ! spec=15Nn...5deg, no=285, id=5868, vol=1.716000e+03
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name   HN) 2.238 0.626 0.626 weight 1.000 ! spec=15Nn...5deg, no=286, id=5869, vol=1.194000e+03
assign (segid "   B" and resid   37 and name   HB) (segid "   B" and resid   37 and name   HN) 2.238 0.626 0.626 weight 1.000 ! spec=15Nn...5deg, no=286, id=5869, vol=1.194000e+03
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   27 and name   HA) 3.933 1.933 1.933 weight 1.000 ! spec=15Nn...5deg, no=288, id=5871, vol=3.208000e+02
assign (segid "   B" and resid   37 and name   HN) (segid "   B" and resid   27 and name   HA) 3.933 1.933 1.933 weight 1.000 ! spec=15Nn...5deg, no=288, id=5871, vol=3.208000e+02
assign (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HN) 3.174 1.259 1.259 weight 1.000 ! spec=15Nn...5deg, no=289, id=5872, vol=1.033000e+03
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HN)
assign (segid "   B" and resid   37 and name HG21) (segid "   B" and resid   37 and name   HN) 3.174 1.259 1.259 weight 1.000 ! spec=15Nn...5deg, no=289, id=5872, vol=1.033000e+03
    or (segid "   B" and resid   37 and name HG22) (segid "   B" and resid   37 and name   HN)
    or (segid "   B" and resid   37 and name HG23) (segid "   B" and resid   37 and name   HN)
assign (segid "   A" and resid   36 and name HG22) (segid "   A" and resid   37 and name   HN) 3.098 1.200 1.200 weight 1.000 ! spec=15Nn...5deg, no=290, id=5873, vol=8.281000e+02
    or (segid "   A" and resid   36 and name HG21) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   36 and name HG23) (segid "   A" and resid   37 and name   HN)
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   37 and name   HN) 3.098 1.200 1.200 weight 1.000 ! spec=15Nn...5deg, no=290, id=5873, vol=8.281000e+02
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   37 and name   HN)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   37 and name   HN)
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   37 and name   HN) 3.937 1.937 1.937 weight 1.000 ! spec=15Nn...5deg, no=292, id=5874, vol=3.827000e+02
assign (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   37 and name   HN) 3.937 1.937 1.937 weight 1.000 ! spec=15Nn...5deg, no=292, id=5874, vol=3.827000e+02
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name   HN) 2.303 0.663 0.663 weight 1.000 ! spec=15Nn...5deg, no=293, id=5875, vol=1.915000e+03
assign (segid "   B" and resid   37 and name   HA) (segid "   B" and resid   37 and name   HN) 2.303 0.663 0.663 weight 1.000 ! spec=15Nn...5deg, no=293, id=5875, vol=1.915000e+03
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name   HN) 2.827 0.999 0.999 weight 1.000 ! spec=15Nn...5deg, no=295, id=5876, vol=5.196000e+02
assign (segid "   B" and resid   80 and name  HB1) (segid "   B" and resid   80 and name   HN) 2.827 0.999 0.999 weight 1.000 ! spec=15Nn...5deg, no=295, id=5876, vol=5.196000e+02
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   80 and name   HN) 4.426 2.449 2.449 weight 1.000 ! spec=15Nn...5deg, no=297, id=5877, vol=4.379000e+02
assign (segid "   B" and resid   79 and name  HB1) (segid "   B" and resid   80 and name   HN) 4.426 2.449 2.449 weight 1.000 ! spec=15Nn...5deg, no=297, id=5877, vol=4.379000e+02
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name   HN) 3.515 1.544 1.544 weight 1.000 ! spec=15Nn...5deg, no=299, id=5879, vol=2.130000e+02
assign (segid "   B" and resid   80 and name   HA) (segid "   B" and resid   80 and name   HN) 3.515 1.544 1.544 weight 1.000 ! spec=15Nn...5deg, no=299, id=5879, vol=2.130000e+02
assign (segid "   A" and resid   43 and name HD22) (segid "   A" and resid   43 and name   HA) 4.730 2.797 2.797 weight 1.000 ! spec=15Nn...5deg, no=300, id=5880, vol=3.213000e+02
assign (segid "   B" and resid   43 and name HD22) (segid "   B" and resid   43 and name   HA) 4.730 2.797 2.797 weight 1.000 ! spec=15Nn...5deg, no=300, id=5880, vol=3.213000e+02
assign (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   43 and name HD22) 3.981 1.981 1.981 weight 1.000 ! spec=15Nn...5deg, no=301, id=5881, vol=5.637000e+02
assign (segid "   B" and resid   43 and name  HB2) (segid "   B" and resid   43 and name HD22) 3.981 1.981 1.981 weight 1.000 ! spec=15Nn...5deg, no=301, id=5881, vol=5.637000e+02
assign (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   43 and name HD22) 4.487 2.517 2.517 weight 1.000 ! spec=15Nn...5deg, no=302, id=5882, vol=4.841000e+02
assign (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   43 and name HD22) 4.487 2.517 2.517 weight 1.000 ! spec=15Nn...5deg, no=302, id=5882, vol=4.841000e+02
assign (segid "   A" and resid   62 and name HD21) (segid "   A" and resid   62 and name   HA) 4.635 2.685 2.685 weight 1.000 ! spec=15Nn...5deg, no=305, id=5885, vol=3.183000e+02
assign (segid "   B" and resid   62 and name HD21) (segid "   B" and resid   62 and name   HA) 4.635 2.685 2.685 weight 1.000 ! spec=15Nn...5deg, no=305, id=5885, vol=3.183000e+02
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name HD21) 4.060 2.060 2.060 weight 1.000 ! spec=15Nn...5deg, no=306, id=5886, vol=4.299000e+02
assign (segid "   B" and resid   62 and name  HB2) (segid "   B" and resid   62 and name HD21) 4.060 2.060 2.060 weight 1.000 ! spec=15Nn...5deg, no=306, id=5886, vol=4.299000e+02
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid  103 and name   HN) 3.232 1.306 1.306 weight 1.000 ! spec=15Nn...5deg, no=311, id=5890, vol=7.939000e+02
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid  103 and name   HN)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid  103 and name   HN)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid  103 and name   HN) 3.232 1.306 1.306 weight 1.000 ! spec=15Nn...5deg, no=311, id=5890, vol=7.939000e+02
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid  103 and name   HN)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid  103 and name   HN)
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  103 and name  HG2) 3.583 1.605 1.605 weight 1.000 ! spec=15Nn...5deg, no=312, id=5891, vol=5.317000e+02
assign (segid "   B" and resid  103 and name   HN) (segid "   B" and resid  103 and name  HG2) 3.583 1.605 1.605 weight 1.000 ! spec=15Nn...5deg, no=312, id=5891, vol=5.317000e+02
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  103 and name  HD2) 4.964 3.081 3.081 weight 1.000 ! spec=15Nn...5deg, no=314, id=5893, vol=2.231000e+02
assign (segid "   B" and resid  103 and name   HN) (segid "   B" and resid  103 and name  HD2) 4.964 3.081 3.081 weight 1.000 ! spec=15Nn...5deg, no=314, id=5893, vol=2.231000e+02
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid  103 and name   HN) 4.066 2.067 2.067 weight 1.000 ! spec=15Nn...5deg, no=316, id=5895, vol=2.768000e+02
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid  103 and name   HN)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid  103 and name   HN)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid  103 and name   HN) 4.066 2.067 2.067 weight 1.000 ! spec=15Nn...5deg, no=316, id=5895, vol=2.768000e+02
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid  103 and name   HN)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid  103 and name   HN)
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  103 and name  HG1) 2.252 0.634 0.634 weight 1.000 ! spec=15Nn...5deg, no=317, id=5896, vol=8.582000e+02
assign (segid "   B" and resid  103 and name   HN) (segid "   B" and resid  103 and name  HG1) 2.252 0.634 0.634 weight 1.000 ! spec=15Nn...5deg, no=317, id=5896, vol=8.582000e+02
assign (segid "   A" and resid  114 and name   HA) (segid "   A" and resid  114 and name   HN) 3.255 1.325 1.325 weight 1.000 ! spec=15Nn...5deg, no=319, id=5897, vol=2.682000e+02
assign (segid "   B" and resid  114 and name   HA) (segid "   B" and resid  114 and name   HN) 3.255 1.325 1.325 weight 1.000 ! spec=15Nn...5deg, no=319, id=5897, vol=2.682000e+02
assign (segid "   A" and resid  113 and name  HB2) (segid "   A" and resid  114 and name   HN) 4.170 2.173 2.173 weight 1.000 ! spec=15Nn...5deg, no=320, id=5898, vol=4.478000e+02
assign (segid "   B" and resid  113 and name  HB2) (segid "   B" and resid  114 and name   HN) 4.170 2.173 2.173 weight 1.000 ! spec=15Nn...5deg, no=320, id=5898, vol=4.478000e+02
assign (segid "   A" and resid  113 and name   HA) (segid "   A" and resid  114 and name   HN) 2.313 0.669 0.669 weight 1.000 ! spec=15Nn...5deg, no=322, id=5899, vol=1.036000e+03
assign (segid "   B" and resid  113 and name   HA) (segid "   B" and resid  114 and name   HN) 2.313 0.669 0.669 weight 1.000 ! spec=15Nn...5deg, no=322, id=5899, vol=1.036000e+03
assign (segid "   A" and resid  114 and name  HD2) (segid "   A" and resid  114 and name   HN) 4.828 2.914 2.914 weight 1.000 ! spec=15Nn...5deg, no=323, id=5900, vol=2.288000e+02
assign (segid "   B" and resid  114 and name  HD2) (segid "   B" and resid  114 and name   HN) 4.828 2.914 2.914 weight 1.000 ! spec=15Nn...5deg, no=323, id=5900, vol=2.288000e+02
assign (segid "   A" and resid  114 and name  HB2) (segid "   A" and resid  114 and name   HN) 2.650 0.878 0.878 weight 1.000 ! spec=15Nn...5deg, no=325, id=5902, vol=4.514000e+02
assign (segid "   B" and resid  114 and name  HB2) (segid "   B" and resid  114 and name   HN) 2.650 0.878 0.878 weight 1.000 ! spec=15Nn...5deg, no=325, id=5902, vol=4.514000e+02
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   71 and name   HN) 3.037 1.153 1.153 weight 1.000 ! spec=15Nn...5deg, no=327, id=5903, vol=8.796000e+02
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   71 and name   HN)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   71 and name   HN)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   71 and name   HN) 3.037 1.153 1.153 weight 1.000 ! spec=15Nn...5deg, no=327, id=5903, vol=8.796000e+02
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   71 and name   HN)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   71 and name   HN)
assign (segid "   A" and resid   71 and name   HB) (segid "   A" and resid   71 and name   HN) 2.430 0.738 0.738 weight 1.000 ! spec=15Nn...5deg, no=329, id=5905, vol=9.421000e+02
assign (segid "   B" and resid   71 and name   HB) (segid "   B" and resid   71 and name   HN) 2.430 0.738 0.738 weight 1.000 ! spec=15Nn...5deg, no=329, id=5905, vol=9.421000e+02
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name   HN) 2.887 1.042 1.042 weight 1.000 ! spec=15Nn...5deg, no=332, id=5907, vol=4.393000e+02
assign (segid "   B" and resid   71 and name   HA) (segid "   B" and resid   71 and name   HN) 2.887 1.042 1.042 weight 1.000 ! spec=15Nn...5deg, no=332, id=5907, vol=4.393000e+02
assign (segid "   A" and resid   71 and name HG11) (segid "   A" and resid   71 and name   HN) 2.021 0.511 0.511 weight 1.000 ! spec=15Nn...5deg, no=333, id=5908, vol=1.019000e+03
assign (segid "   B" and resid   71 and name HG11) (segid "   B" and resid   71 and name   HN) 2.021 0.511 0.511 weight 1.000 ! spec=15Nn...5deg, no=333, id=5908, vol=1.019000e+03
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   21 and name  HB2) 3.957 1.957 1.957 weight 1.000 ! spec=15Nn...5deg, no=335, id=5909, vol=5.942000e+02
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   21 and name  HB2) 3.957 1.957 1.957 weight 1.000 ! spec=15Nn...5deg, no=335, id=5909, vol=5.942000e+02
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   53 and name   HN) 3.871 1.873 1.873 weight 1.000 ! spec=15Nn...5deg, no=337, id=5910, vol=4.274000e+02
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   53 and name   HN)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   53 and name   HN)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   53 and name   HN) 3.871 1.873 1.873 weight 1.000 ! spec=15Nn...5deg, no=337, id=5910, vol=4.274000e+02
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   53 and name   HN)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   53 and name   HN)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name   HN) 2.701 0.912 0.912 weight 1.000 ! spec=15Nn...5deg, no=338, id=5911, vol=1.080000e+03
assign (segid "   B" and resid   53 and name   HA) (segid "   B" and resid   53 and name   HN) 2.701 0.912 0.912 weight 1.000 ! spec=15Nn...5deg, no=338, id=5911, vol=1.080000e+03
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   53 and name   HN) 3.733 1.741 1.741 weight 1.000 ! spec=15Nn...5deg, no=343, id=5916, vol=4.234000e+02
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   53 and name   HN) 3.733 1.741 1.741 weight 1.000 ! spec=15Nn...5deg, no=343, id=5916, vol=4.234000e+02
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name  HB2) 3.916 1.917 1.917 weight 1.000 ! spec=15Nn...5deg, no=344, id=5917, vol=5.139000e+02
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   53 and name  HB2) 3.916 1.917 1.917 weight 1.000 ! spec=15Nn...5deg, no=344, id=5917, vol=5.139000e+02
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   57 and name  HB1) 3.932 1.932 1.932 weight 1.000 ! spec=15Nn...5deg, no=348, id=5920, vol=3.010000e+02
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   57 and name  HB1) 3.932 1.932 1.932 weight 1.000 ! spec=15Nn...5deg, no=348, id=5920, vol=3.010000e+02
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   59 and name   HN) 3.639 1.656 1.656 weight 1.000 ! spec=15Nn...5deg, no=349, id=5921, vol=2.835000e+02
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   59 and name   HN) 3.639 1.656 1.656 weight 1.000 ! spec=15Nn...5deg, no=349, id=5921, vol=2.835000e+02
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name   HN) 2.220 0.616 0.616 weight 1.000 ! spec=15Nn...5deg, no=351, id=5923, vol=1.140000e+03
assign (segid "   B" and resid   17 and name   HA) (segid "   B" and resid   18 and name   HN) 2.220 0.616 0.616 weight 1.000 ! spec=15Nn...5deg, no=351, id=5923, vol=1.140000e+03
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name   HN) 1.853 0.429 0.429 weight 1.000 ! spec=15Nn...5deg, no=352, id=5924, vol=2.227000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   18 and name   HN)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   18 and name   HN) 1.853 0.429 0.429 weight 1.000 ! spec=15Nn...5deg, no=352, id=5924, vol=2.227000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   18 and name   HN)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   18 and name   HN)
assign (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   18 and name   HN) 3.032 1.149 1.149 weight 1.000 ! spec=15Nn...5deg, no=355, id=5927, vol=4.428000e+02
assign (segid "   B" and resid   17 and name  HB1) (segid "   B" and resid   18 and name   HN) 3.032 1.149 1.149 weight 1.000 ! spec=15Nn...5deg, no=355, id=5927, vol=4.428000e+02
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name   HN) 2.628 0.863 0.863 weight 1.000 ! spec=15Nn...5deg, no=357, id=5928, vol=4.876000e+02
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   18 and name   HN) 2.628 0.863 0.863 weight 1.000 ! spec=15Nn...5deg, no=357, id=5928, vol=4.876000e+02
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   18 and name   HN) 3.762 1.769 1.769 weight 1.000 ! spec=15Nn...5deg, no=358, id=5929, vol=6.613000e+02
assign (segid "   B" and resid   17 and name  HB2) (segid "   B" and resid   18 and name   HN) 3.762 1.769 1.769 weight 1.000 ! spec=15Nn...5deg, no=358, id=5929, vol=6.613000e+02
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   19 and name   HN) 2.281 0.650 0.650 weight 1.000 ! spec=15Nn...5deg, no=359, id=5930, vol=2.168000e+03
assign (segid "   B" and resid   18 and name   HA) (segid "   B" and resid   19 and name   HN) 2.281 0.650 0.650 weight 1.000 ! spec=15Nn...5deg, no=359, id=5930, vol=2.168000e+03
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   19 and name   HN) 3.564 1.588 1.588 weight 1.000 ! spec=15Nn...5deg, no=360, id=5931, vol=1.000000e+03
assign (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   19 and name   HN) 3.564 1.588 1.588 weight 1.000 ! spec=15Nn...5deg, no=360, id=5931, vol=1.000000e+03
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name   HN) 3.003 1.127 1.127 weight 1.000 ! spec=15Nn...5deg, no=365, id=5934, vol=5.409000e+02
assign (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   19 and name   HN) 3.003 1.127 1.127 weight 1.000 ! spec=15Nn...5deg, no=365, id=5934, vol=5.409000e+02
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   19 and name   HN) 3.505 1.536 1.536 weight 1.000 ! spec=15Nn...5deg, no=367, id=5935, vol=8.030000e+02
assign (segid "   B" and resid   18 and name   HB) (segid "   B" and resid   19 and name   HN) 3.505 1.536 1.536 weight 1.000 ! spec=15Nn...5deg, no=367, id=5935, vol=8.030000e+02
assign (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   72 and name   HN) 3.400 1.445 1.445 weight 1.000 ! spec=15Nn...5deg, no=370, id=5936, vol=8.291000e+02
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   72 and name   HN)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   72 and name   HN)
assign (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   72 and name   HN) 3.400 1.445 1.445 weight 1.000 ! spec=15Nn...5deg, no=370, id=5936, vol=8.291000e+02
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   72 and name   HN)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   72 and name   HN)
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   72 and name   HN) 2.828 1.000 1.000 weight 1.000 ! spec=15Nn...5deg, no=372, id=5938, vol=7.276000e+02
assign (segid "   B" and resid   72 and name  HB2) (segid "   B" and resid   72 and name   HN) 2.828 1.000 1.000 weight 1.000 ! spec=15Nn...5deg, no=372, id=5938, vol=7.276000e+02
assign (segid "   A" and resid   71 and name HG22) (segid "   A" and resid   72 and name   HN) 2.504 0.784 0.784 weight 1.000 ! spec=15Nn...5deg, no=373, id=5939, vol=7.748000e+02
    or (segid "   A" and resid   71 and name HG21) (segid "   A" and resid   72 and name   HN)
    or (segid "   A" and resid   71 and name HG23) (segid "   A" and resid   72 and name   HN)
assign (segid "   B" and resid   71 and name HG22) (segid "   B" and resid   72 and name   HN) 2.504 0.784 0.784 weight 1.000 ! spec=15Nn...5deg, no=373, id=5939, vol=7.748000e+02
    or (segid "   B" and resid   71 and name HG21) (segid "   B" and resid   72 and name   HN)
    or (segid "   B" and resid   71 and name HG23) (segid "   B" and resid   72 and name   HN)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   72 and name   HN) 2.498 0.780 0.780 weight 1.000 ! spec=15Nn...5deg, no=374, id=5940, vol=8.110000e+02
assign (segid "   B" and resid   71 and name   HA) (segid "   B" and resid   72 and name   HN) 2.498 0.780 0.780 weight 1.000 ! spec=15Nn...5deg, no=374, id=5940, vol=8.110000e+02
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid  104 and name HG11) 3.430 1.470 1.470 weight 1.000 ! spec=15Nn...5deg, no=377, id=5942, vol=4.492000e+02
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid  104 and name HG11) 3.430 1.470 1.470 weight 1.000 ! spec=15Nn...5deg, no=377, id=5942, vol=4.492000e+02
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   21 and name  HE3) 3.616 1.635 1.635 weight 1.000 ! spec=15Nn...5deg, no=379, id=5943, vol=4.003000e+02
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   21 and name  HE3) 3.616 1.635 1.635 weight 1.000 ! spec=15Nn...5deg, no=379, id=5943, vol=4.003000e+02
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name   HA) 3.203 1.282 1.282 weight 1.000 ! spec=15Nn...5deg, no=380, id=5944, vol=4.471000e+02
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   54 and name   HA) 3.203 1.282 1.282 weight 1.000 ! spec=15Nn...5deg, no=380, id=5944, vol=4.471000e+02
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   54 and name   HN) 3.299 1.361 1.361 weight 1.000 ! spec=15Nn...5deg, no=381, id=5945, vol=1.208000e+03
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   54 and name   HN) 3.299 1.361 1.361 weight 1.000 ! spec=15Nn...5deg, no=381, id=5945, vol=1.208000e+03
assign (segid "   A" and resid   26 and name HG21) (segid "   A" and resid   27 and name   HN) 2.642 0.873 0.873 weight 1.000 ! spec=15Nn...5deg, no=384, id=5948, vol=9.833000e+02
    or (segid "   A" and resid   26 and name HG22) (segid "   A" and resid   27 and name   HN)
    or (segid "   A" and resid   26 and name HG23) (segid "   A" and resid   27 and name   HN)
assign (segid "   B" and resid   26 and name HG21) (segid "   B" and resid   27 and name   HN) 2.642 0.873 0.873 weight 1.000 ! spec=15Nn...5deg, no=384, id=5948, vol=9.833000e+02
    or (segid "   B" and resid   26 and name HG22) (segid "   B" and resid   27 and name   HN)
    or (segid "   B" and resid   26 and name HG23) (segid "   B" and resid   27 and name   HN)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   27 and name   HN) 4.266 2.274 2.274 weight 1.000 ! spec=15Nn...5deg, no=389, id=5953, vol=6.562000e+02
assign (segid "   B" and resid   25 and name   HA) (segid "   B" and resid   27 and name   HN) 4.266 2.274 2.274 weight 1.000 ! spec=15Nn...5deg, no=389, id=5953, vol=6.562000e+02
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   38 and name   HB) 3.278 1.343 1.343 weight 1.000 ! spec=15Nn...5deg, no=390, id=5954, vol=3.877000e+02
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   38 and name   HB) 3.278 1.343 1.343 weight 1.000 ! spec=15Nn...5deg, no=390, id=5954, vol=3.877000e+02
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name   HA) 2.638 0.870 0.870 weight 1.000 ! spec=15Nn...5deg, no=392, id=5956, vol=2.616000e+03
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   26 and name   HA) 2.638 0.870 0.870 weight 1.000 ! spec=15Nn...5deg, no=392, id=5956, vol=2.616000e+03
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name   HN) 2.571 0.826 0.826 weight 1.000 ! spec=15Nn...5deg, no=394, id=5958, vol=8.673000e+02
assign (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   27 and name   HN) 2.571 0.826 0.826 weight 1.000 ! spec=15Nn...5deg, no=394, id=5958, vol=8.673000e+02
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   37 and name   HA) 3.674 1.688 1.688 weight 1.000 ! spec=15Nn...5deg, no=395, id=5959, vol=6.582000e+02
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   37 and name   HA) 3.674 1.688 1.688 weight 1.000 ! spec=15Nn...5deg, no=395, id=5959, vol=6.582000e+02
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name   HN) 2.861 1.023 1.023 weight 1.000 ! spec=15Nn...5deg, no=397, id=5961, vol=4.805000e+02
assign (segid "   B" and resid   57 and name   HA) (segid "   B" and resid   57 and name   HN) 2.861 1.023 1.023 weight 1.000 ! spec=15Nn...5deg, no=397, id=5961, vol=4.805000e+02
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   57 and name   HN) 2.748 0.944 0.944 weight 1.000 ! spec=15Nn...5deg, no=400, id=5964, vol=4.214000e+02
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   57 and name   HN) 2.748 0.944 0.944 weight 1.000 ! spec=15Nn...5deg, no=400, id=5964, vol=4.214000e+02
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   57 and name   HN) 2.412 0.727 0.727 weight 1.000 ! spec=15Nn...5deg, no=401, id=5965, vol=8.995000e+02
assign (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   57 and name   HN) 2.412 0.727 0.727 weight 1.000 ! spec=15Nn...5deg, no=401, id=5965, vol=8.995000e+02
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   57 and name   HN) 2.219 0.615 0.615 weight 1.000 ! spec=15Nn...5deg, no=402, id=5966, vol=1.288000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   57 and name   HN)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   57 and name   HN)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   57 and name   HN) 2.219 0.615 0.615 weight 1.000 ! spec=15Nn...5deg, no=402, id=5966, vol=1.288000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   57 and name   HN)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   57 and name   HN)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   57 and name   HN) 4.050 2.050 2.050 weight 1.000 ! spec=15Nn...5deg, no=403, id=5967, vol=3.314000e+02
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   57 and name   HN) 4.050 2.050 2.050 weight 1.000 ! spec=15Nn...5deg, no=403, id=5967, vol=3.314000e+02
assign (segid "   A" and resid   57 and name  HD1) (segid "   A" and resid   57 and name   HN) 5.133 3.294 3.294 weight 1.000 ! spec=15Nn...5deg, no=404, id=5968, vol=2.675000e+02
assign (segid "   B" and resid   57 and name  HD1) (segid "   B" and resid   57 and name   HN) 5.133 3.294 3.294 weight 1.000 ! spec=15Nn...5deg, no=404, id=5968, vol=2.675000e+02
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name   HN) 3.757 1.765 1.765 weight 1.000 ! spec=15Nn...5deg, no=405, id=5969, vol=5.942000e+02
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   57 and name   HN) 3.757 1.765 1.765 weight 1.000 ! spec=15Nn...5deg, no=405, id=5969, vol=5.942000e+02
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   57 and name   HN) 3.953 1.953 1.953 weight 1.000 ! spec=15Nn...5deg, no=408, id=5972, vol=3.646000e+02
assign (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   57 and name   HN) 3.953 1.953 1.953 weight 1.000 ! spec=15Nn...5deg, no=408, id=5972, vol=3.646000e+02
assign (segid "   A" and resid   33 and name  HA1) (segid "   A" and resid   32 and name   HN) 4.705 2.767 2.767 weight 1.000 ! spec=15Nn...5deg, no=410, id=5973, vol=4.713000e+02
assign (segid "   B" and resid   33 and name  HA1) (segid "   B" and resid   32 and name   HN) 4.705 2.767 2.767 weight 1.000 ! spec=15Nn...5deg, no=410, id=5973, vol=4.713000e+02
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   32 and name   HN) 3.438 1.478 1.478 weight 1.000 ! spec=15Nn...5deg, no=411, id=5974, vol=8.070000e+02
assign (segid "   B" and resid   32 and name  HG2) (segid "   B" and resid   32 and name   HN) 3.438 1.478 1.478 weight 1.000 ! spec=15Nn...5deg, no=411, id=5974, vol=8.070000e+02
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   33 and name   HN) 2.026 0.513 0.513 weight 1.000 ! spec=15Nn...5deg, no=413, id=5975, vol=1.437000e+03
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   33 and name   HN) 2.026 0.513 0.513 weight 1.000 ! spec=15Nn...5deg, no=413, id=5975, vol=1.437000e+03
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name   HN) 2.780 0.966 0.966 weight 1.000 ! spec=15Nn...5deg, no=414, id=5976, vol=3.334000e+02
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   31 and name   HN) 2.780 0.966 0.966 weight 1.000 ! spec=15Nn...5deg, no=414, id=5976, vol=3.334000e+02
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name   HN) 2.783 0.968 0.968 weight 1.000 ! spec=15Nn...5deg, no=415, id=5977, vol=9.691000e+02
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   32 and name   HN) 2.783 0.968 0.968 weight 1.000 ! spec=15Nn...5deg, no=415, id=5977, vol=9.691000e+02
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   30 and name   HA) 4.276 2.286 2.286 weight 1.000 ! spec=15Nn...5deg, no=416, id=5978, vol=2.080000e+02
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   30 and name   HA) 4.276 2.286 2.286 weight 1.000 ! spec=15Nn...5deg, no=416, id=5978, vol=2.080000e+02
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   32 and name   HN) 2.027 0.514 0.514 weight 1.000 ! spec=15Nn...5deg, no=417, id=5979, vol=1.417000e+03
assign (segid "   B" and resid   32 and name  HB2) (segid "   B" and resid   32 and name   HN) 2.027 0.514 0.514 weight 1.000 ! spec=15Nn...5deg, no=417, id=5979, vol=1.417000e+03
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   32 and name   HN) 3.468 1.503 1.503 weight 1.000 ! spec=15Nn...5deg, no=418, id=5980, vol=8.070000e+02
assign (segid "   B" and resid   34 and name  HG2) (segid "   B" and resid   32 and name   HN) 3.468 1.503 1.503 weight 1.000 ! spec=15Nn...5deg, no=418, id=5980, vol=8.070000e+02
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   33 and name  HA2) 4.622 2.670 2.670 weight 1.000 ! spec=15Nn...5deg, no=420, id=5981, vol=3.480000e+02
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   33 and name  HA2) 4.622 2.670 2.670 weight 1.000 ! spec=15Nn...5deg, no=420, id=5981, vol=3.480000e+02
assign (segid "   A" and resid   32 and name  HD2) (segid "   A" and resid   32 and name   HN) 3.407 1.451 1.451 weight 1.000 ! spec=15Nn...5deg, no=421, id=5982, vol=6.331000e+02
assign (segid "   B" and resid   32 and name  HD2) (segid "   B" and resid   32 and name   HN) 3.407 1.451 1.451 weight 1.000 ! spec=15Nn...5deg, no=421, id=5982, vol=6.331000e+02
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD12) 4.288 2.299 2.299 weight 1.000 ! spec=15Nn...5deg, no=422, id=5983, vol=2.348000e+02
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD11)
    or (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name HD13)
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   31 and name HD12) 4.288 2.299 2.299 weight 1.000 ! spec=15Nn...5deg, no=422, id=5983, vol=2.348000e+02
    or (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   31 and name HD11)
    or (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   31 and name HD13)
assign (segid "   A" and resid   32 and name  HG1) (segid "   A" and resid   32 and name   HN) 2.111 0.557 0.557 weight 1.000 ! spec=15Nn...5deg, no=423, id=5984, vol=1.076000e+03
assign (segid "   B" and resid   32 and name  HG1) (segid "   B" and resid   32 and name   HN) 2.111 0.557 0.557 weight 1.000 ! spec=15Nn...5deg, no=423, id=5984, vol=1.076000e+03
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   32 and name   HN) 5.353 3.582 3.582 weight 1.000 ! spec=15Nn...5deg, no=424, id=5985, vol=4.058000e+02
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   32 and name   HN) 5.353 3.582 3.582 weight 1.000 ! spec=15Nn...5deg, no=424, id=5985, vol=4.058000e+02
assign (segid "   A" and resid   31 and name HG22) (segid "   A" and resid   32 and name   HN) 2.615 0.855 0.855 weight 1.000 ! spec=15Nn...5deg, no=425, id=5986, vol=7.316000e+02
    or (segid "   A" and resid   31 and name HG21) (segid "   A" and resid   32 and name   HN)
    or (segid "   A" and resid   31 and name HG23) (segid "   A" and resid   32 and name   HN)
assign (segid "   B" and resid   31 and name HG22) (segid "   B" and resid   32 and name   HN) 2.615 0.855 0.855 weight 1.000 ! spec=15Nn...5deg, no=425, id=5986, vol=7.316000e+02
    or (segid "   B" and resid   31 and name HG21) (segid "   B" and resid   32 and name   HN)
    or (segid "   B" and resid   31 and name HG23) (segid "   B" and resid   32 and name   HN)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   34 and name   HN) 3.323 1.380 1.380 weight 1.000 ! spec=15Nn...5deg, no=426, id=5987, vol=6.613000e+02
assign (segid "   B" and resid   32 and name   HN) (segid "   B" and resid   34 and name   HN) 3.323 1.380 1.380 weight 1.000 ! spec=15Nn...5deg, no=426, id=5987, vol=6.613000e+02
assign (segid "   A" and resid    3 and name   HB) (segid "   A" and resid    3 and name   HN) 4.004 2.004 2.004 weight 1.000 ! spec=15Nn...5deg, no=429, id=5988, vol=4.158000e+02
assign (segid "   B" and resid    3 and name   HB) (segid "   B" and resid    3 and name   HN) 4.004 2.004 2.004 weight 1.000 ! spec=15Nn...5deg, no=429, id=5988, vol=4.158000e+02
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name   HN) 2.548 0.812 0.812 weight 1.000 ! spec=15Nn...5deg, no=431, id=5990, vol=1.402000e+03
assign (segid "   B" and resid   74 and name  HB2) (segid "   B" and resid   74 and name   HN) 2.548 0.812 0.812 weight 1.000 ! spec=15Nn...5deg, no=431, id=5990, vol=1.402000e+03
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   75 and name  HB1) 4.358 2.374 2.374 weight 1.000 ! spec=15Nn...5deg, no=436, id=5995, vol=4.143000e+02
assign (segid "   B" and resid   74 and name   HN) (segid "   B" and resid   75 and name  HB1) 4.358 2.374 2.374 weight 1.000 ! spec=15Nn...5deg, no=436, id=5995, vol=4.143000e+02
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name   HN) 2.419 0.732 0.732 weight 1.000 ! spec=15Nn...5deg, no=438, id=5997, vol=1.105000e+03
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   74 and name   HN) 2.419 0.732 0.732 weight 1.000 ! spec=15Nn...5deg, no=438, id=5997, vol=1.105000e+03
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   75 and name   HN) 2.442 0.745 0.745 weight 1.000 ! spec=15Nn...5deg, no=442, id=6001, vol=9.733000e+02
assign (segid "   B" and resid   74 and name   HN) (segid "   B" and resid   75 and name   HN) 2.442 0.745 0.745 weight 1.000 ! spec=15Nn...5deg, no=442, id=6001, vol=9.733000e+02
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   20 and name   HN) 3.995 1.995 1.995 weight 1.000 ! spec=15Nn...5deg, no=443, id=6002, vol=2.910000e+02
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   20 and name   HN)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   20 and name   HN)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   20 and name   HN) 3.995 1.995 1.995 weight 1.000 ! spec=15Nn...5deg, no=443, id=6002, vol=2.910000e+02
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   20 and name   HN)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   20 and name   HN)
assign (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   20 and name   HN) 2.263 0.640 0.640 weight 1.000 ! spec=15Nn...5deg, no=449, id=6007, vol=1.621000e+03
    or (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   20 and name   HN)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   20 and name   HN)
assign (segid "   B" and resid   20 and name HG22) (segid "   B" and resid   20 and name   HN) 2.263 0.640 0.640 weight 1.000 ! spec=15Nn...5deg, no=449, id=6007, vol=1.621000e+03
    or (segid "   B" and resid   20 and name HG21) (segid "   B" and resid   20 and name   HN)
    or (segid "   B" and resid   20 and name HG23) (segid "   B" and resid   20 and name   HN)
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   20 and name   HN) 4.519 2.552 2.552 weight 1.000 ! spec=15Nn...5deg, no=452, id=6010, vol=2.067000e+02
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   20 and name   HN) 4.519 2.552 2.552 weight 1.000 ! spec=15Nn...5deg, no=452, id=6010, vol=2.067000e+02
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name   HN) 2.741 0.939 0.939 weight 1.000 ! spec=15Nn...5deg, no=453, id=6011, vol=4.457000e+02
assign (segid "   B" and resid   20 and name   HB) (segid "   B" and resid   20 and name   HN) 2.741 0.939 0.939 weight 1.000 ! spec=15Nn...5deg, no=453, id=6011, vol=4.457000e+02
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   20 and name   HN) 2.438 0.743 0.743 weight 1.000 ! spec=15Nn...5deg, no=454, id=6012, vol=1.054000e+03
assign (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   20 and name   HN) 2.438 0.743 0.743 weight 1.000 ! spec=15Nn...5deg, no=454, id=6012, vol=1.054000e+03
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   20 and name   HN) 4.877 2.974 2.974 weight 1.000 ! spec=15Nn...5deg, no=456, id=6014, vol=2.312000e+02
assign (segid "   B" and resid   55 and name  HB2) (segid "   B" and resid   20 and name   HN) 4.877 2.974 2.974 weight 1.000 ! spec=15Nn...5deg, no=456, id=6014, vol=2.312000e+02
assign (segid "   A" and resid  100 and name  HG1) (segid "   A" and resid  100 and name   HN) 3.734 1.743 1.743 weight 1.000 ! spec=15Nn...5deg, no=463, id=6021, vol=7.618000e+02
assign (segid "   B" and resid  100 and name  HG1) (segid "   B" and resid  100 and name   HN) 3.734 1.743 1.743 weight 1.000 ! spec=15Nn...5deg, no=463, id=6021, vol=7.618000e+02
assign (segid "   A" and resid  100 and name  HG2) (segid "   A" and resid  100 and name   HN) 2.360 0.696 0.696 weight 1.000 ! spec=15Nn...5deg, no=464, id=6022, vol=1.132000e+03
assign (segid "   B" and resid  100 and name  HG2) (segid "   B" and resid  100 and name   HN) 2.360 0.696 0.696 weight 1.000 ! spec=15Nn...5deg, no=464, id=6022, vol=1.132000e+03
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name   HN) 3.099 1.201 1.201 weight 1.000 ! spec=15Nn...5deg, no=473, id=6027, vol=4.492000e+02
assign (segid "   B" and resid   78 and name   HA) (segid "   B" and resid   78 and name   HN) 3.099 1.201 1.201 weight 1.000 ! spec=15Nn...5deg, no=473, id=6027, vol=4.492000e+02
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name  HB1) 3.237 1.310 1.310 weight 1.000 ! spec=15Nn...5deg, no=474, id=6028, vol=3.625000e+02
assign (segid "   B" and resid   84 and name   HN) (segid "   B" and resid   84 and name  HB1) 3.237 1.310 1.310 weight 1.000 ! spec=15Nn...5deg, no=474, id=6028, vol=3.625000e+02
assign (segid "   A" and resid   83 and name HG21) (segid "   A" and resid   84 and name   HN) 2.436 0.741 0.741 weight 1.000 ! spec=15Nn...5deg, no=475, id=6029, vol=1.091000e+03
    or (segid "   A" and resid   83 and name HG22) (segid "   A" and resid   84 and name   HN)
    or (segid "   A" and resid   83 and name HG23) (segid "   A" and resid   84 and name   HN)
assign (segid "   B" and resid   83 and name HG21) (segid "   B" and resid   84 and name   HN) 2.436 0.741 0.741 weight 1.000 ! spec=15Nn...5deg, no=475, id=6029, vol=1.091000e+03
    or (segid "   B" and resid   83 and name HG22) (segid "   B" and resid   84 and name   HN)
    or (segid "   B" and resid   83 and name HG23) (segid "   B" and resid   84 and name   HN)
assign (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   84 and name   HN) 3.947 1.948 1.948 weight 1.000 ! spec=15Nn...5deg, no=476, id=6030, vol=4.068000e+02
assign (segid "   B" and resid   84 and name  HB2) (segid "   B" and resid   84 and name   HN) 3.947 1.948 1.948 weight 1.000 ! spec=15Nn...5deg, no=476, id=6030, vol=4.068000e+02
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name   HN) 3.174 1.259 1.259 weight 1.000 ! spec=15Nn...5deg, no=478, id=6032, vol=3.344000e+02
assign (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   84 and name   HN) 3.174 1.259 1.259 weight 1.000 ! spec=15Nn...5deg, no=478, id=6032, vol=3.344000e+02
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name   HN) 4.384 2.402 2.402 weight 1.000 ! spec=15Nn...5deg, no=480, id=6034, vol=2.561000e+02
assign (segid "   B" and resid   84 and name   HN) (segid "   B" and resid   85 and name   HN) 4.384 2.402 2.402 weight 1.000 ! spec=15Nn...5deg, no=480, id=6034, vol=2.561000e+02
assign (segid "   A" and resid   10 and name  HA2) (segid "   A" and resid   10 and name   HN) 3.727 1.736 1.736 weight 1.000 ! spec=15Nn...5deg, no=481, id=6035, vol=2.359000e+02
assign (segid "   B" and resid   10 and name  HA2) (segid "   B" and resid   10 and name   HN) 3.727 1.736 1.736 weight 1.000 ! spec=15Nn...5deg, no=481, id=6035, vol=2.359000e+02
assign (segid "   A" and resid   14 and name HG22) (segid "   A" and resid  110 and name   HN) 3.624 1.642 1.642 weight 1.000 ! spec=15Nn...5deg, no=482, id=6036, vol=3.806000e+02
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid  110 and name   HN)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid  110 and name   HN)
assign (segid "   B" and resid   14 and name HG22) (segid "   B" and resid  110 and name   HN) 3.624 1.642 1.642 weight 1.000 ! spec=15Nn...5deg, no=482, id=6036, vol=3.806000e+02
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid  110 and name   HN)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid  110 and name   HN)
assign (segid "   A" and resid   14 and name HG12) (segid "   A" and resid  110 and name   HN) 3.333 3.333 2.667 weight 1.000 ! spec=15Nn...5deg, no=483, id=6037, vol=7.547000e+02
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid  110 and name   HN)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid  110 and name   HN)
assign (segid "   B" and resid   14 and name HG12) (segid "   B" and resid  110 and name   HN) 3.333 3.333 2.667 weight 1.000 ! spec=15Nn...5deg, no=483, id=6037, vol=7.547000e+02
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid  110 and name   HN)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid  110 and name   HN)
assign (segid "   A" and resid  110 and name  HB1) (segid "   A" and resid  110 and name   HN) 3.205 1.284 1.284 weight 1.000 ! spec=15Nn...5deg, no=484, id=6038, vol=3.163000e+02
assign (segid "   B" and resid  110 and name  HB1) (segid "   B" and resid  110 and name   HN) 3.205 1.284 1.284 weight 1.000 ! spec=15Nn...5deg, no=484, id=6038, vol=3.163000e+02
assign (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  110 and name   HN) 3.762 1.769 1.769 weight 1.000 ! spec=15Nn...5deg, no=485, id=6039, vol=7.407000e+02
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  110 and name   HN)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  110 and name   HN)
assign (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  110 and name   HN) 3.762 1.769 1.769 weight 1.000 ! spec=15Nn...5deg, no=485, id=6039, vol=7.407000e+02
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  110 and name   HN)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  110 and name   HN)
assign (segid "   A" and resid  110 and name   HA) (segid "   A" and resid  110 and name   HN) 3.503 1.534 1.534 weight 1.000 ! spec=15Nn...5deg, no=486, id=6040, vol=2.629000e+02
assign (segid "   B" and resid  110 and name   HA) (segid "   B" and resid  110 and name   HN) 3.503 1.534 1.534 weight 1.000 ! spec=15Nn...5deg, no=486, id=6040, vol=2.629000e+02
assign (segid "   A" and resid  109 and name   HB) (segid "   A" and resid  110 and name   HN) 3.054 1.166 1.166 weight 1.000 ! spec=15Nn...5deg, no=488, id=6042, vol=5.743000e+02
assign (segid "   B" and resid  109 and name   HB) (segid "   B" and resid  110 and name   HN) 3.054 1.166 1.166 weight 1.000 ! spec=15Nn...5deg, no=488, id=6042, vol=5.743000e+02
assign (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  110 and name   HN) 2.739 0.938 0.938 weight 1.000 ! spec=15Nn...5deg, no=489, id=6043, vol=8.090000e+02
assign (segid "   B" and resid  109 and name   HA) (segid "   B" and resid  110 and name   HN) 2.739 0.938 0.938 weight 1.000 ! spec=15Nn...5deg, no=489, id=6043, vol=8.090000e+02
assign (segid "   A" and resid  115 and name   HN) (segid "   A" and resid  113 and name   HN) 4.185 2.190 2.190 weight 1.000 ! spec=15Nn...5deg, no=490, id=6044, vol=3.133000e+02
assign (segid "   B" and resid  115 and name   HN) (segid "   B" and resid  113 and name   HN) 4.185 2.190 2.190 weight 1.000 ! spec=15Nn...5deg, no=490, id=6044, vol=3.133000e+02
assign (segid "   A" and resid  115 and name   HN) (segid "   A" and resid  115 and name   HA) 2.382 0.709 0.709 weight 1.000 ! spec=15Nn...5deg, no=491, id=6045, vol=1.236000e+03
assign (segid "   B" and resid  115 and name   HN) (segid "   B" and resid  115 and name   HA) 2.382 0.709 0.709 weight 1.000 ! spec=15Nn...5deg, no=491, id=6045, vol=1.236000e+03
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid  112 and name  HB1) 4.231 2.238 2.238 weight 1.000 ! spec=15Nn...5deg, no=495, id=6048, vol=2.387000e+02
assign (segid "   B" and resid   77 and name   HN) (segid "   B" and resid  112 and name  HB1) 4.231 2.238 2.238 weight 1.000 ! spec=15Nn...5deg, no=495, id=6048, vol=2.387000e+02
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   77 and name   HN) 2.889 1.043 1.043 weight 1.000 ! spec=15Nn...5deg, no=502, id=6052, vol=4.663000e+02
assign (segid "   B" and resid   77 and name  HB1) (segid "   B" and resid   77 and name   HN) 2.889 1.043 1.043 weight 1.000 ! spec=15Nn...5deg, no=502, id=6052, vol=4.663000e+02
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name   HN) 2.963 1.098 1.098 weight 1.000 ! spec=15Nn...5deg, no=504, id=6054, vol=4.163000e+02
assign (segid "   B" and resid   77 and name   HA) (segid "   B" and resid   77 and name   HN) 2.963 1.098 1.098 weight 1.000 ! spec=15Nn...5deg, no=504, id=6054, vol=4.163000e+02
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name  HB1) 4.128 2.130 2.130 weight 1.000 ! spec=15Nn...5deg, no=505, id=6055, vol=3.530000e+02
assign (segid "   B" and resid   77 and name   HN) (segid "   B" and resid   76 and name  HB1) 4.128 2.130 2.130 weight 1.000 ! spec=15Nn...5deg, no=505, id=6055, vol=3.530000e+02
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name   HN) 2.800 0.980 0.980 weight 1.000 ! spec=15Nn...5deg, no=506, id=6056, vol=5.516000e+02
assign (segid "   B" and resid   77 and name  HB2) (segid "   B" and resid   77 and name   HN) 2.800 0.980 0.980 weight 1.000 ! spec=15Nn...5deg, no=506, id=6056, vol=5.516000e+02
assign (segid "   A" and resid  116 and name   HA) (segid "   A" and resid  116 and name   HN) 3.418 1.461 1.461 weight 1.000 ! spec=15Nn...5deg, no=508, id=6057, vol=2.860000e+02
assign (segid "   B" and resid  116 and name   HA) (segid "   B" and resid  116 and name   HN) 3.418 1.461 1.461 weight 1.000 ! spec=15Nn...5deg, no=508, id=6057, vol=2.860000e+02
assign (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   99 and name  HD1) 2.989 1.117 1.117 weight 1.000 ! spec=15Nn...5deg, no=512, id=6058, vol=9.307000e+02
assign (segid "   B" and resid   99 and name  HE1) (segid "   B" and resid   99 and name  HD1) 2.989 1.117 1.117 weight 1.000 ! spec=15Nn...5deg, no=512, id=6058, vol=9.307000e+02
assign (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   99 and name  HZ2) 2.936 1.077 1.077 weight 1.000 ! spec=15Nn...5deg, no=513, id=6059, vol=8.190000e+02
assign (segid "   B" and resid   99 and name  HE1) (segid "   B" and resid   99 and name  HZ2) 2.936 1.077 1.077 weight 1.000 ! spec=15Nn...5deg, no=513, id=6059, vol=8.190000e+02
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name   HB) 2.779 0.965 0.965 weight 1.000 ! spec=15Nn...5deg, no=517, id=6062, vol=8.663000e+02
assign (segid "   B" and resid   26 and name   HN) (segid "   B" and resid   26 and name   HB) 2.779 0.965 0.965 weight 1.000 ! spec=15Nn...5deg, no=517, id=6062, vol=8.663000e+02
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name   HN) 2.602 0.846 0.846 weight 1.000 ! spec=15Nn...5deg, no=519, id=6064, vol=1.471000e+03
assign (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   26 and name   HN) 2.602 0.846 0.846 weight 1.000 ! spec=15Nn...5deg, no=519, id=6064, vol=1.471000e+03
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   68 and name   HN) 4.159 2.162 2.162 weight 1.000 ! spec=15Nn...5deg, no=523, id=6067, vol=3.314000e+02
assign (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   68 and name   HN) 4.159 2.162 2.162 weight 1.000 ! spec=15Nn...5deg, no=523, id=6067, vol=3.314000e+02
assign (segid "   A" and resid   67 and name  HA2) (segid "   A" and resid   68 and name   HN) 2.510 0.787 0.787 weight 1.000 ! spec=15Nn...5deg, no=524, id=6068, vol=7.376000e+02
assign (segid "   B" and resid   67 and name  HA2) (segid "   B" and resid   68 and name   HN) 2.510 0.787 0.787 weight 1.000 ! spec=15Nn...5deg, no=524, id=6068, vol=7.376000e+02
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   68 and name   HN) 3.185 1.268 1.268 weight 1.000 ! spec=15Nn...5deg, no=527, id=6070, vol=3.716000e+02
assign (segid "   B" and resid   68 and name   HA) (segid "   B" and resid   68 and name   HN) 3.185 1.268 1.268 weight 1.000 ! spec=15Nn...5deg, no=527, id=6070, vol=3.716000e+02
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name  HB2) 3.031 1.148 1.148 weight 1.000 ! spec=15Nn...5deg, no=530, id=6073, vol=2.971000e+02
assign (segid "   B" and resid   68 and name   HN) (segid "   B" and resid   68 and name  HB2) 3.031 1.148 1.148 weight 1.000 ! spec=15Nn...5deg, no=530, id=6073, vol=2.971000e+02
assign (segid "   A" and resid   83 and name HG21) (segid "   A" and resid   83 and name   HN) 2.759 0.952 0.952 weight 1.000 ! spec=15Nn...5deg, no=535, id=6078, vol=1.073000e+03
    or (segid "   A" and resid   83 and name HG22) (segid "   A" and resid   83 and name   HN)
    or (segid "   A" and resid   83 and name HG23) (segid "   A" and resid   83 and name   HN)
assign (segid "   B" and resid   83 and name HG21) (segid "   B" and resid   83 and name   HN) 2.759 0.952 0.952 weight 1.000 ! spec=15Nn...5deg, no=535, id=6078, vol=1.073000e+03
    or (segid "   B" and resid   83 and name HG22) (segid "   B" and resid   83 and name   HN)
    or (segid "   B" and resid   83 and name HG23) (segid "   B" and resid   83 and name   HN)
assign (segid "   A" and resid   82 and name HG21) (segid "   A" and resid   83 and name   HN) 3.370 1.420 1.420 weight 1.000 ! spec=15Nn...5deg, no=537, id=6080, vol=6.241000e+02
    or (segid "   A" and resid   82 and name HG22) (segid "   A" and resid   83 and name   HN)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid   83 and name   HN)
assign (segid "   B" and resid   82 and name HG21) (segid "   B" and resid   83 and name   HN) 3.370 1.420 1.420 weight 1.000 ! spec=15Nn...5deg, no=537, id=6080, vol=6.241000e+02
    or (segid "   B" and resid   82 and name HG22) (segid "   B" and resid   83 and name   HN)
    or (segid "   B" and resid   82 and name HG23) (segid "   B" and resid   83 and name   HN)
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name   HA) 3.221 1.296 1.296 weight 1.000 ! spec=15Nn...5deg, no=540, id=6082, vol=3.525000e+02
assign (segid "   B" and resid   83 and name   HN) (segid "   B" and resid   83 and name   HA) 3.221 1.296 1.296 weight 1.000 ! spec=15Nn...5deg, no=540, id=6082, vol=3.525000e+02
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   83 and name   HN) 2.569 0.825 0.825 weight 1.000 ! spec=15Nn...5deg, no=541, id=6083, vol=7.598000e+02
assign (segid "   B" and resid   82 and name   HA) (segid "   B" and resid   83 and name   HN) 2.569 0.825 0.825 weight 1.000 ! spec=15Nn...5deg, no=541, id=6083, vol=7.598000e+02
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   79 and name   HN) 3.820 1.824 1.824 weight 1.000 ! spec=15Nn...5deg, no=545, id=6086, vol=2.586000e+02
assign (segid "   B" and resid   79 and name  HB2) (segid "   B" and resid   79 and name   HN) 3.820 1.824 1.824 weight 1.000 ! spec=15Nn...5deg, no=545, id=6086, vol=2.586000e+02
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   67 and name  HA2) 4.909 3.012 3.012 weight 1.000 ! spec=15Nn...5deg, no=546, id=6087, vol=3.741000e+02
assign (segid "   B" and resid   79 and name   HN) (segid "   B" and resid   67 and name  HA2) 4.909 3.012 3.012 weight 1.000 ! spec=15Nn...5deg, no=546, id=6087, vol=3.741000e+02
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   77 and name   HA) 5.661 4.005 4.005 weight 1.000 ! spec=15Nn...5deg, no=549, id=6089, vol=2.259000e+02
assign (segid "   B" and resid   79 and name   HN) (segid "   B" and resid   77 and name   HA) 5.661 4.005 4.005 weight 1.000 ! spec=15Nn...5deg, no=549, id=6089, vol=2.259000e+02
assign (segid "   A" and resid  112 and name HD22) (segid "   A" and resid   79 and name   HN) 4.019 2.019 2.019 weight 1.000 ! spec=15Nn...5deg, no=550, id=6090, vol=4.528000e+02
    or (segid "   A" and resid  112 and name HD21) (segid "   A" and resid   79 and name   HN)
    or (segid "   A" and resid  112 and name HD23) (segid "   A" and resid   79 and name   HN)
assign (segid "   B" and resid  112 and name HD22) (segid "   B" and resid   79 and name   HN) 4.019 2.019 2.019 weight 1.000 ! spec=15Nn...5deg, no=550, id=6090, vol=4.528000e+02
    or (segid "   B" and resid  112 and name HD21) (segid "   B" and resid   79 and name   HN)
    or (segid "   B" and resid  112 and name HD23) (segid "   B" and resid   79 and name   HN)
assign (segid "   A" and resid  111 and name HG22) (segid "   A" and resid   79 and name   HN) 2.655 0.881 0.881 weight 1.000 ! spec=15Nn...5deg, no=551, id=6091, vol=4.033000e+02
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid   79 and name   HN)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid   79 and name   HN)
assign (segid "   B" and resid  111 and name HG22) (segid "   B" and resid   79 and name   HN) 2.655 0.881 0.881 weight 1.000 ! spec=15Nn...5deg, no=551, id=6091, vol=4.033000e+02
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid   79 and name   HN)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid   79 and name   HN)
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   79 and name   HN) 2.469 0.762 0.762 weight 1.000 ! spec=15Nn...5deg, no=552, id=6092, vol=1.086000e+03
assign (segid "   B" and resid   78 and name   HA) (segid "   B" and resid   79 and name   HN) 2.469 0.762 0.762 weight 1.000 ! spec=15Nn...5deg, no=552, id=6092, vol=1.086000e+03
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid  111 and name   HN) 2.907 1.056 1.056 weight 1.000 ! spec=15Nn...5deg, no=553, id=6093, vol=4.940000e+02
assign (segid "   B" and resid   79 and name   HN) (segid "   B" and resid  111 and name   HN) 2.907 1.056 1.056 weight 1.000 ! spec=15Nn...5deg, no=553, id=6093, vol=4.940000e+02
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   80 and name   HA) 3.783 1.789 1.789 weight 1.000 ! spec=15Nn...5deg, no=556, id=6095, vol=2.757000e+02
assign (segid "   B" and resid   79 and name   HN) (segid "   B" and resid   80 and name   HA) 3.783 1.789 1.789 weight 1.000 ! spec=15Nn...5deg, no=556, id=6095, vol=2.757000e+02
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name   HA) 2.474 0.765 0.765 weight 1.000 ! spec=15Nn...5deg, no=557, id=6096, vol=1.158000e+03
assign (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    7 and name   HA) 2.474 0.765 0.765 weight 1.000 ! spec=15Nn...5deg, no=557, id=6096, vol=1.158000e+03
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name   HN) 4.414 2.436 2.436 weight 1.000 ! spec=15Nn...5deg, no=565, id=6103, vol=6.462000e+02
assign (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   35 and name   HN) 4.414 2.436 2.436 weight 1.000 ! spec=15Nn...5deg, no=565, id=6103, vol=6.462000e+02
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   35 and name   HN) 3.829 1.833 1.833 weight 1.000 ! spec=15Nn...5deg, no=566, id=6104, vol=4.507000e+02
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   35 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   35 and name   HN)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   35 and name   HN) 3.829 1.833 1.833 weight 1.000 ! spec=15Nn...5deg, no=566, id=6104, vol=4.507000e+02
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   35 and name   HN)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   35 and name   HN)
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name   HN) 2.023 0.511 0.511 weight 1.000 ! spec=15Nn...5deg, no=569, id=6107, vol=3.875000e+03
assign (segid "   B" and resid   35 and name  HB2) (segid "   B" and resid   35 and name   HN) 2.023 0.511 0.511 weight 1.000 ! spec=15Nn...5deg, no=569, id=6107, vol=3.875000e+03
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   35 and name   HN) 2.078 0.540 0.540 weight 1.000 ! spec=15Nn...5deg, no=570, id=6108, vol=3.858000e+03
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   35 and name   HN) 2.078 0.540 0.540 weight 1.000 ! spec=15Nn...5deg, no=570, id=6108, vol=3.858000e+03
assign (segid "   A" and resid  118 and name  HG1) (segid "   A" and resid  118 and name   HN) 3.581 1.603 1.603 weight 1.000 ! spec=15Nn...5deg, no=573, id=6111, vol=3.545000e+02
assign (segid "   B" and resid  118 and name  HG1) (segid "   B" and resid  118 and name   HN) 3.581 1.603 1.603 weight 1.000 ! spec=15Nn...5deg, no=573, id=6111, vol=3.545000e+02
assign (segid "   A" and resid  117 and name   HA) (segid "   A" and resid  118 and name   HN) 2.434 0.741 0.741 weight 1.000 ! spec=15Nn...5deg, no=575, id=6113, vol=2.131000e+03
assign (segid "   B" and resid  117 and name   HA) (segid "   B" and resid  118 and name   HN) 2.434 0.741 0.741 weight 1.000 ! spec=15Nn...5deg, no=575, id=6113, vol=2.131000e+03
assign (segid "   A" and resid  108 and name   HA) (segid "   A" and resid  109 and name   HN) 2.340 0.684 0.684 weight 1.000 ! spec=15Nn...5deg, no=578, id=6116, vol=1.120000e+03
assign (segid "   B" and resid  108 and name   HA) (segid "   B" and resid  109 and name   HN) 2.340 0.684 0.684 weight 1.000 ! spec=15Nn...5deg, no=578, id=6116, vol=1.120000e+03
assign (segid "   A" and resid  109 and name   HN) (segid "   A" and resid   81 and name   HN) 2.765 0.955 0.955 weight 1.000 ! spec=15Nn...5deg, no=579, id=6117, vol=6.120000e+02
assign (segid "   B" and resid  109 and name   HN) (segid "   B" and resid   81 and name   HN) 2.765 0.955 0.955 weight 1.000 ! spec=15Nn...5deg, no=579, id=6117, vol=6.120000e+02
assign (segid "   A" and resid  109 and name   HB) (segid "   A" and resid  109 and name   HN) 3.379 1.427 1.427 weight 1.000 ! spec=15Nn...5deg, no=582, id=6119, vol=3.781000e+02
assign (segid "   B" and resid  109 and name   HB) (segid "   B" and resid  109 and name   HN) 3.379 1.427 1.427 weight 1.000 ! spec=15Nn...5deg, no=582, id=6119, vol=3.781000e+02
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid  109 and name   HN) 4.286 2.297 2.297 weight 1.000 ! spec=15Nn...5deg, no=583, id=6120, vol=3.193000e+02
assign (segid "   B" and resid   83 and name   HN) (segid "   B" and resid  109 and name   HN) 4.286 2.297 2.297 weight 1.000 ! spec=15Nn...5deg, no=583, id=6120, vol=3.193000e+02
assign (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid  109 and name   HN) 3.557 1.582 1.582 weight 1.000 ! spec=15Nn...5deg, no=584, id=6121, vol=3.253000e+02
assign (segid "   B" and resid   80 and name  HB2) (segid "   B" and resid  109 and name   HN) 3.557 1.582 1.582 weight 1.000 ! spec=15Nn...5deg, no=584, id=6121, vol=3.253000e+02
assign (segid "   A" and resid  109 and name   HN) (segid "   A" and resid  108 and name  HB1) 4.687 2.746 2.746 weight 1.000 ! spec=15Nn...5deg, no=586, id=6123, vol=2.497000e+02
assign (segid "   B" and resid  109 and name   HN) (segid "   B" and resid  108 and name  HB1) 4.687 2.746 2.746 weight 1.000 ! spec=15Nn...5deg, no=586, id=6123, vol=2.497000e+02
assign (segid "   A" and resid  109 and name HG22) (segid "   A" and resid  109 and name   HN) 2.274 0.647 0.647 weight 1.000 ! spec=15Nn...5deg, no=587, id=6124, vol=8.120000e+02
    or (segid "   A" and resid  109 and name HG21) (segid "   A" and resid  109 and name   HN)
    or (segid "   A" and resid  109 and name HG23) (segid "   A" and resid  109 and name   HN)
assign (segid "   B" and resid  109 and name HG22) (segid "   B" and resid  109 and name   HN) 2.274 0.647 0.647 weight 1.000 ! spec=15Nn...5deg, no=587, id=6124, vol=8.120000e+02
    or (segid "   B" and resid  109 and name HG21) (segid "   B" and resid  109 and name   HN)
    or (segid "   B" and resid  109 and name HG23) (segid "   B" and resid  109 and name   HN)
assign (segid "   A" and resid  109 and name   HN) (segid "   A" and resid   81 and name   HA) 4.372 2.389 2.389 weight 1.000 ! spec=15Nn...5deg, no=588, id=6125, vol=3.374000e+02
assign (segid "   B" and resid  109 and name   HN) (segid "   B" and resid   81 and name   HA) 4.372 2.389 2.389 weight 1.000 ! spec=15Nn...5deg, no=588, id=6125, vol=3.374000e+02
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid   87 and name   HN) 3.736 1.744 1.744 weight 1.000 ! spec=15Nn...5deg, no=600, id=6134, vol=4.249000e+02
assign (segid "   B" and resid  103 and name   HA) (segid "   B" and resid   87 and name   HN) 3.736 1.744 1.744 weight 1.000 ! spec=15Nn...5deg, no=600, id=6134, vol=4.249000e+02
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   87 and name   HN) 2.549 0.812 0.812 weight 1.000 ! spec=15Nn...5deg, no=601, id=6135, vol=6.693000e+02
assign (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   87 and name   HN) 2.549 0.812 0.812 weight 1.000 ! spec=15Nn...5deg, no=601, id=6135, vol=6.693000e+02
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name   HN) 3.239 1.312 1.312 weight 1.000 ! spec=15Nn...5deg, no=603, id=6137, vol=2.512000e+02
assign (segid "   B" and resid   87 and name   HA) (segid "   B" and resid   87 and name   HN) 3.239 1.312 1.312 weight 1.000 ! spec=15Nn...5deg, no=603, id=6137, vol=2.512000e+02
assign (segid "   A" and resid   87 and name   HB) (segid "   A" and resid   87 and name   HN) 3.203 1.283 1.283 weight 1.000 ! spec=15Nn...5deg, no=604, id=6138, vol=4.492000e+02
assign (segid "   B" and resid   87 and name   HB) (segid "   B" and resid   87 and name   HN) 3.203 1.283 1.283 weight 1.000 ! spec=15Nn...5deg, no=604, id=6138, vol=4.492000e+02
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid   87 and name   HN) 4.800 2.879 2.879 weight 1.000 ! spec=15Nn...5deg, no=605, id=6139, vol=3.756000e+02
assign (segid "   B" and resid  101 and name  HB2) (segid "   B" and resid   87 and name   HN) 4.800 2.879 2.879 weight 1.000 ! spec=15Nn...5deg, no=605, id=6139, vol=3.756000e+02
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   87 and name   HN) 3.487 1.520 1.520 weight 1.000 ! spec=15Nn...5deg, no=606, id=6140, vol=4.214000e+02
assign (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   87 and name   HN) 3.487 1.520 1.520 weight 1.000 ! spec=15Nn...5deg, no=606, id=6140, vol=4.214000e+02
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid  102 and name   HN) 2.785 0.969 0.969 weight 1.000 ! spec=15Nn...5deg, no=607, id=6141, vol=4.905000e+02
assign (segid "   B" and resid   87 and name   HN) (segid "   B" and resid  102 and name   HN) 2.785 0.969 0.969 weight 1.000 ! spec=15Nn...5deg, no=607, id=6141, vol=4.905000e+02
assign (segid "   A" and resid  112 and name   HN) (segid "   A" and resid  112 and name  HB1) 4.033 2.033 2.033 weight 1.000 ! spec=15Nn...5deg, no=609, id=6143, vol=3.223000e+02
assign (segid "   B" and resid  112 and name   HN) (segid "   B" and resid  112 and name  HB1) 4.033 2.033 2.033 weight 1.000 ! spec=15Nn...5deg, no=609, id=6143, vol=3.223000e+02
assign (segid "   A" and resid  111 and name   HA) (segid "   A" and resid  112 and name   HN) 2.836 1.006 1.006 weight 1.000 ! spec=15Nn...5deg, no=610, id=6144, vol=5.473000e+02
assign (segid "   B" and resid  111 and name   HA) (segid "   B" and resid  112 and name   HN) 2.836 1.006 1.006 weight 1.000 ! spec=15Nn...5deg, no=610, id=6144, vol=5.473000e+02
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid  112 and name   HN) 3.826 1.830 1.830 weight 1.000 ! spec=15Nn...5deg, no=611, id=6145, vol=4.083000e+02
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid  112 and name   HN)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid  112 and name   HN)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid  112 and name   HN) 3.826 1.830 1.830 weight 1.000 ! spec=15Nn...5deg, no=611, id=6145, vol=4.083000e+02
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid  112 and name   HN)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid  112 and name   HN)
assign (segid "   A" and resid  112 and name   HG) (segid "   A" and resid  112 and name   HN) 2.914 1.061 1.061 weight 1.000 ! spec=15Nn...5deg, no=614, id=6147, vol=4.535000e+02
assign (segid "   B" and resid  112 and name   HG) (segid "   B" and resid  112 and name   HN) 2.914 1.061 1.061 weight 1.000 ! spec=15Nn...5deg, no=614, id=6147, vol=4.535000e+02
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   28 and name   HN) 2.463 0.758 0.758 weight 1.000 ! spec=15Nn...5deg, no=620, id=6151, vol=7.467000e+02
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   28 and name   HN)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   28 and name   HN)
assign (segid "   B" and resid   38 and name HG22) (segid "   B" and resid   28 and name   HN) 2.463 0.758 0.758 weight 1.000 ! spec=15Nn...5deg, no=620, id=6151, vol=7.467000e+02
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid   28 and name   HN)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid   28 and name   HN)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   28 and name   HN) 3.314 3.314 2.686 weight 1.000 ! spec=15Nn...5deg, no=623, id=6153, vol=6.974000e+02
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   28 and name   HN)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   28 and name   HN)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   28 and name   HN) 3.314 3.314 2.686 weight 1.000 ! spec=15Nn...5deg, no=623, id=6153, vol=6.974000e+02
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   28 and name   HN)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   28 and name   HN)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   28 and name   HN) 2.795 0.977 0.977 weight 1.000 ! spec=15Nn...5deg, no=626, id=6155, vol=5.772000e+02
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   28 and name   HN) 2.795 0.977 0.977 weight 1.000 ! spec=15Nn...5deg, no=626, id=6155, vol=5.772000e+02
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   28 and name   HN) 2.151 0.578 0.578 weight 1.000 ! spec=15Nn...5deg, no=627, id=6156, vol=1.627000e+03
assign (segid "   B" and resid   27 and name   HA) (segid "   B" and resid   28 and name   HN) 2.151 0.578 0.578 weight 1.000 ! spec=15Nn...5deg, no=627, id=6156, vol=1.627000e+03
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   13 and name   HN) 3.341 1.395 1.395 weight 1.000 ! spec=15Nn...5deg, no=628, id=6157, vol=5.130000e+02
assign (segid "   B" and resid   12 and name  HB1) (segid "   B" and resid   13 and name   HN) 3.341 1.395 1.395 weight 1.000 ! spec=15Nn...5deg, no=628, id=6157, vol=5.130000e+02
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name   HA) 2.712 0.920 0.920 weight 1.000 ! spec=15Nn...5deg, no=629, id=6158, vol=1.215000e+03
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   13 and name   HA) 2.712 0.920 0.920 weight 1.000 ! spec=15Nn...5deg, no=629, id=6158, vol=1.215000e+03
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name  HB2) 4.021 2.021 2.021 weight 1.000 ! spec=15Nn...5deg, no=632, id=6161, vol=4.656000e+02
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   12 and name  HB2) 4.021 2.021 2.021 weight 1.000 ! spec=15Nn...5deg, no=632, id=6161, vol=4.656000e+02
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name   HN) 3.523 1.551 1.551 weight 1.000 ! spec=15Nn...5deg, no=635, id=6163, vol=2.373000e+02
assign (segid "   B" and resid   86 and name  HB2) (segid "   B" and resid   86 and name   HN) 3.523 1.551 1.551 weight 1.000 ! spec=15Nn...5deg, no=635, id=6163, vol=2.373000e+02
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   86 and name   HN) 3.117 1.215 1.215 weight 1.000 ! spec=15Nn...5deg, no=636, id=6164, vol=4.720000e+02
assign (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   86 and name   HN) 3.117 1.215 1.215 weight 1.000 ! spec=15Nn...5deg, no=636, id=6164, vol=4.720000e+02
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   86 and name   HN) 3.328 1.385 1.385 weight 1.000 ! spec=15Nn...5deg, no=637, id=6165, vol=2.978000e+02
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   86 and name   HN)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   86 and name   HN)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   86 and name   HN) 3.328 1.385 1.385 weight 1.000 ! spec=15Nn...5deg, no=637, id=6165, vol=2.978000e+02
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   86 and name   HN)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   86 and name   HN)
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   86 and name   HN) 2.728 0.930 0.930 weight 1.000 ! spec=15Nn...5deg, no=640, id=6167, vol=8.271000e+02
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   86 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   86 and name   HN)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid   86 and name   HN) 2.728 0.930 0.930 weight 1.000 ! spec=15Nn...5deg, no=640, id=6167, vol=8.271000e+02
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid   86 and name   HN)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid   86 and name   HN)
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name   HN) 4.004 2.004 2.004 weight 1.000 ! spec=15Nn...5deg, no=642, id=6169, vol=3.681000e+02
assign (segid "   B" and resid   86 and name  HB1) (segid "   B" and resid   86 and name   HN) 4.004 2.004 2.004 weight 1.000 ! spec=15Nn...5deg, no=642, id=6169, vol=3.681000e+02
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   86 and name   HN) 3.224 1.299 1.299 weight 1.000 ! spec=15Nn...5deg, no=643, id=6170, vol=4.947000e+02
assign (segid "   B" and resid   85 and name   HA) (segid "   B" and resid   86 and name   HN) 3.224 1.299 1.299 weight 1.000 ! spec=15Nn...5deg, no=643, id=6170, vol=4.947000e+02
assign (segid "   A" and resid   36 and name   HB) (segid "   A" and resid   36 and name   HN) 2.986 1.114 1.114 weight 1.000 ! spec=15Nn...5deg, no=644, id=6171, vol=6.713000e+02
assign (segid "   B" and resid   36 and name   HB) (segid "   B" and resid   36 and name   HN) 2.986 1.114 1.114 weight 1.000 ! spec=15Nn...5deg, no=644, id=6171, vol=6.713000e+02
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   36 and name   HN) 3.524 1.552 1.552 weight 1.000 ! spec=15Nn...5deg, no=646, id=6172, vol=7.065000e+02
assign (segid "   B" and resid   35 and name  HG1) (segid "   B" and resid   36 and name   HN) 3.524 1.552 1.552 weight 1.000 ! spec=15Nn...5deg, no=646, id=6172, vol=7.065000e+02
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   36 and name   HN) 3.344 1.397 1.397 weight 1.000 ! spec=15Nn...5deg, no=647, id=6173, vol=3.470000e+02
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   28 and name  HB3) (segid "   A" and resid   36 and name   HN)
assign (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   36 and name   HN) 3.344 1.397 1.397 weight 1.000 ! spec=15Nn...5deg, no=647, id=6173, vol=3.470000e+02
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   36 and name   HN)
    or (segid "   B" and resid   28 and name  HB3) (segid "   B" and resid   36 and name   HN)
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   36 and name   HN) 3.349 1.402 1.402 weight 1.000 ! spec=15Nn...5deg, no=648, id=6174, vol=5.473000e+02
assign (segid "   B" and resid   29 and name   HA) (segid "   B" and resid   36 and name   HN) 3.349 1.402 1.402 weight 1.000 ! spec=15Nn...5deg, no=648, id=6174, vol=5.473000e+02
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   36 and name   HN) 3.617 1.635 1.635 weight 1.000 ! spec=15Nn...5deg, no=649, id=6175, vol=5.459000e+02
assign (segid "   B" and resid   35 and name  HG2) (segid "   B" and resid   36 and name   HN) 3.617 1.635 1.635 weight 1.000 ! spec=15Nn...5deg, no=649, id=6175, vol=5.459000e+02
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   36 and name   HN) 2.461 0.757 0.757 weight 1.000 ! spec=15Nn...5deg, no=650, id=6176, vol=1.032000e+03
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   36 and name   HN)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   36 and name   HN) 2.461 0.757 0.757 weight 1.000 ! spec=15Nn...5deg, no=650, id=6176, vol=1.032000e+03
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   36 and name   HN)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   36 and name   HN)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name   HN) 2.331 0.679 0.679 weight 1.000 ! spec=15Nn...5deg, no=651, id=6177, vol=2.083000e+03
assign (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   36 and name   HN) 2.331 0.679 0.679 weight 1.000 ! spec=15Nn...5deg, no=651, id=6177, vol=2.083000e+03
assign (segid "   A" and resid   36 and name HG22) (segid "   A" and resid   36 and name   HN) 2.367 0.700 0.700 weight 1.000 ! spec=15Nn...5deg, no=656, id=6181, vol=6.532000e+02
    or (segid "   A" and resid   36 and name HG21) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   36 and name HG23) (segid "   A" and resid   36 and name   HN)
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   36 and name   HN) 2.367 0.700 0.700 weight 1.000 ! spec=15Nn...5deg, no=656, id=6181, vol=6.532000e+02
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   36 and name   HN)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   36 and name   HN)
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   36 and name   HN) 4.027 2.027 2.027 weight 1.000 ! spec=15Nn...5deg, no=657, id=6182, vol=9.094000e+02
assign (segid "   B" and resid   35 and name  HB2) (segid "   B" and resid   36 and name   HN) 4.027 2.027 2.027 weight 1.000 ! spec=15Nn...5deg, no=657, id=6182, vol=9.094000e+02
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   22 and name HG22) 3.469 1.505 1.505 weight 1.000 ! spec=15Nn...5deg, no=664, id=6187, vol=7.618000e+02
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   22 and name HG21)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   22 and name HG23)
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   22 and name HG22) 3.469 1.505 1.505 weight 1.000 ! spec=15Nn...5deg, no=664, id=6187, vol=7.618000e+02
    or (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   22 and name HG21)
    or (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   22 and name HG23)
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   25 and name   HN) 4.083 2.084 2.084 weight 1.000 ! spec=15Nn...5deg, no=668, id=6190, vol=4.663000e+02
assign (segid "   B" and resid   24 and name  HB2) (segid "   B" and resid   25 and name   HN) 4.083 2.084 2.084 weight 1.000 ! spec=15Nn...5deg, no=668, id=6190, vol=4.663000e+02
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   25 and name   HN) 2.237 0.625 0.625 weight 1.000 ! spec=15Nn...5deg, no=669, id=6191, vol=1.759000e+03
    or (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   25 and name   HN)
    or (segid "   A" and resid   22 and name HG13) (segid "   A" and resid   25 and name   HN)
assign (segid "   B" and resid   22 and name HG12) (segid "   B" and resid   25 and name   HN) 2.237 0.625 0.625 weight 1.000 ! spec=15Nn...5deg, no=669, id=6191, vol=1.759000e+03
    or (segid "   B" and resid   22 and name HG11) (segid "   B" and resid   25 and name   HN)
    or (segid "   B" and resid   22 and name HG13) (segid "   B" and resid   25 and name   HN)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name   HN) 2.839 1.008 1.008 weight 1.000 ! spec=15Nn...5deg, no=670, id=6192, vol=6.522000e+02
assign (segid "   B" and resid   25 and name   HA) (segid "   B" and resid   25 and name   HN) 2.839 1.008 1.008 weight 1.000 ! spec=15Nn...5deg, no=670, id=6192, vol=6.522000e+02
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HA) 2.810 0.987 0.987 weight 1.000 ! spec=15Nn...5deg, no=673, id=6194, vol=7.628000e+02
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   24 and name   HA) 2.810 0.987 0.987 weight 1.000 ! spec=15Nn...5deg, no=673, id=6194, vol=7.628000e+02
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   25 and name   HN) 2.424 0.735 0.735 weight 1.000 ! spec=15Nn...5deg, no=674, id=6195, vol=7.417000e+02
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   25 and name   HN) 2.424 0.735 0.735 weight 1.000 ! spec=15Nn...5deg, no=674, id=6195, vol=7.417000e+02
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name   HN) 2.240 0.627 0.627 weight 1.000 ! spec=15Nn...5deg, no=675, id=6196, vol=1.022000e+03
assign (segid "   B" and resid   25 and name  HB1) (segid "   B" and resid   25 and name   HN) 2.240 0.627 0.627 weight 1.000 ! spec=15Nn...5deg, no=675, id=6196, vol=1.022000e+03
assign (segid "   A" and resid   98 and name  HB2) (segid "   A" and resid   98 and name   HN) 2.239 0.627 0.627 weight 1.000 ! spec=15Nn...5deg, no=679, id=6198, vol=1.569000e+03
    or (segid "   A" and resid   98 and name  HB1) (segid "   A" and resid   98 and name   HN)
    or (segid "   A" and resid   98 and name  HB3) (segid "   A" and resid   98 and name   HN)
assign (segid "   B" and resid   98 and name  HB2) (segid "   B" and resid   98 and name   HN) 2.239 0.627 0.627 weight 1.000 ! spec=15Nn...5deg, no=679, id=6198, vol=1.569000e+03
    or (segid "   B" and resid   98 and name  HB1) (segid "   B" and resid   98 and name   HN)
    or (segid "   B" and resid   98 and name  HB3) (segid "   B" and resid   98 and name   HN)
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   98 and name   HN) 2.522 0.795 0.795 weight 1.000 ! spec=15Nn...5deg, no=680, id=6199, vol=1.437000e+03
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   98 and name   HN)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   98 and name   HN)
assign (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   98 and name   HN) 2.522 0.795 0.795 weight 1.000 ! spec=15Nn...5deg, no=680, id=6199, vol=1.437000e+03
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   98 and name   HN)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   98 and name   HN)
assign (segid "   A" and resid   98 and name   HA) (segid "   A" and resid   98 and name   HN) 2.671 0.892 0.892 weight 1.000 ! spec=15Nn...5deg, no=682, id=6200, vol=8.341000e+02
assign (segid "   B" and resid   98 and name   HA) (segid "   B" and resid   98 and name   HN) 2.671 0.892 0.892 weight 1.000 ! spec=15Nn...5deg, no=682, id=6200, vol=8.341000e+02
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   92 and name HG21) 4.474 2.502 2.502 weight 1.000 ! spec=15Nn...5deg, no=683, id=6201, vol=4.003000e+02
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   92 and name HG22)
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   92 and name HG23)
assign (segid "   B" and resid   98 and name   HN) (segid "   B" and resid   92 and name HG21) 4.474 2.502 2.502 weight 1.000 ! spec=15Nn...5deg, no=683, id=6201, vol=4.003000e+02
    or (segid "   B" and resid   98 and name   HN) (segid "   B" and resid   92 and name HG22)
    or (segid "   B" and resid   98 and name   HN) (segid "   B" and resid   92 and name HG23)
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   98 and name   HN) 2.859 1.022 1.022 weight 1.000 ! spec=15Nn...5deg, no=684, id=6202, vol=3.686000e+02
assign (segid "   B" and resid   97 and name   HA) (segid "   B" and resid   98 and name   HN) 2.859 1.022 1.022 weight 1.000 ! spec=15Nn...5deg, no=684, id=6202, vol=3.686000e+02
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   92 and name   HA) 3.711 1.721 1.721 weight 1.000 ! spec=15Nn...5deg, no=685, id=6203, vol=3.042000e+02
assign (segid "   B" and resid   98 and name   HN) (segid "   B" and resid   92 and name   HA) 3.711 1.721 1.721 weight 1.000 ! spec=15Nn...5deg, no=685, id=6203, vol=3.042000e+02
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   88 and name  HG1) 2.520 0.794 0.794 weight 1.000 ! spec=15Nn...5deg, no=686, id=6204, vol=6.512000e+02
assign (segid "   B" and resid   88 and name   HN) (segid "   B" and resid   88 and name  HG1) 2.520 0.794 0.794 weight 1.000 ! spec=15Nn...5deg, no=686, id=6204, vol=6.512000e+02
assign (segid "   A" and resid   88 and name  HG2) (segid "   A" and resid   88 and name   HN) 3.274 1.340 1.340 weight 1.000 ! spec=15Nn...5deg, no=689, id=6205, vol=4.713000e+02
assign (segid "   B" and resid   88 and name  HG2) (segid "   B" and resid   88 and name   HN) 3.274 1.340 1.340 weight 1.000 ! spec=15Nn...5deg, no=689, id=6205, vol=4.713000e+02
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   88 and name   HN) 2.684 0.900 0.900 weight 1.000 ! spec=15Nn...5deg, no=690, id=6206, vol=6.552000e+02
assign (segid "   B" and resid   87 and name   HA) (segid "   B" and resid   88 and name   HN) 2.684 0.900 0.900 weight 1.000 ! spec=15Nn...5deg, no=690, id=6206, vol=6.552000e+02
assign (segid "   A" and resid   87 and name   HB) (segid "   A" and resid   88 and name   HN) 3.194 1.275 1.275 weight 1.000 ! spec=15Nn...5deg, no=691, id=6207, vol=3.766000e+02
assign (segid "   B" and resid   87 and name   HB) (segid "   B" and resid   88 and name   HN) 3.194 1.275 1.275 weight 1.000 ! spec=15Nn...5deg, no=691, id=6207, vol=3.766000e+02
assign (segid "   A" and resid   88 and name  HB2) (segid "   A" and resid   88 and name   HN) 3.183 1.266 1.266 weight 1.000 ! spec=15Nn...5deg, no=692, id=6208, vol=7.015000e+02
assign (segid "   B" and resid   88 and name  HB2) (segid "   B" and resid   88 and name   HN) 3.183 1.266 1.266 weight 1.000 ! spec=15Nn...5deg, no=692, id=6208, vol=7.015000e+02
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid  109 and name HG22) 3.835 1.838 1.838 weight 1.000 ! spec=15Nn...5deg, no=698, id=6209, vol=4.983000e+02
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid  109 and name HG21)
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid  109 and name HG23)
assign (segid "   B" and resid   82 and name   HN) (segid "   B" and resid  109 and name HG22) 3.835 1.838 1.838 weight 1.000 ! spec=15Nn...5deg, no=698, id=6209, vol=4.983000e+02
    or (segid "   B" and resid   82 and name   HN) (segid "   B" and resid  109 and name HG21)
    or (segid "   B" and resid   82 and name   HN) (segid "   B" and resid  109 and name HG23)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name   HN) 3.052 1.164 1.164 weight 1.000 ! spec=15Nn...5deg, no=701, id=6212, vol=5.971000e+02
assign (segid "   B" and resid   82 and name   HB) (segid "   B" and resid   82 and name   HN) 3.052 1.164 1.164 weight 1.000 ! spec=15Nn...5deg, no=701, id=6212, vol=5.971000e+02
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name   HN) 3.260 1.328 1.328 weight 1.000 ! spec=15Nn...5deg, no=715, id=6221, vol=3.530000e+02
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   46 and name   HN) 3.260 1.328 1.328 weight 1.000 ! spec=15Nn...5deg, no=715, id=6221, vol=3.530000e+02
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name  HA1) 3.264 1.332 1.332 weight 1.000 ! spec=15Nn...5deg, no=720, id=6226, vol=3.711000e+02
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   23 and name  HA1) 3.264 1.332 1.332 weight 1.000 ! spec=15Nn...5deg, no=720, id=6226, vol=3.711000e+02
assign (segid "   A" and resid   23 and name  HA2) (segid "   A" and resid   24 and name   HN) 4.040 2.040 2.040 weight 1.000 ! spec=15Nn...5deg, no=721, id=6227, vol=2.437000e+02
assign (segid "   B" and resid   23 and name  HA2) (segid "   B" and resid   24 and name   HN) 4.040 2.040 2.040 weight 1.000 ! spec=15Nn...5deg, no=721, id=6227, vol=2.437000e+02
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name   HN) 3.071 1.179 1.179 weight 1.000 ! spec=15Nn...5deg, no=722, id=6228, vol=6.056000e+02
assign (segid "   B" and resid   24 and name  HB2) (segid "   B" and resid   24 and name   HN) 3.071 1.179 1.179 weight 1.000 ! spec=15Nn...5deg, no=722, id=6228, vol=6.056000e+02
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   53 and name   HN) 4.040 2.041 2.041 weight 1.000 ! spec=15Nn...5deg, no=723, id=6229, vol=3.133000e+02
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   53 and name   HN) 4.040 2.041 2.041 weight 1.000 ! spec=15Nn...5deg, no=723, id=6229, vol=3.133000e+02
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   24 and name   HN) 2.055 0.528 0.528 weight 1.000 ! spec=15Nn...5deg, no=724, id=6230, vol=1.394000e+03
    or (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   24 and name   HN)
    or (segid "   A" and resid   22 and name HG13) (segid "   A" and resid   24 and name   HN)
assign (segid "   B" and resid   22 and name HG12) (segid "   B" and resid   24 and name   HN) 2.055 0.528 0.528 weight 1.000 ! spec=15Nn...5deg, no=724, id=6230, vol=1.394000e+03
    or (segid "   B" and resid   22 and name HG11) (segid "   B" and resid   24 and name   HN)
    or (segid "   B" and resid   22 and name HG13) (segid "   B" and resid   24 and name   HN)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name   HA) 2.718 0.924 0.924 weight 1.000 ! spec=15Nn...5deg, no=725, id=6231, vol=1.016000e+03
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   24 and name   HA) 2.718 0.924 0.924 weight 1.000 ! spec=15Nn...5deg, no=725, id=6231, vol=1.016000e+03
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name   HN) 3.741 1.750 1.750 weight 1.000 ! spec=15Nn...5deg, no=728, id=6234, vol=4.912000e+02
assign (segid "   B" and resid   24 and name  HB1) (segid "   B" and resid   24 and name   HN) 3.741 1.750 1.750 weight 1.000 ! spec=15Nn...5deg, no=728, id=6234, vol=4.912000e+02
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   44 and name   HB) 3.564 3.564 2.436 weight 1.000 ! spec=15Nn...5deg, no=731, id=6237, vol=6.600000e+02
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   44 and name   HB) 3.564 3.564 2.436 weight 1.000 ! spec=15Nn...5deg, no=731, id=6237, vol=6.600000e+02
assign (segid "   A" and resid    4 and name   HA) (segid "   A" and resid    4 and name   HN) 3.008 1.131 1.131 weight 1.000 ! spec=15Nn...5deg, no=736, id=6239, vol=6.006000e+02
assign (segid "   B" and resid    4 and name   HA) (segid "   B" and resid    4 and name   HN) 3.008 1.131 1.131 weight 1.000 ! spec=15Nn...5deg, no=736, id=6239, vol=6.006000e+02
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   97 and name   HN) 2.847 1.013 1.013 weight 1.000 ! spec=15Nn...5deg, no=737, id=6240, vol=2.640000e+02
    or (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   97 and name   HN)
    or (segid "   A" and resid   97 and name  HB3) (segid "   A" and resid   97 and name   HN)
assign (segid "   B" and resid   97 and name  HB2) (segid "   B" and resid   97 and name   HN) 2.847 1.013 1.013 weight 1.000 ! spec=15Nn...5deg, no=737, id=6240, vol=2.640000e+02
    or (segid "   B" and resid   97 and name  HB1) (segid "   B" and resid   97 and name   HN)
    or (segid "   B" and resid   97 and name  HB3) (segid "   B" and resid   97 and name   HN)
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   97 and name   HA) 3.080 1.186 1.186 weight 1.000 ! spec=15Nn...5deg, no=738, id=6241, vol=2.896000e+02
assign (segid "   B" and resid   97 and name   HN) (segid "   B" and resid   97 and name   HA) 3.080 1.186 1.186 weight 1.000 ! spec=15Nn...5deg, no=738, id=6241, vol=2.896000e+02
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name   HA) 2.787 0.971 0.971 weight 1.000 ! spec=15Nn...5deg, no=740, id=6242, vol=1.030000e+03
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   15 and name   HA) 2.787 0.971 0.971 weight 1.000 ! spec=15Nn...5deg, no=740, id=6242, vol=1.030000e+03
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HN) 2.649 0.877 0.877 weight 1.000 ! spec=15Nn...5deg, no=741, id=6243, vol=9.307000e+02
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   14 and name   HN) 2.649 0.877 0.877 weight 1.000 ! spec=15Nn...5deg, no=741, id=6243, vol=9.307000e+02
assign (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   15 and name   HN) 2.492 0.777 0.777 weight 1.000 ! spec=15Nn...5deg, no=742, id=6244, vol=6.412000e+02
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   15 and name   HN)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   15 and name   HN)
assign (segid "   B" and resid   14 and name HG22) (segid "   B" and resid   15 and name   HN) 2.492 0.777 0.777 weight 1.000 ! spec=15Nn...5deg, no=742, id=6244, vol=6.412000e+02
    or (segid "   B" and resid   14 and name HG21) (segid "   B" and resid   15 and name   HN)
    or (segid "   B" and resid   14 and name HG23) (segid "   B" and resid   15 and name   HN)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HA) 3.538 1.564 1.564 weight 1.000 ! spec=15Nn...5deg, no=743, id=6245, vol=3.178000e+02
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   14 and name   HA) 3.538 1.564 1.564 weight 1.000 ! spec=15Nn...5deg, no=743, id=6245, vol=3.178000e+02
assign (segid "   A" and resid   14 and name HG12) (segid "   A" and resid   15 and name   HN) 3.103 1.203 1.203 weight 1.000 ! spec=15Nn...5deg, no=744, id=6246, vol=9.733000e+02
    or (segid "   A" and resid   14 and name HG11) (segid "   A" and resid   15 and name   HN)
    or (segid "   A" and resid   14 and name HG13) (segid "   A" and resid   15 and name   HN)
assign (segid "   B" and resid   14 and name HG12) (segid "   B" and resid   15 and name   HN) 3.103 1.203 1.203 weight 1.000 ! spec=15Nn...5deg, no=744, id=6246, vol=9.733000e+02
    or (segid "   B" and resid   14 and name HG11) (segid "   B" and resid   15 and name   HN)
    or (segid "   B" and resid   14 and name HG13) (segid "   B" and resid   15 and name   HN)
assign (segid "   A" and resid  110 and name  HB1) (segid "   A" and resid   15 and name   HN) 4.008 2.008 2.008 weight 1.000 ! spec=15Nn...5deg, no=745, id=6247, vol=4.471000e+02
assign (segid "   B" and resid  110 and name  HB1) (segid "   B" and resid   15 and name   HN) 4.008 2.008 2.008 weight 1.000 ! spec=15Nn...5deg, no=745, id=6247, vol=4.471000e+02
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   68 and name  HB1) 3.405 3.405 2.595 weight 1.000 ! spec=15Nn...5deg, no=746, id=6248, vol=7.155000e+02
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   68 and name  HB1) 3.405 3.405 2.595 weight 1.000 ! spec=15Nn...5deg, no=746, id=6248, vol=7.155000e+02
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name   HN) 3.099 1.200 1.200 weight 1.000 ! spec=15Nn...5deg, no=747, id=6249, vol=6.532000e+02
assign (segid "   B" and resid   15 and name  HB2) (segid "   B" and resid   15 and name   HN) 3.099 1.200 1.200 weight 1.000 ! spec=15Nn...5deg, no=747, id=6249, vol=6.532000e+02
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   15 and name   HN) 2.940 1.080 1.080 weight 1.000 ! spec=15Nn...5deg, no=749, id=6251, vol=7.537000e+02
assign (segid "   B" and resid   15 and name  HB1) (segid "   B" and resid   15 and name   HN) 2.940 1.080 1.080 weight 1.000 ! spec=15Nn...5deg, no=749, id=6251, vol=7.537000e+02
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   15 and name   HN) 3.434 1.474 1.474 weight 1.000 ! spec=15Nn...5deg, no=750, id=6252, vol=5.360000e+02
assign (segid "   B" and resid   13 and name  HB1) (segid "   B" and resid   15 and name   HN) 3.434 1.474 1.474 weight 1.000 ! spec=15Nn...5deg, no=750, id=6252, vol=5.360000e+02
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   58 and name   HN) 2.339 0.684 0.684 weight 1.000 ! spec=15Nn...5deg, no=752, id=6254, vol=8.371000e+02
assign (segid "   B" and resid   57 and name  HB1) (segid "   B" and resid   58 and name   HN) 2.339 0.684 0.684 weight 1.000 ! spec=15Nn...5deg, no=752, id=6254, vol=8.371000e+02
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   58 and name   HN) 2.111 0.557 0.557 weight 1.000 ! spec=15Nn...5deg, no=753, id=6255, vol=1.744000e+03
assign (segid "   B" and resid   57 and name   HA) (segid "   B" and resid   58 and name   HN) 2.111 0.557 0.557 weight 1.000 ! spec=15Nn...5deg, no=753, id=6255, vol=1.744000e+03
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   58 and name   HN) 3.316 1.374 1.374 weight 1.000 ! spec=15Nn...5deg, no=755, id=6256, vol=8.341000e+02
assign (segid "   B" and resid   57 and name  HB2) (segid "   B" and resid   58 and name   HN) 3.316 1.374 1.374 weight 1.000 ! spec=15Nn...5deg, no=755, id=6256, vol=8.341000e+02
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   58 and name   HN) 4.272 2.281 2.281 weight 1.000 ! spec=15Nn...5deg, no=756, id=6257, vol=2.939000e+02
assign (segid "   B" and resid   57 and name   HN) (segid "   B" and resid   58 and name   HN) 4.272 2.281 2.281 weight 1.000 ! spec=15Nn...5deg, no=756, id=6257, vol=2.939000e+02
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   58 and name   HN) 2.942 1.082 1.082 weight 1.000 ! spec=15Nn...5deg, no=757, id=6258, vol=1.148000e+03
assign (segid "   B" and resid   57 and name  HG2) (segid "   B" and resid   58 and name   HN) 2.942 1.082 1.082 weight 1.000 ! spec=15Nn...5deg, no=757, id=6258, vol=1.148000e+03
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   58 and name   HA) 2.375 0.705 0.705 weight 1.000 ! spec=15Nn...5deg, no=758, id=6259, vol=1.744000e+03
assign (segid "   B" and resid   58 and name   HN) (segid "   B" and resid   58 and name   HA) 2.375 0.705 0.705 weight 1.000 ! spec=15Nn...5deg, no=758, id=6259, vol=1.744000e+03
assign (segid "   A" and resid  108 and name  HB1) (segid "   A" and resid   58 and name   HN) 2.969 1.102 1.102 weight 1.000 ! spec=15Nn...5deg, no=759, id=6260, vol=7.105000e+02
assign (segid "   B" and resid  108 and name  HB1) (segid "   B" and resid   58 and name   HN) 2.969 1.102 1.102 weight 1.000 ! spec=15Nn...5deg, no=759, id=6260, vol=7.105000e+02
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   58 and name   HN) 2.920 1.066 1.066 weight 1.000 ! spec=15Nn...5deg, no=761, id=6261, vol=3.852000e+02
assign (segid "   B" and resid   58 and name  HB2) (segid "   B" and resid   58 and name   HN) 2.920 1.066 1.066 weight 1.000 ! spec=15Nn...5deg, no=761, id=6261, vol=3.852000e+02
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   96 and name   HA) 2.808 0.986 0.986 weight 1.000 ! spec=15Nn...5deg, no=764, id=6263, vol=6.874000e+02
assign (segid "   B" and resid   96 and name   HN) (segid "   B" and resid   96 and name   HA) 2.808 0.986 0.986 weight 1.000 ! spec=15Nn...5deg, no=764, id=6263, vol=6.874000e+02
assign (segid "   A" and resid   96 and name  HG2) (segid "   A" and resid   96 and name   HN) 3.861 1.863 1.863 weight 1.000 ! spec=15Nn...5deg, no=766, id=6265, vol=1.060000e+03
assign (segid "   B" and resid   96 and name  HG2) (segid "   B" and resid   96 and name   HN) 3.861 1.863 1.863 weight 1.000 ! spec=15Nn...5deg, no=766, id=6265, vol=1.060000e+03
assign (segid "   A" and resid   51 and name HE22) (segid "   A" and resid   51 and name HE21) 2.349 0.690 0.690 weight 1.000 ! spec=15Nn...5deg, no=770, id=6268, vol=3.364000e+02
assign (segid "   B" and resid   51 and name HE22) (segid "   B" and resid   51 and name HE21) 2.349 0.690 0.690 weight 1.000 ! spec=15Nn...5deg, no=770, id=6268, vol=3.364000e+02
assign (segid "   A" and resid  107 and name   HA) (segid "   A" and resid  107 and name   HN) 2.695 0.908 0.908 weight 1.000 ! spec=15Nn...5deg, no=773, id=6270, vol=6.221000e+02
assign (segid "   B" and resid  107 and name   HA) (segid "   B" and resid  107 and name   HN) 2.695 0.908 0.908 weight 1.000 ! spec=15Nn...5deg, no=773, id=6270, vol=6.221000e+02
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid   56 and name   HN) 4.128 2.130 2.130 weight 1.000 ! spec=15Nn...5deg, no=774, id=6271, vol=2.842000e+02
assign (segid "   B" and resid  107 and name   HN) (segid "   B" and resid   56 and name   HN) 4.128 2.130 2.130 weight 1.000 ! spec=15Nn...5deg, no=774, id=6271, vol=2.842000e+02
assign (segid "   A" and resid  108 and name   HN) (segid "   A" and resid  107 and name   HN) 3.779 1.786 1.786 weight 1.000 ! spec=15Nn...5deg, no=775, id=6272, vol=4.334000e+02
assign (segid "   B" and resid  108 and name   HN) (segid "   B" and resid  107 and name   HN) 3.779 1.786 1.786 weight 1.000 ! spec=15Nn...5deg, no=775, id=6272, vol=4.334000e+02
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid  106 and name   HN) 2.271 0.645 0.645 weight 1.000 ! spec=15Nn...5deg, no=776, id=6273, vol=9.847000e+02
assign (segid "   B" and resid  107 and name   HN) (segid "   B" and resid  106 and name   HN) 2.271 0.645 0.645 weight 1.000 ! spec=15Nn...5deg, no=776, id=6273, vol=9.847000e+02
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid   83 and name   HN) 2.875 1.033 1.033 weight 1.000 ! spec=15Nn...5deg, no=777, id=6274, vol=5.573000e+02
assign (segid "   B" and resid  107 and name   HN) (segid "   B" and resid   83 and name   HN) 2.875 1.033 1.033 weight 1.000 ! spec=15Nn...5deg, no=777, id=6274, vol=5.573000e+02
assign (segid "   A" and resid  107 and name  HB2) (segid "   A" and resid  107 and name   HN) 2.098 0.550 0.550 weight 1.000 ! spec=15Nn...5deg, no=779, id=6276, vol=2.088000e+03
    or (segid "   A" and resid  107 and name  HB1) (segid "   A" and resid  107 and name   HN)
    or (segid "   A" and resid  107 and name  HB3) (segid "   A" and resid  107 and name   HN)
assign (segid "   B" and resid  107 and name  HB2) (segid "   B" and resid  107 and name   HN) 2.098 0.550 0.550 weight 1.000 ! spec=15Nn...5deg, no=779, id=6276, vol=2.088000e+03
    or (segid "   B" and resid  107 and name  HB1) (segid "   B" and resid  107 and name   HN)
    or (segid "   B" and resid  107 and name  HB3) (segid "   B" and resid  107 and name   HN)
assign (segid "   A" and resid   56 and name HG21) (segid "   A" and resid  107 and name   HN) 3.446 1.484 1.484 weight 1.000 ! spec=15Nn...5deg, no=780, id=6277, vol=4.620000e+02
    or (segid "   A" and resid   56 and name HG22) (segid "   A" and resid  107 and name   HN)
    or (segid "   A" and resid   56 and name HG23) (segid "   A" and resid  107 and name   HN)
assign (segid "   B" and resid   56 and name HG21) (segid "   B" and resid  107 and name   HN) 3.446 1.484 1.484 weight 1.000 ! spec=15Nn...5deg, no=780, id=6277, vol=4.620000e+02
    or (segid "   B" and resid   56 and name HG22) (segid "   B" and resid  107 and name   HN)
    or (segid "   B" and resid   56 and name HG23) (segid "   B" and resid  107 and name   HN)
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid  106 and name   HA) 3.340 1.394 1.394 weight 1.000 ! spec=15Nn...5deg, no=781, id=6278, vol=5.409000e+02
assign (segid "   B" and resid  107 and name   HN) (segid "   B" and resid  106 and name   HA) 3.340 1.394 1.394 weight 1.000 ! spec=15Nn...5deg, no=781, id=6278, vol=5.409000e+02
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid   84 and name   HA) 4.890 2.989 2.989 weight 1.000 ! spec=15Nn...5deg, no=782, id=6279, vol=2.807000e+02
assign (segid "   B" and resid  107 and name   HN) (segid "   B" and resid   84 and name   HA) 4.890 2.989 2.989 weight 1.000 ! spec=15Nn...5deg, no=782, id=6279, vol=2.807000e+02
assign (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name   HN) 2.636 0.869 0.869 weight 1.000 ! spec=15Nn...5deg, no=787, id=6281, vol=8.241000e+02
assign (segid "   B" and resid   90 and name   HA) (segid "   B" and resid   90 and name   HN) 2.636 0.869 0.869 weight 1.000 ! spec=15Nn...5deg, no=787, id=6281, vol=8.241000e+02
assign (segid "   A" and resid  111 and name   HN) (segid "   A" and resid  111 and name   HA) 3.174 1.259 1.259 weight 1.000 ! spec=15Nn...5deg, no=790, id=6283, vol=2.988000e+02
assign (segid "   B" and resid  111 and name   HN) (segid "   B" and resid  111 and name   HA) 3.174 1.259 1.259 weight 1.000 ! spec=15Nn...5deg, no=790, id=6283, vol=2.988000e+02
assign (segid "   A" and resid  110 and name   HA) (segid "   A" and resid  111 and name   HN) 2.706 0.915 0.915 weight 1.000 ! spec=15Nn...5deg, no=791, id=6284, vol=5.914000e+02
assign (segid "   B" and resid  110 and name   HA) (segid "   B" and resid  111 and name   HN) 2.706 0.915 0.915 weight 1.000 ! spec=15Nn...5deg, no=791, id=6284, vol=5.914000e+02
assign (segid "   A" and resid  111 and name   HN) (segid "   A" and resid   79 and name   HA) 3.986 1.986 1.986 weight 1.000 ! spec=15Nn...5deg, no=792, id=6285, vol=4.407000e+02
assign (segid "   B" and resid  111 and name   HN) (segid "   B" and resid   79 and name   HA) 3.986 1.986 1.986 weight 1.000 ! spec=15Nn...5deg, no=792, id=6285, vol=4.407000e+02
assign (segid "   A" and resid  111 and name HG22) (segid "   A" and resid  111 and name   HN) 2.650 0.878 0.878 weight 1.000 ! spec=15Nn...5deg, no=794, id=6287, vol=3.635000e+02
    or (segid "   A" and resid  111 and name HG21) (segid "   A" and resid  111 and name   HN)
    or (segid "   A" and resid  111 and name HG23) (segid "   A" and resid  111 and name   HN)
assign (segid "   B" and resid  111 and name HG22) (segid "   B" and resid  111 and name   HN) 2.650 0.878 0.878 weight 1.000 ! spec=15Nn...5deg, no=794, id=6287, vol=3.635000e+02
    or (segid "   B" and resid  111 and name HG21) (segid "   B" and resid  111 and name   HN)
    or (segid "   B" and resid  111 and name HG23) (segid "   B" and resid  111 and name   HN)
assign (segid "   A" and resid  111 and name HG12) (segid "   A" and resid  111 and name   HN) 2.483 0.771 0.771 weight 1.000 ! spec=15Nn...5deg, no=795, id=6288, vol=5.352000e+02
    or (segid "   A" and resid  111 and name HG11) (segid "   A" and resid  111 and name   HN)
    or (segid "   A" and resid  111 and name HG13) (segid "   A" and resid  111 and name   HN)
assign (segid "   B" and resid  111 and name HG12) (segid "   B" and resid  111 and name   HN) 2.483 0.771 0.771 weight 1.000 ! spec=15Nn...5deg, no=795, id=6288, vol=5.352000e+02
    or (segid "   B" and resid  111 and name HG11) (segid "   B" and resid  111 and name   HN)
    or (segid "   B" and resid  111 and name HG13) (segid "   B" and resid  111 and name   HN)
assign (segid "   A" and resid  109 and name HG22) (segid "   A" and resid  111 and name   HN) 2.976 1.107 1.107 weight 1.000 ! spec=15Nn...5deg, no=796, id=6289, vol=4.003000e+02
    or (segid "   A" and resid  109 and name HG21) (segid "   A" and resid  111 and name   HN)
    or (segid "   A" and resid  109 and name HG23) (segid "   A" and resid  111 and name   HN)
assign (segid "   B" and resid  109 and name HG22) (segid "   B" and resid  111 and name   HN) 2.976 1.107 1.107 weight 1.000 ! spec=15Nn...5deg, no=796, id=6289, vol=4.003000e+02
    or (segid "   B" and resid  109 and name HG21) (segid "   B" and resid  111 and name   HN)
    or (segid "   B" and resid  109 and name HG23) (segid "   B" and resid  111 and name   HN)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   41 and name   HN) 2.941 1.081 1.081 weight 1.000 ! spec=15Nn...5deg, no=799, id=6292, vol=8.767000e+02
assign (segid "   B" and resid   40 and name   HA) (segid "   B" and resid   41 and name   HN) 2.941 1.081 1.081 weight 1.000 ! spec=15Nn...5deg, no=799, id=6292, vol=8.767000e+02
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   42 and name HG12) 3.320 1.378 1.378 weight 1.000 ! spec=15Nn...5deg, no=800, id=6293, vol=3.092000e+02
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   42 and name HG11)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   42 and name HG13)
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   42 and name HG12) 3.320 1.378 1.378 weight 1.000 ! spec=15Nn...5deg, no=800, id=6293, vol=3.092000e+02
    or (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   42 and name HG11)
    or (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   42 and name HG13)
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   41 and name   HN) 2.850 1.015 1.015 weight 1.000 ! spec=15Nn...5deg, no=802, id=6295, vol=5.217000e+02
assign (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   41 and name   HN) 2.850 1.015 1.015 weight 1.000 ! spec=15Nn...5deg, no=802, id=6295, vol=5.217000e+02
assign (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   41 and name   HN) 3.155 1.244 1.244 weight 1.000 ! spec=15Nn...5deg, no=803, id=6296, vol=1.980000e+03
assign (segid "   B" and resid   41 and name  HB2) (segid "   B" and resid   41 and name   HN) 3.155 1.244 1.244 weight 1.000 ! spec=15Nn...5deg, no=803, id=6296, vol=1.980000e+03
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name   HN) 2.946 1.085 1.085 weight 1.000 ! spec=15Nn...5deg, no=804, id=6297, vol=6.844000e+02
assign (segid "   B" and resid   41 and name   HA) (segid "   B" and resid   41 and name   HN) 2.946 1.085 1.085 weight 1.000 ! spec=15Nn...5deg, no=804, id=6297, vol=6.844000e+02
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   42 and name   HN) 3.768 1.774 1.774 weight 1.000 ! spec=15Nn...5deg, no=806, id=6299, vol=7.065000e+02
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   42 and name   HN) 3.768 1.774 1.774 weight 1.000 ! spec=15Nn...5deg, no=806, id=6299, vol=7.065000e+02
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name  HB1) 2.561 0.820 0.820 weight 1.000 ! spec=15Nn...5deg, no=809, id=6302, vol=9.961000e+02
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   41 and name  HB1) 2.561 0.820 0.820 weight 1.000 ! spec=15Nn...5deg, no=809, id=6302, vol=9.961000e+02
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name   HN) 2.820 0.994 0.994 weight 1.000 ! spec=15Nn...5deg, no=811, id=6304, vol=3.776000e+02
assign (segid "   B" and resid   42 and name   HA) (segid "   B" and resid   42 and name   HN) 2.820 0.994 0.994 weight 1.000 ! spec=15Nn...5deg, no=811, id=6304, vol=3.776000e+02
assign (segid "   A" and resid   42 and name   HB) (segid "   A" and resid   42 and name   HN) 3.222 1.297 1.297 weight 1.000 ! spec=15Nn...5deg, no=815, id=6306, vol=3.761000e+02
assign (segid "   B" and resid   42 and name   HB) (segid "   B" and resid   42 and name   HN) 3.222 1.297 1.297 weight 1.000 ! spec=15Nn...5deg, no=815, id=6306, vol=3.761000e+02
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   49 and name  HB1) 5.111 3.265 3.265 weight 1.000 ! spec=15Nn...5deg, no=816, id=6307, vol=2.007000e+02
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   49 and name  HB1) 5.111 3.265 3.265 weight 1.000 ! spec=15Nn...5deg, no=816, id=6307, vol=2.007000e+02
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   42 and name   HN) 2.760 0.952 0.952 weight 1.000 ! spec=15Nn...5deg, no=818, id=6309, vol=5.836000e+02
assign (segid "   B" and resid   41 and name   HA) (segid "   B" and resid   42 and name   HN) 2.760 0.952 0.952 weight 1.000 ! spec=15Nn...5deg, no=818, id=6309, vol=5.836000e+02
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   49 and name   HN) 3.097 1.199 1.199 weight 1.000 ! spec=15Nn...5deg, no=819, id=6310, vol=3.063000e+02
assign (segid "   B" and resid   42 and name   HN) (segid "   B" and resid   49 and name   HN) 3.097 1.199 1.199 weight 1.000 ! spec=15Nn...5deg, no=819, id=6310, vol=3.063000e+02
assign (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   42 and name   HN) 3.972 1.972 1.972 weight 1.000 ! spec=15Nn...5deg, no=822, id=6313, vol=4.635000e+02
assign (segid "   B" and resid   41 and name  HB1) (segid "   B" and resid   42 and name   HN) 3.972 1.972 1.972 weight 1.000 ! spec=15Nn...5deg, no=822, id=6313, vol=4.635000e+02
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB1) 3.955 1.955 1.955 weight 1.000 ! spec=15Nn...5deg, no=829, id=6319, vol=4.421000e+02
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   11 and name  HB1) 3.955 1.955 1.955 weight 1.000 ! spec=15Nn...5deg, no=829, id=6319, vol=4.421000e+02
assign (segid "   A" and resid  104 and name HG11) (segid "   A" and resid  104 and name   HN) 2.764 0.955 0.955 weight 1.000 ! spec=15Nn...5deg, no=831, id=6321, vol=6.623000e+02
assign (segid "   B" and resid  104 and name HG11) (segid "   B" and resid  104 and name   HN) 2.764 0.955 0.955 weight 1.000 ! spec=15Nn...5deg, no=831, id=6321, vol=6.623000e+02
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  104 and name HG12) 2.269 0.643 0.643 weight 1.000 ! spec=15Nn...5deg, no=833, id=6323, vol=7.256000e+02
assign (segid "   B" and resid  104 and name   HN) (segid "   B" and resid  104 and name HG12) 2.269 0.643 0.643 weight 1.000 ! spec=15Nn...5deg, no=833, id=6323, vol=7.256000e+02
assign (segid "   A" and resid  104 and name HG22) (segid "   A" and resid  104 and name   HN) 2.839 1.008 1.008 weight 1.000 ! spec=15Nn...5deg, no=836, id=6325, vol=5.011000e+02
    or (segid "   A" and resid  104 and name HG21) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid  104 and name HG23) (segid "   A" and resid  104 and name   HN)
assign (segid "   B" and resid  104 and name HG22) (segid "   B" and resid  104 and name   HN) 2.839 1.008 1.008 weight 1.000 ! spec=15Nn...5deg, no=836, id=6325, vol=5.011000e+02
    or (segid "   B" and resid  104 and name HG21) (segid "   B" and resid  104 and name   HN)
    or (segid "   B" and resid  104 and name HG23) (segid "   B" and resid  104 and name   HN)
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid  104 and name   HN) 3.941 1.942 1.942 weight 1.000 ! spec=15Nn...5deg, no=837, id=6326, vol=3.570000e+02
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid  104 and name   HN)
assign (segid "   B" and resid  104 and name HD12) (segid "   B" and resid  104 and name   HN) 3.941 1.942 1.942 weight 1.000 ! spec=15Nn...5deg, no=837, id=6326, vol=3.570000e+02
    or (segid "   B" and resid  104 and name HD11) (segid "   B" and resid  104 and name   HN)
    or (segid "   B" and resid  104 and name HD13) (segid "   B" and resid  104 and name   HN)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name   HN) 2.721 0.926 0.926 weight 1.000 ! spec=15Nn...5deg, no=842, id=6328, vol=8.552000e+02
assign (segid "   B" and resid   40 and name   HA) (segid "   B" and resid   40 and name   HN) 2.721 0.926 0.926 weight 1.000 ! spec=15Nn...5deg, no=842, id=6328, vol=8.552000e+02
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   40 and name   HN) 3.288 1.351 1.351 weight 1.000 ! spec=15Nn...5deg, no=845, id=6330, vol=8.060000e+02
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   40 and name   HN) 3.288 1.351 1.351 weight 1.000 ! spec=15Nn...5deg, no=845, id=6330, vol=8.060000e+02
assign (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   40 and name   HN) 3.806 1.811 1.811 weight 1.000 ! spec=15Nn...5deg, no=849, id=6333, vol=8.060000e+02
assign (segid "   B" and resid   41 and name  HB1) (segid "   B" and resid   40 and name   HN) 3.806 1.811 1.811 weight 1.000 ! spec=15Nn...5deg, no=849, id=6333, vol=8.060000e+02
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   39 and name   HN) 3.792 1.797 1.797 weight 1.000 ! spec=15Nn...5deg, no=853, id=6335, vol=3.530000e+02
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   39 and name   HN)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   39 and name   HN)
assign (segid "   B" and resid   38 and name HG22) (segid "   B" and resid   39 and name   HN) 3.792 1.797 1.797 weight 1.000 ! spec=15Nn...5deg, no=853, id=6335, vol=3.530000e+02
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid   39 and name   HN)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid   39 and name   HN)
assign (segid "   A" and resid   39 and name   HG) (segid "   A" and resid   39 and name   HN) 2.577 0.830 0.830 weight 1.000 ! spec=15Nn...5deg, no=854, id=6336, vol=5.786000e+02
assign (segid "   B" and resid   39 and name   HG) (segid "   B" and resid   39 and name   HN) 2.577 0.830 0.830 weight 1.000 ! spec=15Nn...5deg, no=854, id=6336, vol=5.786000e+02
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name   HN) 3.370 1.420 1.420 weight 1.000 ! spec=15Nn...5deg, no=856, id=6337, vol=2.117000e+02
assign (segid "   B" and resid   39 and name   HA) (segid "   B" and resid   39 and name   HN) 3.370 1.420 1.420 weight 1.000 ! spec=15Nn...5deg, no=856, id=6337, vol=2.117000e+02
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name   HN) 3.650 1.665 1.665 weight 1.000 ! spec=15Nn...5deg, no=857, id=6338, vol=6.156000e+02
assign (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   39 and name   HN) 3.650 1.665 1.665 weight 1.000 ! spec=15Nn...5deg, no=857, id=6338, vol=6.156000e+02
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HB2) 2.842 1.009 1.009 weight 1.000 ! spec=15Nn...5deg, no=858, id=6339, vol=3.555000e+02
assign (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   39 and name  HB2) 2.842 1.009 1.009 weight 1.000 ! spec=15Nn...5deg, no=858, id=6339, vol=3.555000e+02
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   39 and name   HN) 2.748 0.944 0.944 weight 1.000 ! spec=15Nn...5deg, no=860, id=6341, vol=3.982000e+02
assign (segid "   B" and resid   38 and name   HA) (segid "   B" and resid   39 and name   HN) 2.748 0.944 0.944 weight 1.000 ! spec=15Nn...5deg, no=860, id=6341, vol=3.982000e+02
assign (segid "   A" and resid   39 and name HD22) (segid "   A" and resid   39 and name   HN) 3.317 1.375 1.375 weight 1.000 ! spec=15Nn...5deg, no=861, id=6342, vol=5.715000e+02
    or (segid "   A" and resid   39 and name HD21) (segid "   A" and resid   39 and name   HN)
    or (segid "   A" and resid   39 and name HD23) (segid "   A" and resid   39 and name   HN)
assign (segid "   B" and resid   39 and name HD22) (segid "   B" and resid   39 and name   HN) 3.317 1.375 1.375 weight 1.000 ! spec=15Nn...5deg, no=861, id=6342, vol=5.715000e+02
    or (segid "   B" and resid   39 and name HD21) (segid "   B" and resid   39 and name   HN)
    or (segid "   B" and resid   39 and name HD23) (segid "   B" and resid   39 and name   HN)
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   75 and name   HN) 3.664 1.678 1.678 weight 1.000 ! spec=15Nn...5deg, no=864, id=6344, vol=6.134000e+02
assign (segid "   B" and resid   74 and name  HB2) (segid "   B" and resid   75 and name   HN) 3.664 1.678 1.678 weight 1.000 ! spec=15Nn...5deg, no=864, id=6344, vol=6.134000e+02
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   75 and name   HN) 4.007 2.007 2.007 weight 1.000 ! spec=15Nn...5deg, no=865, id=6345, vol=3.213000e+02
assign (segid "   B" and resid   73 and name   HN) (segid "   B" and resid   75 and name   HN) 4.007 2.007 2.007 weight 1.000 ! spec=15Nn...5deg, no=865, id=6345, vol=3.213000e+02
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   76 and name   HN) 2.176 0.592 0.592 weight 1.000 ! spec=15Nn...5deg, no=866, id=6346, vol=1.412000e+03
assign (segid "   B" and resid   75 and name   HN) (segid "   B" and resid   76 and name   HN) 2.176 0.592 0.592 weight 1.000 ! spec=15Nn...5deg, no=866, id=6346, vol=1.412000e+03
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid  115 and name  HB2) 5.593 3.910 3.910 weight 1.000 ! spec=15Nn...5deg, no=867, id=6347, vol=3.389000e+02
assign (segid "   B" and resid   75 and name   HN) (segid "   B" and resid  115 and name  HB2) 5.593 3.910 3.910 weight 1.000 ! spec=15Nn...5deg, no=867, id=6347, vol=3.389000e+02
assign (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   75 and name   HN) 4.302 2.313 2.313 weight 1.000 ! spec=15Nn...5deg, no=870, id=6349, vol=2.782000e+02
assign (segid "   B" and resid   73 and name   HA) (segid "   B" and resid   75 and name   HN) 4.302 2.313 2.313 weight 1.000 ! spec=15Nn...5deg, no=870, id=6349, vol=2.782000e+02
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   75 and name   HN) 3.267 1.334 1.334 weight 1.000 ! spec=15Nn...5deg, no=871, id=6350, vol=7.698000e+02
assign (segid "   B" and resid   75 and name  HB2) (segid "   B" and resid   75 and name   HN) 3.267 1.334 1.334 weight 1.000 ! spec=15Nn...5deg, no=871, id=6350, vol=7.698000e+02
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   75 and name   HN) 4.605 2.651 2.651 weight 1.000 ! spec=15Nn...5deg, no=872, id=6351, vol=3.027000e+02
assign (segid "   B" and resid   74 and name  HG1) (segid "   B" and resid   75 and name   HN) 4.605 2.651 2.651 weight 1.000 ! spec=15Nn...5deg, no=872, id=6351, vol=3.027000e+02
assign (segid "   A" and resid   75 and name  HB1) (segid "   A" and resid   75 and name   HN) 2.635 0.868 0.868 weight 1.000 ! spec=15Nn...5deg, no=873, id=6352, vol=7.075000e+02
assign (segid "   B" and resid   75 and name  HB1) (segid "   B" and resid   75 and name   HN) 2.635 0.868 0.868 weight 1.000 ! spec=15Nn...5deg, no=873, id=6352, vol=7.075000e+02
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   75 and name   HN) 2.609 0.851 0.851 weight 1.000 ! spec=15Nn...5deg, no=874, id=6353, vol=7.919000e+02
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   75 and name   HN) 2.609 0.851 0.851 weight 1.000 ! spec=15Nn...5deg, no=874, id=6353, vol=7.919000e+02
assign (segid "   A" and resid   74 and name  HG2) (segid "   A" and resid   75 and name   HN) 4.005 2.005 2.005 weight 1.000 ! spec=15Nn...5deg, no=875, id=6354, vol=3.490000e+02
assign (segid "   B" and resid   74 and name  HG2) (segid "   B" and resid   75 and name   HN) 4.005 2.005 2.005 weight 1.000 ! spec=15Nn...5deg, no=875, id=6354, vol=3.490000e+02
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name   HN) 2.948 1.086 1.086 weight 1.000 ! spec=15Nn...5deg, no=876, id=6355, vol=6.341000e+02
assign (segid "   B" and resid   75 and name   HA) (segid "   B" and resid   75 and name   HN) 2.948 1.086 1.086 weight 1.000 ! spec=15Nn...5deg, no=876, id=6355, vol=6.341000e+02
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   75 and name   HN) 3.276 1.342 1.342 weight 1.000 ! spec=15Nn...5deg, no=878, id=6357, vol=5.168000e+02
assign (segid "   B" and resid   74 and name   HA) (segid "   B" and resid   75 and name   HN) 3.276 1.342 1.342 weight 1.000 ! spec=15Nn...5deg, no=878, id=6357, vol=5.168000e+02
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid  102 and name   HN) 4.856 2.948 2.948 weight 1.000 ! spec=15Nn...5deg, no=883, id=6358, vol=2.714000e+02
assign (segid "   B" and resid   86 and name  HB2) (segid "   B" and resid  102 and name   HN) 4.856 2.948 2.948 weight 1.000 ! spec=15Nn...5deg, no=883, id=6358, vol=2.714000e+02
assign (segid "   A" and resid  102 and name HG12) (segid "   A" and resid  102 and name   HN) 2.410 0.726 0.726 weight 1.000 ! spec=15Nn...5deg, no=884, id=6359, vol=5.573000e+02
assign (segid "   B" and resid  102 and name HG12) (segid "   B" and resid  102 and name   HN) 2.410 0.726 0.726 weight 1.000 ! spec=15Nn...5deg, no=884, id=6359, vol=5.573000e+02
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name   HB) 3.605 1.624 1.624 weight 1.000 ! spec=15Nn...5deg, no=885, id=6360, vol=3.138000e+02
assign (segid "   B" and resid  102 and name   HN) (segid "   B" and resid  102 and name   HB) 3.605 1.624 1.624 weight 1.000 ! spec=15Nn...5deg, no=885, id=6360, vol=3.138000e+02
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid  102 and name   HN) 2.852 1.017 1.017 weight 1.000 ! spec=15Nn...5deg, no=886, id=6361, vol=6.261000e+02
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid  102 and name   HN)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid  102 and name   HN) 2.852 1.017 1.017 weight 1.000 ! spec=15Nn...5deg, no=886, id=6361, vol=6.261000e+02
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid  102 and name   HN)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid  102 and name   HN)
assign (segid "   A" and resid   87 and name   HB) (segid "   A" and resid  102 and name   HN) 3.859 1.862 1.862 weight 1.000 ! spec=15Nn...5deg, no=888, id=6363, vol=2.608000e+02
assign (segid "   B" and resid   87 and name   HB) (segid "   B" and resid  102 and name   HN) 3.859 1.862 1.862 weight 1.000 ! spec=15Nn...5deg, no=888, id=6363, vol=2.608000e+02
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid   88 and name   HN) 4.441 2.465 2.465 weight 1.000 ! spec=15Nn...5deg, no=890, id=6365, vol=2.054000e+02
assign (segid "   B" and resid  102 and name   HN) (segid "   B" and resid   88 and name   HN) 4.441 2.465 2.465 weight 1.000 ! spec=15Nn...5deg, no=890, id=6365, vol=2.054000e+02
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  101 and name  HB2) 4.179 2.183 2.183 weight 1.000 ! spec=15Nn...5deg, no=891, id=6366, vol=4.365000e+02
assign (segid "   B" and resid  102 and name   HN) (segid "   B" and resid  101 and name  HB2) 4.179 2.183 2.183 weight 1.000 ! spec=15Nn...5deg, no=891, id=6366, vol=4.365000e+02
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name HG11) 2.995 1.121 1.121 weight 1.000 ! spec=15Nn...5deg, no=892, id=6367, vol=3.610000e+02
assign (segid "   B" and resid  102 and name   HN) (segid "   B" and resid  102 and name HG11) 2.995 1.121 1.121 weight 1.000 ! spec=15Nn...5deg, no=892, id=6367, vol=3.610000e+02
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid  102 and name   HN) 3.923 1.924 1.924 weight 1.000 ! spec=15Nn...5deg, no=894, id=6368, vol=3.570000e+02
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid  102 and name   HN)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid  102 and name   HN) 3.923 1.924 1.924 weight 1.000 ! spec=15Nn...5deg, no=894, id=6368, vol=3.570000e+02
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid  102 and name   HN)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid  102 and name   HN)
assign (segid "   A" and resid   45 and name HD22) (segid "   A" and resid   45 and name   HA) 2.538 0.805 0.805 weight 1.000 ! spec=15Nn...5deg, no=898, id=6371, vol=1.157000e+03
assign (segid "   B" and resid   45 and name HD22) (segid "   B" and resid   45 and name   HA) 2.538 0.805 0.805 weight 1.000 ! spec=15Nn...5deg, no=898, id=6371, vol=1.157000e+03
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   75 and name  HB1) 3.487 1.520 1.520 weight 1.000 ! spec=15Nn...5deg, no=906, id=6376, vol=5.068000e+02
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   75 and name  HB1) 3.487 1.520 1.520 weight 1.000 ! spec=15Nn...5deg, no=906, id=6376, vol=5.068000e+02
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    2 and name   HA) 3.239 1.311 1.311 weight 1.000 ! spec=15Nn...5deg, no=912, id=6378, vol=3.952000e+02
assign (segid "   B" and resid    2 and name   HN) (segid "   B" and resid    2 and name   HA) 3.239 1.311 1.311 weight 1.000 ! spec=15Nn...5deg, no=912, id=6378, vol=3.952000e+02
assign (segid "   A" and resid   48 and name HG22) (segid "   A" and resid   48 and name   HN) 2.461 0.757 0.757 weight 1.000 ! spec=15Nn...5deg, no=915, id=6380, vol=1.264000e+03
    or (segid "   A" and resid   48 and name HG21) (segid "   A" and resid   48 and name   HN)
    or (segid "   A" and resid   48 and name HG23) (segid "   A" and resid   48 and name   HN)
assign (segid "   B" and resid   48 and name HG22) (segid "   B" and resid   48 and name   HN) 2.461 0.757 0.757 weight 1.000 ! spec=15Nn...5deg, no=915, id=6380, vol=1.264000e+03
    or (segid "   B" and resid   48 and name HG21) (segid "   B" and resid   48 and name   HN)
    or (segid "   B" and resid   48 and name HG23) (segid "   B" and resid   48 and name   HN)
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   48 and name   HN) 4.455 2.481 2.481 weight 1.000 ! spec=15Nn...5deg, no=916, id=6381, vol=5.779000e+02
assign (segid "   B" and resid   47 and name  HB2) (segid "   B" and resid   48 and name   HN) 4.455 2.481 2.481 weight 1.000 ! spec=15Nn...5deg, no=916, id=6381, vol=5.779000e+02
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   48 and name   HN) 4.631 2.680 2.680 weight 1.000 ! spec=15Nn...5deg, no=919, id=6384, vol=3.600000e+02
assign (segid "   B" and resid   47 and name  HB1) (segid "   B" and resid   48 and name   HN) 4.631 2.680 2.680 weight 1.000 ! spec=15Nn...5deg, no=919, id=6384, vol=3.600000e+02
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name   HN) 3.045 1.159 1.159 weight 1.000 ! spec=15Nn...5deg, no=920, id=6385, vol=4.606000e+02
assign (segid "   B" and resid   48 and name   HA) (segid "   B" and resid   48 and name   HN) 3.045 1.159 1.159 weight 1.000 ! spec=15Nn...5deg, no=920, id=6385, vol=4.606000e+02
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   77 and name HD21) 4.085 2.085 2.085 weight 1.000 ! spec=15Nn...5deg, no=921, id=6386, vol=3.329000e+02
assign (segid "   B" and resid   77 and name  HB1) (segid "   B" and resid   77 and name HD21) 4.085 2.085 2.085 weight 1.000 ! spec=15Nn...5deg, no=921, id=6386, vol=3.329000e+02
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   34 and name   HN) 1.980 0.490 0.490 weight 1.000 ! spec=15Nn...5deg, no=929, id=6393, vol=1.445000e+03
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   34 and name   HN) 1.980 0.490 0.490 weight 1.000 ! spec=15Nn...5deg, no=929, id=6393, vol=1.445000e+03
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   32 and name  HB2) 2.842 1.010 1.010 weight 1.000 ! spec=15Nn...5deg, no=930, id=6394, vol=6.006000e+02
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   32 and name  HB2) 2.842 1.010 1.010 weight 1.000 ! spec=15Nn...5deg, no=930, id=6394, vol=6.006000e+02
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   34 and name   HN) 2.877 1.035 1.035 weight 1.000 ! spec=15Nn...5deg, no=931, id=6395, vol=6.452000e+02
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   34 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   34 and name   HN)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   34 and name   HN) 2.877 1.035 1.035 weight 1.000 ! spec=15Nn...5deg, no=931, id=6395, vol=6.452000e+02
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   34 and name   HN)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   34 and name   HN)
assign (segid "   A" and resid   22 and name HG22) (segid "   A" and resid   55 and name   HN) 3.445 1.484 1.484 weight 1.000 ! spec=15Nn...5deg, no=942, id=6404, vol=4.457000e+02
    or (segid "   A" and resid   22 and name HG21) (segid "   A" and resid   55 and name   HN)
    or (segid "   A" and resid   22 and name HG23) (segid "   A" and resid   55 and name   HN)
assign (segid "   B" and resid   22 and name HG22) (segid "   B" and resid   55 and name   HN) 3.445 1.484 1.484 weight 1.000 ! spec=15Nn...5deg, no=942, id=6404, vol=4.457000e+02
    or (segid "   B" and resid   22 and name HG21) (segid "   B" and resid   55 and name   HN)
    or (segid "   B" and resid   22 and name HG23) (segid "   B" and resid   55 and name   HN)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name  HD1) 5.087 3.235 3.235 weight 1.000 ! spec=15Nn...5deg, no=945, id=6407, vol=2.352000e+02
assign (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   54 and name  HD1) 5.087 3.235 3.235 weight 1.000 ! spec=15Nn...5deg, no=945, id=6407, vol=2.352000e+02
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   55 and name   HN) 2.767 0.957 0.957 weight 1.000 ! spec=15Nn...5deg, no=948, id=6409, vol=6.763000e+02
assign (segid "   B" and resid   20 and name   HN) (segid "   B" and resid   55 and name   HN) 2.767 0.957 0.957 weight 1.000 ! spec=15Nn...5deg, no=948, id=6409, vol=6.763000e+02
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name   HN) 3.189 1.272 1.272 weight 1.000 ! spec=15Nn...5deg, no=949, id=6410, vol=3.847000e+02
assign (segid "   B" and resid   55 and name   HA) (segid "   B" and resid   55 and name   HN) 3.189 1.272 1.272 weight 1.000 ! spec=15Nn...5deg, no=949, id=6410, vol=3.847000e+02
assign (segid "   A" and resid   55 and name  HG1) (segid "   A" and resid   55 and name   HN) 3.012 1.134 1.134 weight 1.000 ! spec=15Nn...5deg, no=950, id=6411, vol=4.173000e+02
assign (segid "   B" and resid   55 and name  HG1) (segid "   B" and resid   55 and name   HN) 3.012 1.134 1.134 weight 1.000 ! spec=15Nn...5deg, no=950, id=6411, vol=4.173000e+02
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   55 and name   HN) 2.394 0.716 0.716 weight 1.000 ! spec=15Nn...5deg, no=952, id=6413, vol=1.167000e+03
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   55 and name   HN) 2.394 0.716 0.716 weight 1.000 ! spec=15Nn...5deg, no=952, id=6413, vol=1.167000e+03
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   55 and name   HN) 3.847 1.850 1.850 weight 1.000 ! spec=15Nn...5deg, no=953, id=6414, vol=3.454000e+02
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   55 and name   HN) 3.847 1.850 1.850 weight 1.000 ! spec=15Nn...5deg, no=953, id=6414, vol=3.454000e+02
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   55 and name   HN) 4.723 2.788 2.788 weight 1.000 ! spec=15Nn...5deg, no=954, id=6415, vol=2.387000e+02
assign (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   55 and name   HN) 4.723 2.788 2.788 weight 1.000 ! spec=15Nn...5deg, no=954, id=6415, vol=2.387000e+02
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid  106 and name   HN) 4.146 2.149 2.149 weight 1.000 ! spec=15Nn...5deg, no=961, id=6422, vol=3.600000e+02
assign (segid "   B" and resid   85 and name   HN) (segid "   B" and resid  106 and name   HN) 4.146 2.149 2.149 weight 1.000 ! spec=15Nn...5deg, no=961, id=6422, vol=3.600000e+02
assign (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   85 and name   HN) 2.971 1.104 1.104 weight 1.000 ! spec=15Nn...5deg, no=964, id=6424, vol=7.407000e+02
assign (segid "   B" and resid   84 and name  HB2) (segid "   B" and resid   85 and name   HN) 2.971 1.104 1.104 weight 1.000 ! spec=15Nn...5deg, no=964, id=6424, vol=7.407000e+02
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   85 and name   HN) 2.334 0.681 0.681 weight 1.000 ! spec=15Nn...5deg, no=965, id=6425, vol=1.036000e+03
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   85 and name   HN)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid   85 and name   HN) 2.334 0.681 0.681 weight 1.000 ! spec=15Nn...5deg, no=965, id=6425, vol=1.036000e+03
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid   85 and name   HN)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid   85 and name   HN)
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   85 and name   HN) 2.639 0.871 0.871 weight 1.000 ! spec=15Nn...5deg, no=968, id=6428, vol=6.995000e+02
assign (segid "   B" and resid   84 and name   HA) (segid "   B" and resid   85 and name   HN) 2.639 0.871 0.871 weight 1.000 ! spec=15Nn...5deg, no=968, id=6428, vol=6.995000e+02
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   29 and name   HN) 2.439 0.744 0.744 weight 1.000 ! spec=15Nn...5deg, no=972, id=6431, vol=1.398000e+03
assign (segid "   B" and resid   28 and name   HA) (segid "   B" and resid   29 and name   HN) 2.439 0.744 0.744 weight 1.000 ! spec=15Nn...5deg, no=972, id=6431, vol=1.398000e+03
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   29 and name   HN) 2.084 0.543 0.543 weight 1.000 ! spec=15Nn...5deg, no=973, id=6432, vol=2.361000e+03
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid   28 and name  HB3) (segid "   A" and resid   29 and name   HN)
assign (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   29 and name   HN) 2.084 0.543 0.543 weight 1.000 ! spec=15Nn...5deg, no=973, id=6432, vol=2.361000e+03
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   29 and name   HN)
    or (segid "   B" and resid   28 and name  HB3) (segid "   B" and resid   29 and name   HN)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid  102 and name HG22) 3.004 1.128 1.128 weight 1.000 ! spec=15Nn...5deg, no=976, id=6434, vol=5.424000e+02
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid  102 and name HG21)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid  102 and name HG23)
assign (segid "   B" and resid   29 and name   HN) (segid "   B" and resid  102 and name HG22) 3.004 1.128 1.128 weight 1.000 ! spec=15Nn...5deg, no=976, id=6434, vol=5.424000e+02
    or (segid "   B" and resid   29 and name   HN) (segid "   B" and resid  102 and name HG21)
    or (segid "   B" and resid   29 and name   HN) (segid "   B" and resid  102 and name HG23)
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HN) 3.306 1.366 1.366 weight 1.000 ! spec=15Nn...5deg, no=977, id=6435, vol=9.108000e+02
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HN)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   29 and name   HN) 3.306 1.366 1.366 weight 1.000 ! spec=15Nn...5deg, no=977, id=6435, vol=9.108000e+02
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   29 and name   HN)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   29 and name   HN)
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   29 and name   HN) 2.418 0.731 0.731 weight 1.000 ! spec=15Nn...5deg, no=979, id=6437, vol=1.098000e+03
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   29 and name   HN) 2.418 0.731 0.731 weight 1.000 ! spec=15Nn...5deg, no=979, id=6437, vol=1.098000e+03
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   30 and name   HN) 4.234 2.241 2.241 weight 1.000 ! spec=15Nn...5deg, no=980, id=6438, vol=3.213000e+02
assign (segid "   B" and resid   29 and name   HN) (segid "   B" and resid   30 and name   HN) 4.234 2.241 2.241 weight 1.000 ! spec=15Nn...5deg, no=980, id=6438, vol=3.213000e+02
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name   HN) 4.406 2.426 2.426 weight 1.000 ! spec=15Nn...5deg, no=996, id=6448, vol=3.304000e+02
assign (segid "   B" and resid   62 and name  HB2) (segid "   B" and resid   62 and name   HN) 4.406 2.426 2.426 weight 1.000 ! spec=15Nn...5deg, no=996, id=6448, vol=3.304000e+02
assign (segid "   A" and resid   96 and name HE21) (segid "   A" and resid   96 and name   HA) 2.873 1.032 1.032 weight 1.000 ! spec=15Nn...5deg, no=997, id=6449, vol=1.211000e+03
assign (segid "   B" and resid   96 and name HE21) (segid "   B" and resid   96 and name   HA) 2.873 1.032 1.032 weight 1.000 ! spec=15Nn...5deg, no=997, id=6449, vol=1.211000e+03
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   22 and name   HN) 3.555 1.580 1.580 weight 1.000 ! spec=15Nn...5deg, no=1001, id=6452, vol=4.279000e+02
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   22 and name   HN) 3.555 1.580 1.580 weight 1.000 ! spec=15Nn...5deg, no=1001, id=6452, vol=4.279000e+02
assign (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   21 and name   HN) 2.726 0.929 0.929 weight 1.000 ! spec=15Nn...5deg, no=1002, id=6453, vol=7.598000e+02
assign (segid "   B" and resid   21 and name  HB1) (segid "   B" and resid   21 and name   HN) 2.726 0.929 0.929 weight 1.000 ! spec=15Nn...5deg, no=1002, id=6453, vol=7.598000e+02
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   21 and name   HN) 2.281 0.650 0.650 weight 1.000 ! spec=15Nn...5deg, no=1004, id=6455, vol=2.017000e+03
assign (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   21 and name   HN) 2.281 0.650 0.650 weight 1.000 ! spec=15Nn...5deg, no=1004, id=6455, vol=2.017000e+03
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   21 and name   HN) 2.257 0.637 0.637 weight 1.000 ! spec=15Nn...5deg, no=1007, id=6458, vol=1.208000e+03
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   21 and name   HN)
assign (segid "   B" and resid   20 and name HG12) (segid "   B" and resid   21 and name   HN) 2.257 0.637 0.637 weight 1.000 ! spec=15Nn...5deg, no=1007, id=6458, vol=1.208000e+03
    or (segid "   B" and resid   20 and name HG11) (segid "   B" and resid   21 and name   HN)
    or (segid "   B" and resid   20 and name HG13) (segid "   B" and resid   21 and name   HN)
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   21 and name   HN) 2.818 0.992 0.992 weight 1.000 ! spec=15Nn...5deg, no=1010, id=6461, vol=1.121000e+03
assign (segid "   B" and resid   20 and name   HB) (segid "   B" and resid   21 and name   HN) 2.818 0.992 0.992 weight 1.000 ! spec=15Nn...5deg, no=1010, id=6461, vol=1.121000e+03
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   69 and name   HN) 2.997 1.123 1.123 weight 1.000 ! spec=15Nn...5deg, no=1018, id=6465, vol=3.922000e+02
assign (segid "   B" and resid   68 and name   HA) (segid "   B" and resid   69 and name   HN) 2.997 1.123 1.123 weight 1.000 ! spec=15Nn...5deg, no=1018, id=6465, vol=3.922000e+02
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   35 and name   HA) 3.265 1.333 1.333 weight 1.000 ! spec=15Nn...5deg, no=1021, id=6466, vol=8.190000e+02
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   35 and name   HA) 3.265 1.333 1.333 weight 1.000 ! spec=15Nn...5deg, no=1021, id=6466, vol=8.190000e+02
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   33 and name   HN) 3.708 1.719 1.719 weight 1.000 ! spec=15Nn...5deg, no=1022, id=6467, vol=3.942000e+02
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   33 and name   HN) 3.708 1.719 1.719 weight 1.000 ! spec=15Nn...5deg, no=1022, id=6467, vol=3.942000e+02
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   30 and name   HN) 2.459 0.756 0.756 weight 1.000 ! spec=15Nn...5deg, no=1026, id=6470, vol=1.453000e+03
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   30 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   30 and name   HN)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid   30 and name   HN) 2.459 0.756 0.756 weight 1.000 ! spec=15Nn...5deg, no=1026, id=6470, vol=1.453000e+03
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid   30 and name   HN)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid   30 and name   HN)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   32 and name   HN) 4.654 2.708 2.708 weight 1.000 ! spec=15Nn...5deg, no=1027, id=6471, vol=2.007000e+02
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   32 and name   HN) 4.654 2.708 2.708 weight 1.000 ! spec=15Nn...5deg, no=1027, id=6471, vol=2.007000e+02
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid   30 and name   HN) 2.877 1.034 1.034 weight 1.000 ! spec=15Nn...5deg, no=1028, id=6472, vol=6.934000e+02
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid   30 and name   HN)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid   30 and name   HN)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid   30 and name   HN) 2.877 1.034 1.034 weight 1.000 ! spec=15Nn...5deg, no=1028, id=6472, vol=6.934000e+02
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid   30 and name   HN)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid   30 and name   HN)
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   30 and name   HN) 3.974 1.974 1.974 weight 1.000 ! spec=15Nn...5deg, no=1030, id=6474, vol=4.762000e+02
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   30 and name   HN) 3.974 1.974 1.974 weight 1.000 ! spec=15Nn...5deg, no=1030, id=6474, vol=4.762000e+02
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   30 and name   HN) 2.624 0.860 0.860 weight 1.000 ! spec=15Nn...5deg, no=1031, id=6475, vol=5.957000e+02
assign (segid "   B" and resid   30 and name  HB2) (segid "   B" and resid   30 and name   HN) 2.624 0.860 0.860 weight 1.000 ! spec=15Nn...5deg, no=1031, id=6475, vol=5.957000e+02
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   34 and name  HB1) 4.234 2.241 2.241 weight 1.000 ! spec=15Nn...5deg, no=1035, id=6479, vol=3.424000e+02
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   34 and name  HB1) 4.234 2.241 2.241 weight 1.000 ! spec=15Nn...5deg, no=1035, id=6479, vol=3.424000e+02
assign (segid "   A" and resid  109 and name   HN) (segid "   A" and resid  109 and name   HA) 3.192 1.273 1.273 weight 1.000 ! spec=15Nnoesy, no=1, id=2514, vol=5.118000e+03
assign (segid "   B" and resid  109 and name   HN) (segid "   B" and resid  109 and name   HA) 3.192 1.273 1.273 weight 1.000 ! spec=15Nnoesy, no=1, id=2514, vol=5.118000e+03
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid  109 and name   HN) 3.826 1.829 1.829 weight 1.000 ! spec=15Nnoesy, no=2, id=2515, vol=7.863000e+03
assign (segid "   B" and resid   80 and name   HA) (segid "   B" and resid  109 and name   HN) 3.826 1.829 1.829 weight 1.000 ! spec=15Nnoesy, no=2, id=2515, vol=7.863000e+03
assign (segid "   A" and resid  109 and name HG12) (segid "   A" and resid  109 and name   HN) 2.267 0.643 0.643 weight 1.000 ! spec=15Nnoesy, no=4, id=2517, vol=2.063000e+04
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid  109 and name   HN)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid  109 and name   HN)
assign (segid "   B" and resid  109 and name HG12) (segid "   B" and resid  109 and name   HN) 2.267 0.643 0.643 weight 1.000 ! spec=15Nnoesy, no=4, id=2517, vol=2.063000e+04
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid  109 and name   HN)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid  109 and name   HN)
assign (segid "   A" and resid  109 and name   HN) (segid "   A" and resid  108 and name   HN) 4.081 2.082 2.082 weight 1.000 ! spec=15Nnoesy, no=9, id=2520, vol=4.500000e+03
assign (segid "   B" and resid  109 and name   HN) (segid "   B" and resid  108 and name   HN) 4.081 2.082 2.082 weight 1.000 ! spec=15Nnoesy, no=9, id=2520, vol=4.500000e+03
assign (segid "   A" and resid  118 and name  HG2) (segid "   A" and resid  118 and name   HN) 3.957 1.957 1.957 weight 1.000 ! spec=15Nnoesy, no=17, id=2523, vol=8.465000e+03
assign (segid "   B" and resid  118 and name  HG2) (segid "   B" and resid  118 and name   HN) 3.957 1.957 1.957 weight 1.000 ! spec=15Nnoesy, no=17, id=2523, vol=8.465000e+03
assign (segid "   A" and resid  114 and name   HN) (segid "   A" and resid  114 and name  HG2) 4.920 3.026 3.026 weight 1.000 ! spec=15Nnoesy, no=22, id=2524, vol=3.045000e+03
assign (segid "   B" and resid  114 and name   HN) (segid "   B" and resid  114 and name  HG2) 4.920 3.026 3.026 weight 1.000 ! spec=15Nnoesy, no=22, id=2524, vol=3.045000e+03
assign (segid "   A" and resid  115 and name   HN) (segid "   A" and resid  115 and name  HE2) 4.838 2.925 2.925 weight 1.000 ! spec=15Nnoesy, no=28, id=2525, vol=6.645000e+03
assign (segid "   B" and resid  115 and name   HN) (segid "   B" and resid  115 and name  HE2) 4.838 2.925 2.925 weight 1.000 ! spec=15Nnoesy, no=28, id=2525, vol=6.645000e+03
assign (segid "   A" and resid  113 and name  HB2) (segid "   A" and resid  113 and name   HN) 3.309 1.368 1.368 weight 1.000 ! spec=15Nnoesy, no=30, id=2526, vol=8.454000e+03
assign (segid "   B" and resid  113 and name  HB2) (segid "   B" and resid  113 and name   HN) 3.309 1.368 1.368 weight 1.000 ! spec=15Nnoesy, no=30, id=2526, vol=8.454000e+03
assign (segid "   A" and resid   96 and name  HG2) (segid "   A" and resid   96 and name HE21) 3.371 1.420 1.420 weight 1.000 ! spec=15Nnoesy, no=39, id=2527, vol=1.623000e+04
assign (segid "   B" and resid   96 and name  HG2) (segid "   B" and resid   96 and name HE21) 3.371 1.420 1.420 weight 1.000 ! spec=15Nnoesy, no=39, id=2527, vol=1.623000e+04
assign (segid "   A" and resid   96 and name  HG2) (segid "   A" and resid   96 and name HE22) 4.269 2.278 2.278 weight 1.000 ! spec=15Nnoesy, no=40, id=2528, vol=1.106000e+04
assign (segid "   B" and resid   96 and name  HG2) (segid "   B" and resid   96 and name HE22) 4.269 2.278 2.278 weight 1.000 ! spec=15Nnoesy, no=40, id=2528, vol=1.106000e+04
assign (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   95 and name   HN) 2.905 1.055 1.055 weight 1.000 ! spec=15Nnoesy, no=43, id=2530, vol=1.343000e+04
assign (segid "   B" and resid   95 and name  HG2) (segid "   B" and resid   95 and name   HN) 2.905 1.055 1.055 weight 1.000 ! spec=15Nnoesy, no=43, id=2530, vol=1.343000e+04
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   95 and name   HN) 2.467 0.761 0.761 weight 1.000 ! spec=15Nnoesy, no=45, id=2531, vol=1.292000e+04
assign (segid "   B" and resid   94 and name  HB2) (segid "   B" and resid   95 and name   HN) 2.467 0.761 0.761 weight 1.000 ! spec=15Nnoesy, no=45, id=2531, vol=1.292000e+04
assign (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   94 and name   HN) 4.762 2.835 2.835 weight 1.000 ! spec=15Nnoesy, no=53, id=2532, vol=4.454000e+03
assign (segid "   B" and resid   93 and name  HB2) (segid "   B" and resid   94 and name   HN) 4.762 2.835 2.835 weight 1.000 ! spec=15Nnoesy, no=53, id=2532, vol=4.454000e+03
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   94 and name   HN) 3.103 1.203 1.203 weight 1.000 ! spec=15Nnoesy, no=54, id=2533, vol=9.351000e+03
assign (segid "   B" and resid   94 and name  HB2) (segid "   B" and resid   94 and name   HN) 3.103 1.203 1.203 weight 1.000 ! spec=15Nnoesy, no=54, id=2533, vol=9.351000e+03
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   86 and name  HD1) 4.270 2.279 2.279 weight 1.000 ! spec=15Nnoesy, no=66, id=2537, vol=6.677000e+03
assign (segid "   B" and resid   86 and name   HN) (segid "   B" and resid   86 and name  HD1) 4.270 2.279 2.279 weight 1.000 ! spec=15Nnoesy, no=66, id=2537, vol=6.677000e+03
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name  HB2) 3.370 1.420 1.420 weight 1.000 ! spec=15Nnoesy, no=71, id=2538, vol=7.215000e+03
assign (segid "   B" and resid   79 and name   HN) (segid "   B" and resid   78 and name  HB2) 3.370 1.420 1.420 weight 1.000 ! spec=15Nnoesy, no=71, id=2538, vol=7.215000e+03
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   79 and name  HD1) 4.210 2.215 2.215 weight 1.000 ! spec=15Nnoesy, no=72, id=2539, vol=5.424000e+03
assign (segid "   B" and resid   79 and name   HN) (segid "   B" and resid   79 and name  HD1) 4.210 2.215 2.215 weight 1.000 ! spec=15Nnoesy, no=72, id=2539, vol=5.424000e+03
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name  HB2) 3.248 1.319 1.319 weight 1.000 ! spec=15Nnoesy, no=75, id=2540, vol=4.176000e+03
assign (segid "   B" and resid   78 and name   HN) (segid "   B" and resid   78 and name  HB2) 3.248 1.319 1.319 weight 1.000 ! spec=15Nnoesy, no=75, id=2540, vol=4.176000e+03
assign (segid "   A" and resid   65 and name  HG2) (segid "   A" and resid   65 and name   HN) 3.708 1.718 1.718 weight 1.000 ! spec=15Nnoesy, no=88, id=2542, vol=6.990000e+03
assign (segid "   B" and resid   65 and name  HG2) (segid "   B" and resid   65 and name   HN) 3.708 1.718 1.718 weight 1.000 ! spec=15Nnoesy, no=88, id=2542, vol=6.990000e+03
assign (segid "   A" and resid   65 and name  HB2) (segid "   A" and resid   65 and name   HN) 2.769 0.959 0.959 weight 1.000 ! spec=15Nnoesy, no=89, id=2543, vol=1.130000e+04
assign (segid "   B" and resid   65 and name  HB2) (segid "   B" and resid   65 and name   HN) 2.769 0.959 0.959 weight 1.000 ! spec=15Nnoesy, no=89, id=2543, vol=1.130000e+04
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name  HD1) 5.076 3.221 3.221 weight 1.000 ! spec=15Nnoesy, no=92, id=2544, vol=6.420000e+03
assign (segid "   B" and resid   54 and name   HN) (segid "   B" and resid   53 and name  HD1) 5.076 3.221 3.221 weight 1.000 ! spec=15Nnoesy, no=92, id=2544, vol=6.420000e+03
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name  HD1) 3.582 1.603 1.603 weight 1.000 ! spec=15Nnoesy, no=96, id=2546, vol=1.189000e+04
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   53 and name  HD1) 3.582 1.603 1.603 weight 1.000 ! spec=15Nnoesy, no=96, id=2546, vol=1.189000e+04
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name   HZ) 4.227 2.233 2.233 weight 1.000 ! spec=15Nnoesy, no=103, id=2547, vol=3.801000e+03
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   53 and name   HZ) 4.227 2.233 2.233 weight 1.000 ! spec=15Nnoesy, no=103, id=2547, vol=3.801000e+03
assign (segid "   A" and resid   51 and name HE22) (segid "   A" and resid   51 and name  HB2) 5.646 3.985 3.985 weight 1.000 ! spec=15Nnoesy, no=104, id=2548, vol=3.094000e+03
assign (segid "   B" and resid   51 and name HE22) (segid "   B" and resid   51 and name  HB2) 5.646 3.985 3.985 weight 1.000 ! spec=15Nnoesy, no=104, id=2548, vol=3.094000e+03
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name  HD1) 4.954 3.068 3.068 weight 1.000 ! spec=15Nnoesy, no=110, id=2550, vol=5.825000e+03
assign (segid "   B" and resid   50 and name   HN) (segid "   B" and resid   49 and name  HD1) 4.954 3.068 3.068 weight 1.000 ! spec=15Nnoesy, no=110, id=2550, vol=5.825000e+03
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD21) 3.528 1.556 1.556 weight 1.000 ! spec=15Nnoesy, no=127, id=2552, vol=1.718000e+04
assign (segid "   B" and resid   46 and name  HB2) (segid "   B" and resid   46 and name HD21) 3.528 1.556 1.556 weight 1.000 ! spec=15Nnoesy, no=127, id=2552, vol=1.718000e+04
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD22) 4.384 2.403 2.403 weight 1.000 ! spec=15Nnoesy, no=128, id=2553, vol=1.335000e+04
assign (segid "   B" and resid   46 and name  HB2) (segid "   B" and resid   46 and name HD22) 4.384 2.403 2.403 weight 1.000 ! spec=15Nnoesy, no=128, id=2553, vol=1.335000e+04
assign (segid "   A" and resid   41 and name  HG2) (segid "   A" and resid   41 and name   HN) 2.458 0.755 0.755 weight 1.000 ! spec=15Nnoesy, no=140, id=2554, vol=2.185000e+04
assign (segid "   B" and resid   41 and name  HG2) (segid "   B" and resid   41 and name   HN) 2.458 0.755 0.755 weight 1.000 ! spec=15Nnoesy, no=140, id=2554, vol=2.185000e+04
assign (segid "   A" and resid   34 and name  HD2) (segid "   A" and resid   34 and name   HN) 2.913 1.061 1.061 weight 1.000 ! spec=15Nnoesy, no=146, id=2556, vol=2.558000e+04
assign (segid "   B" and resid   34 and name  HD2) (segid "   B" and resid   34 and name   HN) 2.913 1.061 1.061 weight 1.000 ! spec=15Nnoesy, no=146, id=2556, vol=2.558000e+04
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name  HD1) 4.130 2.132 2.132 weight 1.000 ! spec=15Nnoesy, no=153, id=2559, vol=7.204000e+03
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   12 and name  HD1) 4.130 2.132 2.132 weight 1.000 ! spec=15Nnoesy, no=153, id=2559, vol=7.204000e+03
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name  HE1) 4.307 2.318 2.318 weight 1.000 ! spec=15Nnoesy, no=154, id=2560, vol=7.204000e+03
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   12 and name  HE1) 4.307 2.318 2.318 weight 1.000 ! spec=15Nnoesy, no=154, id=2560, vol=7.204000e+03
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.661 0.885 0.885 weight 1.000 ! spec=15Nnoesy, no=157, id=2561, vol=1.691000e+04
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   11 and name  HB2) 2.661 0.885 0.885 weight 1.000 ! spec=15Nnoesy, no=157, id=2561, vol=1.691000e+04
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HD1) 4.263 2.272 2.272 weight 1.000 ! spec=15Nnoesy, no=162, id=2562, vol=6.516000e+03
assign (segid "   B" and resid    7 and name   HN) (segid "   B" and resid    7 and name  HD1) 4.263 2.272 2.272 weight 1.000 ! spec=15Nnoesy, no=162, id=2562, vol=6.516000e+03
assign (segid "   A" and resid  104 and name HG22) (segid "   A" and resid  105 and name   HN) 3.643 1.659 1.659 weight 1.000 ! spec=15Nnoesy, no=178, id=2565, vol=1.194000e+04
    or (segid "   A" and resid  104 and name HG21) (segid "   A" and resid  105 and name   HN)
    or (segid "   A" and resid  104 and name HG23) (segid "   A" and resid  105 and name   HN)
assign (segid "   B" and resid  104 and name HG22) (segid "   B" and resid  105 and name   HN) 3.643 1.659 1.659 weight 1.000 ! spec=15Nnoesy, no=178, id=2565, vol=1.194000e+04
    or (segid "   B" and resid  104 and name HG21) (segid "   B" and resid  105 and name   HN)
    or (segid "   B" and resid  104 and name HG23) (segid "   B" and resid  105 and name   HN)
assign (segid "   A" and resid  105 and name   HN) (segid "   A" and resid   55 and name  HG1) 4.690 2.750 2.750 weight 1.000 ! spec=15Nnoesy, no=179, id=2566, vol=6.259000e+03
assign (segid "   B" and resid  105 and name   HN) (segid "   B" and resid   55 and name  HG1) 4.690 2.750 2.750 weight 1.000 ! spec=15Nnoesy, no=179, id=2566, vol=6.259000e+03
assign (segid "   A" and resid  104 and name   HA) (segid "   A" and resid  105 and name   HN) 2.556 0.817 0.817 weight 1.000 ! spec=15Nnoesy, no=181, id=2568, vol=2.166000e+04
assign (segid "   B" and resid  104 and name   HA) (segid "   B" and resid  105 and name   HN) 2.556 0.817 0.817 weight 1.000 ! spec=15Nnoesy, no=181, id=2568, vol=2.166000e+04
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   70 and name  HA2) 4.079 2.080 2.080 weight 1.000 ! spec=15Nnoesy, no=183, id=2570, vol=4.517000e+03
assign (segid "   B" and resid   71 and name   HN) (segid "   B" and resid   70 and name  HA2) 4.079 2.080 2.080 weight 1.000 ! spec=15Nnoesy, no=183, id=2570, vol=4.517000e+03
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   72 and name   HN) 4.276 2.286 2.286 weight 1.000 ! spec=15Nnoesy, no=185, id=2572, vol=5.536000e+03
assign (segid "   B" and resid   71 and name   HN) (segid "   B" and resid   72 and name   HN) 4.276 2.286 2.286 weight 1.000 ! spec=15Nnoesy, no=185, id=2572, vol=5.536000e+03
assign (segid "   A" and resid   71 and name HG22) (segid "   A" and resid   71 and name   HN) 3.380 1.428 1.428 weight 1.000 ! spec=15Nnoesy, no=186, id=2573, vol=1.495000e+04
    or (segid "   A" and resid   71 and name HG21) (segid "   A" and resid   71 and name   HN)
    or (segid "   A" and resid   71 and name HG23) (segid "   A" and resid   71 and name   HN)
assign (segid "   B" and resid   71 and name HG22) (segid "   B" and resid   71 and name   HN) 3.380 1.428 1.428 weight 1.000 ! spec=15Nnoesy, no=186, id=2573, vol=1.495000e+04
    or (segid "   B" and resid   71 and name HG21) (segid "   B" and resid   71 and name   HN)
    or (segid "   B" and resid   71 and name HG23) (segid "   B" and resid   71 and name   HN)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   21 and name   HN) 5.018 3.148 3.148 weight 1.000 ! spec=15Nnoesy, no=191, id=2578, vol=3.134000e+03
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   21 and name   HN) 5.018 3.148 3.148 weight 1.000 ! spec=15Nnoesy, no=191, id=2578, vol=3.134000e+03
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   53 and name   HN) 3.429 1.470 1.470 weight 1.000 ! spec=15Nnoesy, no=194, id=2581, vol=4.227000e+03
assign (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   53 and name   HN) 3.429 1.470 1.470 weight 1.000 ! spec=15Nnoesy, no=194, id=2581, vol=4.227000e+03
assign (segid "   A" and resid   22 and name HG12) (segid "   A" and resid   53 and name   HN) 3.822 1.826 1.826 weight 1.000 ! spec=15Nnoesy, no=196, id=2582, vol=6.066000e+03
    or (segid "   A" and resid   22 and name HG11) (segid "   A" and resid   53 and name   HN)
    or (segid "   A" and resid   22 and name HG13) (segid "   A" and resid   53 and name   HN)
assign (segid "   B" and resid   22 and name HG12) (segid "   B" and resid   53 and name   HN) 3.822 1.826 1.826 weight 1.000 ! spec=15Nnoesy, no=196, id=2582, vol=6.066000e+03
    or (segid "   B" and resid   22 and name HG11) (segid "   B" and resid   53 and name   HN)
    or (segid "   B" and resid   22 and name HG13) (segid "   B" and resid   53 and name   HN)
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name   HN) 2.793 0.975 0.975 weight 1.000 ! spec=15Nnoesy, no=197, id=2583, vol=8.408000e+03
assign (segid "   B" and resid   53 and name  HB1) (segid "   B" and resid   53 and name   HN) 2.793 0.975 0.975 weight 1.000 ! spec=15Nnoesy, no=197, id=2583, vol=8.408000e+03
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   23 and name  HA2) 4.892 2.991 2.991 weight 1.000 ! spec=15Nnoesy, no=198, id=2584, vol=4.386000e+03
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   23 and name  HA2) 4.892 2.991 2.991 weight 1.000 ! spec=15Nnoesy, no=198, id=2584, vol=4.386000e+03
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   18 and name   HN) 2.977 2.977 3.023 weight 1.000 ! spec=15Nnoesy, no=207, id=2593, vol=5.785000e+03
assign (segid "   B" and resid   57 and name   HA) (segid "   B" and resid   18 and name   HN) 2.977 2.977 3.023 weight 1.000 ! spec=15Nnoesy, no=207, id=2593, vol=5.785000e+03
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   58 and name   HA) 3.855 1.858 1.858 weight 1.000 ! spec=15Nnoesy, no=208, id=2594, vol=6.685000e+03
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   58 and name   HA) 3.855 1.858 1.858 weight 1.000 ! spec=15Nnoesy, no=208, id=2594, vol=6.685000e+03
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name   HN) 2.931 1.074 1.074 weight 1.000 ! spec=15Nnoesy, no=210, id=2595, vol=7.499000e+03
assign (segid "   B" and resid   18 and name   HA) (segid "   B" and resid   18 and name   HN) 2.931 1.074 1.074 weight 1.000 ! spec=15Nnoesy, no=210, id=2595, vol=7.499000e+03
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   18 and name   HN) 3.024 1.143 1.143 weight 1.000 ! spec=15Nnoesy, no=212, id=2597, vol=1.284000e+04
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   18 and name   HN)
assign (segid "   B" and resid   18 and name HG22) (segid "   B" and resid   18 and name   HN) 3.024 1.143 1.143 weight 1.000 ! spec=15Nnoesy, no=212, id=2597, vol=1.284000e+04
    or (segid "   B" and resid   18 and name HG21) (segid "   B" and resid   18 and name   HN)
    or (segid "   B" and resid   18 and name HG23) (segid "   B" and resid   18 and name   HN)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   57 and name  HB2) 3.217 1.294 1.294 weight 1.000 ! spec=15Nnoesy, no=213, id=2598, vol=6.934000e+03
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   57 and name  HB2) 3.217 1.294 1.294 weight 1.000 ! spec=15Nnoesy, no=213, id=2598, vol=6.934000e+03
assign (segid "   A" and resid   56 and name HG21) (segid "   A" and resid   18 and name   HN) 2.637 0.869 0.869 weight 1.000 ! spec=15Nnoesy, no=215, id=2599, vol=1.752000e+04
    or (segid "   A" and resid   56 and name HG22) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   56 and name HG23) (segid "   A" and resid   18 and name   HN)
assign (segid "   B" and resid   56 and name HG21) (segid "   B" and resid   18 and name   HN) 2.637 0.869 0.869 weight 1.000 ! spec=15Nnoesy, no=215, id=2599, vol=1.752000e+04
    or (segid "   B" and resid   56 and name HG22) (segid "   B" and resid   18 and name   HN)
    or (segid "   B" and resid   56 and name HG23) (segid "   B" and resid   18 and name   HN)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   59 and name  HB1) 3.808 1.813 1.813 weight 1.000 ! spec=15Nnoesy, no=216, id=2600, vol=5.255000e+03
assign (segid "   B" and resid   18 and name   HN) (segid "   B" and resid   59 and name  HB1) 3.808 1.813 1.813 weight 1.000 ! spec=15Nnoesy, no=216, id=2600, vol=5.255000e+03
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name   HN) 3.074 1.181 1.181 weight 1.000 ! spec=15Nnoesy, no=218, id=2601, vol=7.704000e+03
assign (segid "   B" and resid   21 and name   HA) (segid "   B" and resid   21 and name   HN) 3.074 1.181 1.181 weight 1.000 ! spec=15Nnoesy, no=218, id=2601, vol=7.704000e+03
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   21 and name   HN) 3.303 3.303 2.697 weight 1.000 ! spec=15Nnoesy, no=219, id=2602, vol=1.970000e+04
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   21 and name   HN) 3.303 3.303 2.697 weight 1.000 ! spec=15Nnoesy, no=219, id=2602, vol=1.970000e+04
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name   HN) 3.582 1.603 1.603 weight 1.000 ! spec=15Nnoesy, no=222, id=2604, vol=1.359000e+04
assign (segid "   B" and resid   21 and name  HB2) (segid "   B" and resid   21 and name   HN) 3.582 1.603 1.603 weight 1.000 ! spec=15Nnoesy, no=222, id=2604, vol=1.359000e+04
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HD1) 3.608 1.627 1.627 weight 1.000 ! spec=15Nnoesy, no=226, id=2608, vol=5.865000e+03
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   21 and name  HD1) 3.608 1.627 1.627 weight 1.000 ! spec=15Nnoesy, no=226, id=2608, vol=5.865000e+03
assign (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   21 and name   HN) 3.173 1.259 1.259 weight 1.000 ! spec=15Nnoesy, no=227, id=2609, vol=2.156000e+04
    or (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   21 and name   HN)
assign (segid "   B" and resid   20 and name HG22) (segid "   B" and resid   21 and name   HN) 3.173 1.259 1.259 weight 1.000 ! spec=15Nnoesy, no=227, id=2609, vol=2.156000e+04
    or (segid "   B" and resid   20 and name HG21) (segid "   B" and resid   21 and name   HN)
    or (segid "   B" and resid   20 and name HG23) (segid "   B" and resid   21 and name   HN)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   63 and name  HG2) 3.020 1.140 1.140 weight 1.000 ! spec=15Nnoesy, no=228, id=2610, vol=6.516000e+03
assign (segid "   B" and resid   69 and name   HN) (segid "   B" and resid   63 and name  HG2) 3.020 1.140 1.140 weight 1.000 ! spec=15Nnoesy, no=228, id=2610, vol=6.516000e+03
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name  HB2) 2.724 0.927 0.927 weight 1.000 ! spec=15Nnoesy, no=229, id=2611, vol=8.079000e+03
assign (segid "   B" and resid   69 and name   HN) (segid "   B" and resid   69 and name  HB2) 2.724 0.927 0.927 weight 1.000 ! spec=15Nnoesy, no=229, id=2611, vol=8.079000e+03
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   69 and name   HN) 3.630 1.647 1.647 weight 1.000 ! spec=15Nnoesy, no=231, id=2612, vol=5.520000e+03
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   69 and name   HN)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   69 and name   HN)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   69 and name   HN) 3.630 1.647 1.647 weight 1.000 ! spec=15Nnoesy, no=231, id=2612, vol=5.520000e+03
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   69 and name   HN)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   69 and name   HN)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name  HB1) 3.690 1.702 1.702 weight 1.000 ! spec=15Nnoesy, no=232, id=2613, vol=3.829000e+03
assign (segid "   B" and resid   69 and name   HN) (segid "   B" and resid   69 and name  HB1) 3.690 1.702 1.702 weight 1.000 ! spec=15Nnoesy, no=232, id=2613, vol=3.829000e+03
assign (segid "   A" and resid   69 and name  HD1) (segid "   A" and resid   69 and name   HN) 4.874 2.970 2.970 weight 1.000 ! spec=15Nnoesy, no=233, id=2614, vol=3.194000e+03
assign (segid "   B" and resid   69 and name  HD1) (segid "   B" and resid   69 and name   HN) 4.874 2.970 2.970 weight 1.000 ! spec=15Nnoesy, no=233, id=2614, vol=3.194000e+03
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name   HN) 3.155 1.244 1.244 weight 1.000 ! spec=15Nnoesy, no=235, id=2616, vol=4.932000e+03
assign (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   69 and name   HN) 3.155 1.244 1.244 weight 1.000 ! spec=15Nnoesy, no=235, id=2616, vol=4.932000e+03
assign (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   69 and name   HN) 3.438 1.478 1.478 weight 1.000 ! spec=15Nnoesy, no=236, id=2617, vol=3.058000e+03
    or (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   69 and name   HN)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   69 and name   HN)
assign (segid "   B" and resid   64 and name HG22) (segid "   B" and resid   69 and name   HN) 3.438 1.478 1.478 weight 1.000 ! spec=15Nnoesy, no=236, id=2617, vol=3.058000e+03
    or (segid "   B" and resid   64 and name HG21) (segid "   B" and resid   69 and name   HN)
    or (segid "   B" and resid   64 and name HG23) (segid "   B" and resid   69 and name   HN)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name  HG2) 3.538 1.565 1.565 weight 1.000 ! spec=15Nnoesy, no=237, id=2618, vol=8.477000e+03
assign (segid "   B" and resid   69 and name   HN) (segid "   B" and resid   69 and name  HG2) 3.538 1.565 1.565 weight 1.000 ! spec=15Nnoesy, no=237, id=2618, vol=8.477000e+03
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name  HG1) 3.306 1.366 1.366 weight 1.000 ! spec=15Nnoesy, no=238, id=2619, vol=3.291000e+03
assign (segid "   B" and resid   69 and name   HN) (segid "   B" and resid   69 and name  HG1) 3.306 1.366 1.366 weight 1.000 ! spec=15Nnoesy, no=238, id=2619, vol=3.291000e+03
assign (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name HD21) 4.395 2.414 2.414 weight 1.000 ! spec=15Nnoesy, no=240, id=2621, vol=6.757000e+03
assign (segid "   B" and resid   62 and name  HB1) (segid "   B" and resid   62 and name HD21) 4.395 2.414 2.414 weight 1.000 ! spec=15Nnoesy, no=240, id=2621, vol=6.757000e+03
assign (segid "   A" and resid   62 and name HD21) (segid "   A" and resid   67 and name   HN) 4.404 2.425 2.425 weight 1.000 ! spec=15Nnoesy, no=241, id=2622, vol=7.295000e+03
assign (segid "   B" and resid   62 and name HD21) (segid "   B" and resid   67 and name   HN) 4.404 2.425 2.425 weight 1.000 ! spec=15Nnoesy, no=241, id=2622, vol=7.295000e+03
assign (segid "   A" and resid   62 and name HD21) (segid "   A" and resid   79 and name   HA) 2.397 0.718 0.718 weight 1.000 ! spec=15Nnoesy, no=242, id=2623, vol=2.179000e+04
assign (segid "   B" and resid   62 and name HD21) (segid "   B" and resid   79 and name   HA) 2.397 0.718 0.718 weight 1.000 ! spec=15Nnoesy, no=242, id=2623, vol=2.179000e+04
assign (segid "   A" and resid   92 and name HG21) (segid "   A" and resid   93 and name   HN) 4.108 2.109 2.109 weight 1.000 ! spec=15Nnoesy, no=246, id=2626, vol=5.825000e+03
    or (segid "   A" and resid   92 and name HG22) (segid "   A" and resid   93 and name   HN)
    or (segid "   A" and resid   92 and name HG23) (segid "   A" and resid   93 and name   HN)
assign (segid "   B" and resid   92 and name HG21) (segid "   B" and resid   93 and name   HN) 4.108 2.109 2.109 weight 1.000 ! spec=15Nnoesy, no=246, id=2626, vol=5.825000e+03
    or (segid "   B" and resid   92 and name HG22) (segid "   B" and resid   93 and name   HN)
    or (segid "   B" and resid   92 and name HG23) (segid "   B" and resid   93 and name   HN)
assign (segid "   A" and resid   93 and name   HN) (segid "   A" and resid   92 and name   HN) 3.840 1.843 1.843 weight 1.000 ! spec=15Nnoesy, no=248, id=2628, vol=6.106000e+03
assign (segid "   B" and resid   93 and name   HN) (segid "   B" and resid   92 and name   HN) 3.840 1.843 1.843 weight 1.000 ! spec=15Nnoesy, no=248, id=2628, vol=6.106000e+03
assign (segid "   A" and resid   36 and name HG22) (segid "   A" and resid   93 and name   HN) 4.324 2.337 2.337 weight 1.000 ! spec=15Nnoesy, no=250, id=2630, vol=3.383000e+03
    or (segid "   A" and resid   36 and name HG21) (segid "   A" and resid   93 and name   HN)
    or (segid "   A" and resid   36 and name HG23) (segid "   A" and resid   93 and name   HN)
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   93 and name   HN) 4.324 2.337 2.337 weight 1.000 ! spec=15Nnoesy, no=250, id=2630, vol=3.383000e+03
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   93 and name   HN)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   93 and name   HN)
assign (segid "   A" and resid   96 and name HE21) (segid "   A" and resid   96 and name HE22) 1.422 0.253 0.253 weight 1.000 ! spec=15Nnoesy, no=259, id=2631, vol=2.165000e+05
assign (segid "   B" and resid   96 and name HE21) (segid "   B" and resid   96 and name HE22) 1.422 0.253 0.253 weight 1.000 ! spec=15Nnoesy, no=259, id=2631, vol=2.165000e+05
assign (segid "   A" and resid   96 and name HE21) (segid "   A" and resid   96 and name  HB2) 4.752 2.823 2.823 weight 1.000 ! spec=15Nnoesy, no=260, id=2632, vol=5.560000e+03
assign (segid "   B" and resid   96 and name HE21) (segid "   B" and resid   96 and name  HB2) 4.752 2.823 2.823 weight 1.000 ! spec=15Nnoesy, no=260, id=2632, vol=5.560000e+03
assign (segid "   A" and resid   96 and name HE21) (segid "   A" and resid   96 and name  HB1) 4.482 2.511 2.511 weight 1.000 ! spec=15Nnoesy, no=261, id=2633, vol=7.068000e+03
assign (segid "   B" and resid   96 and name HE21) (segid "   B" and resid   96 and name  HB1) 4.482 2.511 2.511 weight 1.000 ! spec=15Nnoesy, no=261, id=2633, vol=7.068000e+03
assign (segid "   A" and resid   26 and name   HB) (segid "   A" and resid   27 and name   HN) 3.627 1.644 1.644 weight 1.000 ! spec=15Nnoesy, no=263, id=2635, vol=1.175000e+04
assign (segid "   B" and resid   26 and name   HB) (segid "   B" and resid   27 and name   HN) 3.627 1.644 1.644 weight 1.000 ! spec=15Nnoesy, no=263, id=2635, vol=1.175000e+04
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   38 and name   HN) 3.392 1.439 1.439 weight 1.000 ! spec=15Nnoesy, no=264, id=2636, vol=6.315000e+03
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   38 and name   HN) 3.392 1.439 1.439 weight 1.000 ! spec=15Nnoesy, no=264, id=2636, vol=6.315000e+03
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name   HN) 2.217 0.614 0.614 weight 1.000 ! spec=15Nnoesy, no=265, id=2637, vol=2.813000e+04
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   26 and name   HN) 2.217 0.614 0.614 weight 1.000 ! spec=15Nnoesy, no=265, id=2637, vol=2.813000e+04
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   27 and name   HN) 3.349 1.402 1.402 weight 1.000 ! spec=15Nnoesy, no=267, id=2639, vol=1.157000e+04
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   27 and name   HN) 3.349 1.402 1.402 weight 1.000 ! spec=15Nnoesy, no=267, id=2639, vol=1.157000e+04
assign (segid "   A" and resid   27 and name HG21) (segid "   A" and resid   27 and name   HN) 2.571 0.826 0.826 weight 1.000 ! spec=15Nnoesy, no=268, id=2640, vol=3.054000e+04
    or (segid "   A" and resid   27 and name HG22) (segid "   A" and resid   27 and name   HN)
    or (segid "   A" and resid   27 and name HG23) (segid "   A" and resid   27 and name   HN)
assign (segid "   B" and resid   27 and name HG21) (segid "   B" and resid   27 and name   HN) 2.571 0.826 0.826 weight 1.000 ! spec=15Nnoesy, no=268, id=2640, vol=3.054000e+04
    or (segid "   B" and resid   27 and name HG22) (segid "   B" and resid   27 and name   HN)
    or (segid "   B" and resid   27 and name HG23) (segid "   B" and resid   27 and name   HN)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   28 and name   HN) 3.974 1.974 1.974 weight 1.000 ! spec=15Nnoesy, no=270, id=2642, vol=6.203000e+03
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   28 and name   HN) 3.974 1.974 1.974 weight 1.000 ! spec=15Nnoesy, no=270, id=2642, vol=6.203000e+03
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   25 and name  HG2) 3.024 1.143 1.143 weight 1.000 ! spec=15Nnoesy, no=271, id=2643, vol=5.986000e+03
assign (segid "   B" and resid   27 and name   HN) (segid "   B" and resid   25 and name  HG2) 3.024 1.143 1.143 weight 1.000 ! spec=15Nnoesy, no=271, id=2643, vol=5.986000e+03
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   27 and name   HN) 3.297 1.359 1.359 weight 1.000 ! spec=15Nnoesy, no=273, id=2645, vol=5.970000e+03
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   27 and name   HN)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   27 and name   HN)
assign (segid "   B" and resid   38 and name HG22) (segid "   B" and resid   27 and name   HN) 3.297 1.359 1.359 weight 1.000 ! spec=15Nnoesy, no=273, id=2645, vol=5.970000e+03
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid   27 and name   HN)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid   27 and name   HN)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   17 and name  HB1) 3.527 1.555 1.555 weight 1.000 ! spec=15Nnoesy, no=276, id=2648, vol=4.795000e+03
assign (segid "   B" and resid   57 and name   HN) (segid "   B" and resid   17 and name  HB1) 3.527 1.555 1.555 weight 1.000 ! spec=15Nnoesy, no=276, id=2648, vol=4.795000e+03
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name   HN) 3.393 1.439 1.439 weight 1.000 ! spec=15Nnoesy, no=278, id=2650, vol=8.011000e+03
assign (segid "   B" and resid   57 and name  HB1) (segid "   B" and resid   57 and name   HN) 3.393 1.439 1.439 weight 1.000 ! spec=15Nnoesy, no=278, id=2650, vol=8.011000e+03
assign (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   57 and name   HN) 3.187 1.270 1.270 weight 1.000 ! spec=15Nnoesy, no=280, id=2652, vol=5.070000e+03
assign (segid "   B" and resid   57 and name  HG1) (segid "   B" and resid   57 and name   HN) 3.187 1.270 1.270 weight 1.000 ! spec=15Nnoesy, no=280, id=2652, vol=5.070000e+03
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name   HN) 2.653 0.880 0.880 weight 1.000 ! spec=15Nnoesy, no=284, id=2655, vol=6.372000e+03
assign (segid "   B" and resid   57 and name  HB2) (segid "   B" and resid   57 and name   HN) 2.653 0.880 0.880 weight 1.000 ! spec=15Nnoesy, no=284, id=2655, vol=6.372000e+03
assign (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   57 and name   HN) 3.934 1.934 1.934 weight 1.000 ! spec=15Nnoesy, no=285, id=2656, vol=8.011000e+03
assign (segid "   B" and resid   57 and name  HD2) (segid "   B" and resid   57 and name   HN) 3.934 1.934 1.934 weight 1.000 ! spec=15Nnoesy, no=285, id=2656, vol=8.011000e+03
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   32 and name   HN) 3.206 1.285 1.285 weight 1.000 ! spec=15Nnoesy, no=288, id=2658, vol=5.319000e+03
assign (segid "   B" and resid   31 and name   HA) (segid "   B" and resid   32 and name   HN) 3.206 1.285 1.285 weight 1.000 ! spec=15Nnoesy, no=288, id=2658, vol=5.319000e+03
assign (segid "   A" and resid   65 and name   HA) (segid "   A" and resid   65 and name   HN) 3.247 1.318 1.318 weight 1.000 ! spec=15Nnoesy, no=297, id=2666, vol=6.797000e+03
assign (segid "   B" and resid   65 and name   HA) (segid "   B" and resid   65 and name   HN) 3.247 1.318 1.318 weight 1.000 ! spec=15Nnoesy, no=297, id=2666, vol=6.797000e+03
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   65 and name   HN) 2.452 0.752 0.752 weight 1.000 ! spec=15Nnoesy, no=298, id=2667, vol=1.114000e+04
assign (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   65 and name   HN) 2.452 0.752 0.752 weight 1.000 ! spec=15Nnoesy, no=298, id=2667, vol=1.114000e+04
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   65 and name   HN) 3.468 1.503 1.503 weight 1.000 ! spec=15Nnoesy, no=301, id=2669, vol=4.403000e+03
assign (segid "   B" and resid   64 and name   HA) (segid "   B" and resid   65 and name   HN) 3.468 1.503 1.503 weight 1.000 ! spec=15Nnoesy, no=301, id=2669, vol=4.403000e+03
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   73 and name   HN) 3.700 1.711 1.711 weight 1.000 ! spec=15Nnoesy, no=302, id=2670, vol=7.261000e+03
assign (segid "   B" and resid   73 and name  HB2) (segid "   B" and resid   73 and name   HN) 3.700 1.711 1.711 weight 1.000 ! spec=15Nnoesy, no=302, id=2670, vol=7.261000e+03
assign (segid "   A" and resid   73 and name  HB1) (segid "   A" and resid   73 and name   HN) 2.822 0.995 0.995 weight 1.000 ! spec=15Nnoesy, no=303, id=2671, vol=1.186000e+04
assign (segid "   B" and resid   73 and name  HB1) (segid "   B" and resid   73 and name   HN) 2.822 0.995 0.995 weight 1.000 ! spec=15Nnoesy, no=303, id=2671, vol=1.186000e+04
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   72 and name   HN) 3.685 1.698 1.698 weight 1.000 ! spec=15Nnoesy, no=304, id=2672, vol=5.938000e+03
assign (segid "   B" and resid   73 and name   HN) (segid "   B" and resid   72 and name   HN) 3.685 1.698 1.698 weight 1.000 ! spec=15Nnoesy, no=304, id=2672, vol=5.938000e+03
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   74 and name   HN) 2.727 0.930 0.930 weight 1.000 ! spec=15Nnoesy, no=305, id=2673, vol=1.171000e+04
assign (segid "   B" and resid   73 and name   HN) (segid "   B" and resid   74 and name   HN) 2.727 0.930 0.930 weight 1.000 ! spec=15Nnoesy, no=305, id=2673, vol=1.171000e+04
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   76 and name  HB1) 3.170 1.256 1.256 weight 1.000 ! spec=15Nnoesy, no=306, id=2674, vol=8.249000e+03
assign (segid "   B" and resid   73 and name   HN) (segid "   B" and resid   76 and name  HB1) 3.170 1.256 1.256 weight 1.000 ! spec=15Nnoesy, no=306, id=2674, vol=8.249000e+03
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   73 and name   HN) 2.344 0.687 0.687 weight 1.000 ! spec=15Nnoesy, no=307, id=2675, vol=3.195000e+04
assign (segid "   B" and resid   72 and name   HA) (segid "   B" and resid   73 and name   HN) 2.344 0.687 0.687 weight 1.000 ! spec=15Nnoesy, no=307, id=2675, vol=3.195000e+04
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   73 and name   HA) 2.695 0.908 0.908 weight 1.000 ! spec=15Nnoesy, no=309, id=2677, vol=2.327000e+04
assign (segid "   B" and resid   73 and name   HN) (segid "   B" and resid   73 and name   HA) 2.695 0.908 0.908 weight 1.000 ! spec=15Nnoesy, no=309, id=2677, vol=2.327000e+04
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   63 and name  HG2) 4.723 2.788 2.788 weight 1.000 ! spec=15Nnoesy, no=311, id=2679, vol=6.203000e+03
assign (segid "   B" and resid   62 and name   HN) (segid "   B" and resid   63 and name  HG2) 4.723 2.788 2.788 weight 1.000 ! spec=15Nnoesy, no=311, id=2679, vol=6.203000e+03
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name  HB1) 3.541 1.568 1.568 weight 1.000 ! spec=15Nnoesy, no=312, id=2680, vol=5.568000e+03
assign (segid "   B" and resid   62 and name   HN) (segid "   B" and resid   62 and name  HB1) 3.541 1.568 1.568 weight 1.000 ! spec=15Nnoesy, no=312, id=2680, vol=5.568000e+03
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name   HN) 3.257 1.326 1.326 weight 1.000 ! spec=15Nnoesy, no=313, id=2681, vol=3.710000e+03
assign (segid "   B" and resid   62 and name   HA) (segid "   B" and resid   62 and name   HN) 3.257 1.326 1.326 weight 1.000 ! spec=15Nnoesy, no=313, id=2681, vol=3.710000e+03
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   22 and name   HN) 3.029 1.147 1.147 weight 1.000 ! spec=15Nnoesy, no=318, id=2684, vol=6.452000e+03
assign (segid "   B" and resid   53 and name   HN) (segid "   B" and resid   22 and name   HN) 3.029 1.147 1.147 weight 1.000 ! spec=15Nnoesy, no=318, id=2684, vol=6.452000e+03
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   22 and name   HN) 3.850 1.853 1.853 weight 1.000 ! spec=15Nnoesy, no=323, id=2688, vol=5.857000e+03
assign (segid "   B" and resid   54 and name   HA) (segid "   B" and resid   22 and name   HN) 3.850 1.853 1.853 weight 1.000 ! spec=15Nnoesy, no=323, id=2688, vol=5.857000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   54 and name   HN) 4.496 2.527 2.527 weight 1.000 ! spec=15Nnoesy, no=324, id=2689, vol=3.186000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   54 and name   HN) 4.496 2.527 2.527 weight 1.000 ! spec=15Nnoesy, no=324, id=2689, vol=3.186000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HB2) 4.038 2.038 2.038 weight 1.000 ! spec=15Nnoesy, no=325, id=2690, vol=5.962000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   21 and name  HB2) 4.038 2.038 2.038 weight 1.000 ! spec=15Nnoesy, no=325, id=2690, vol=5.962000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name   HA) 3.051 1.164 1.164 weight 1.000 ! spec=15Nnoesy, no=326, id=2691, vol=6.123000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   22 and name   HA) 3.051 1.164 1.164 weight 1.000 ! spec=15Nnoesy, no=326, id=2691, vol=6.123000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HE3) 4.760 2.832 2.832 weight 1.000 ! spec=15Nnoesy, no=328, id=2693, vol=3.142000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   21 and name  HE3) 4.760 2.832 2.832 weight 1.000 ! spec=15Nnoesy, no=328, id=2693, vol=3.142000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   53 and name  HB1) 3.222 1.298 1.298 weight 1.000 ! spec=15Nnoesy, no=329, id=2694, vol=6.002000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   53 and name  HB1) 3.222 1.298 1.298 weight 1.000 ! spec=15Nnoesy, no=329, id=2694, vol=6.002000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   23 and name   HN) 4.377 2.395 2.395 weight 1.000 ! spec=15Nnoesy, no=330, id=2695, vol=4.369000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   23 and name   HN) 4.377 2.395 2.395 weight 1.000 ! spec=15Nnoesy, no=330, id=2695, vol=4.369000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   55 and name  HG1) 3.308 1.368 1.368 weight 1.000 ! spec=15Nnoesy, no=331, id=2696, vol=4.193000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   55 and name  HG1) 3.308 1.368 1.368 weight 1.000 ! spec=15Nnoesy, no=331, id=2696, vol=4.193000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   53 and name  HB2) 4.426 2.449 2.449 weight 1.000 ! spec=15Nnoesy, no=332, id=2697, vol=5.962000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   53 and name  HB2) 4.426 2.449 2.449 weight 1.000 ! spec=15Nnoesy, no=332, id=2697, vol=5.962000e+03
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   55 and name   HN) 3.805 1.810 1.810 weight 1.000 ! spec=15Nnoesy, no=334, id=2699, vol=5.496000e+03
assign (segid "   B" and resid   22 and name   HN) (segid "   B" and resid   55 and name   HN) 3.805 1.810 1.810 weight 1.000 ! spec=15Nnoesy, no=334, id=2699, vol=5.496000e+03
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name   HA) 2.616 0.856 0.856 weight 1.000 ! spec=15Nnoesy, no=341, id=2703, vol=1.629000e+04
assign (segid "   B" and resid   84 and name   HN) (segid "   B" and resid   83 and name   HA) 2.616 0.856 0.856 weight 1.000 ! spec=15Nnoesy, no=341, id=2703, vol=1.629000e+04
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name   HB) 3.107 1.207 1.207 weight 1.000 ! spec=15Nnoesy, no=346, id=2707, vol=1.083000e+04
assign (segid "   B" and resid   84 and name   HN) (segid "   B" and resid   83 and name   HB) 3.107 1.207 1.207 weight 1.000 ! spec=15Nnoesy, no=346, id=2707, vol=1.083000e+04
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   42 and name   HN) 3.829 1.832 1.832 weight 1.000 ! spec=15Nnoesy, no=358, id=2712, vol=4.511000e+03
assign (segid "   B" and resid   43 and name   HN) (segid "   B" and resid   42 and name   HN) 3.829 1.832 1.832 weight 1.000 ! spec=15Nnoesy, no=358, id=2712, vol=4.511000e+03
assign (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   43 and name   HN) 3.769 1.776 1.776 weight 1.000 ! spec=15Nnoesy, no=359, id=2713, vol=1.059000e+04
assign (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   43 and name   HN) 3.769 1.776 1.776 weight 1.000 ! spec=15Nnoesy, no=359, id=2713, vol=1.059000e+04
assign (segid "   A" and resid   42 and name HG12) (segid "   A" and resid   43 and name   HN) 3.832 1.835 1.835 weight 1.000 ! spec=15Nnoesy, no=361, id=2715, vol=6.380000e+03
    or (segid "   A" and resid   42 and name HG11) (segid "   A" and resid   43 and name   HN)
    or (segid "   A" and resid   42 and name HG13) (segid "   A" and resid   43 and name   HN)
assign (segid "   B" and resid   42 and name HG12) (segid "   B" and resid   43 and name   HN) 3.832 1.835 1.835 weight 1.000 ! spec=15Nnoesy, no=361, id=2715, vol=6.380000e+03
    or (segid "   B" and resid   42 and name HG11) (segid "   B" and resid   43 and name   HN)
    or (segid "   B" and resid   42 and name HG13) (segid "   B" and resid   43 and name   HN)
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid  112 and name HD22) 4.050 2.051 2.051 weight 1.000 ! spec=15Nnoesy, no=365, id=2718, vol=5.166000e+03
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid   78 and name   HN) (segid "   B" and resid  112 and name HD22) 4.050 2.051 2.051 weight 1.000 ! spec=15Nnoesy, no=365, id=2718, vol=5.166000e+03
    or (segid "   B" and resid   78 and name   HN) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid   78 and name   HN) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   78 and name   HN) 3.116 3.116 2.884 weight 1.000 ! spec=15Nnoesy, no=366, id=2719, vol=1.420000e+04
assign (segid "   B" and resid   79 and name  HB1) (segid "   B" and resid   78 and name   HN) 3.116 3.116 2.884 weight 1.000 ! spec=15Nnoesy, no=366, id=2719, vol=1.420000e+04
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name   HN) 3.890 1.892 1.892 weight 1.000 ! spec=15Nnoesy, no=367, id=2720, vol=7.749000e+03
assign (segid "   B" and resid   78 and name   HN) (segid "   B" and resid   77 and name   HN) 3.890 1.892 1.892 weight 1.000 ! spec=15Nnoesy, no=367, id=2720, vol=7.749000e+03
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   78 and name   HN) 2.335 0.681 0.681 weight 1.000 ! spec=15Nnoesy, no=368, id=2721, vol=2.968000e+04
assign (segid "   B" and resid   77 and name   HA) (segid "   B" and resid   78 and name   HN) 2.335 0.681 0.681 weight 1.000 ! spec=15Nnoesy, no=368, id=2721, vol=2.968000e+04
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   78 and name   HN) 3.594 1.615 1.615 weight 1.000 ! spec=15Nnoesy, no=369, id=2722, vol=1.463000e+04
assign (segid "   B" and resid   77 and name  HB1) (segid "   B" and resid   78 and name   HN) 3.594 1.615 1.615 weight 1.000 ! spec=15Nnoesy, no=369, id=2722, vol=1.463000e+04
assign (segid "   A" and resid   91 and name HG21) (segid "   A" and resid   91 and name   HN) 2.618 0.856 0.856 weight 1.000 ! spec=15Nnoesy, no=371, id=2723, vol=1.096000e+04
    or (segid "   A" and resid   91 and name HG22) (segid "   A" and resid   91 and name   HN)
    or (segid "   A" and resid   91 and name HG23) (segid "   A" and resid   91 and name   HN)
assign (segid "   B" and resid   91 and name HG21) (segid "   B" and resid   91 and name   HN) 2.618 0.856 0.856 weight 1.000 ! spec=15Nnoesy, no=371, id=2723, vol=1.096000e+04
    or (segid "   B" and resid   91 and name HG22) (segid "   B" and resid   91 and name   HN)
    or (segid "   B" and resid   91 and name HG23) (segid "   B" and resid   91 and name   HN)
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   38 and name   HN) 2.929 1.072 1.072 weight 1.000 ! spec=15Nnoesy, no=374, id=2724, vol=1.089000e+04
assign (segid "   B" and resid   26 and name   HA) (segid "   B" and resid   38 and name   HN) 2.929 1.072 1.072 weight 1.000 ! spec=15Nnoesy, no=374, id=2724, vol=1.089000e+04
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   38 and name   HN) 5.089 3.237 3.237 weight 1.000 ! spec=15Nnoesy, no=375, id=2725, vol=3.054000e+03
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   38 and name   HN) 5.089 3.237 3.237 weight 1.000 ! spec=15Nnoesy, no=375, id=2725, vol=3.054000e+03
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name   HB) 3.909 1.910 1.910 weight 1.000 ! spec=15Nnoesy, no=381, id=2731, vol=5.616000e+03
assign (segid "   B" and resid   38 and name   HN) (segid "   B" and resid   37 and name   HB) 3.909 1.910 1.910 weight 1.000 ! spec=15Nnoesy, no=381, id=2731, vol=5.616000e+03
assign (segid "   A" and resid   39 and name HD12) (segid "   A" and resid   38 and name   HN) 4.516 2.549 2.549 weight 1.000 ! spec=15Nnoesy, no=383, id=2732, vol=3.094000e+03
    or (segid "   A" and resid   39 and name HD11) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   39 and name HD13) (segid "   A" and resid   38 and name   HN)
assign (segid "   B" and resid   39 and name HD12) (segid "   B" and resid   38 and name   HN) 4.516 2.549 2.549 weight 1.000 ! spec=15Nnoesy, no=383, id=2732, vol=3.094000e+03
    or (segid "   B" and resid   39 and name HD11) (segid "   B" and resid   38 and name   HN)
    or (segid "   B" and resid   39 and name HD13) (segid "   B" and resid   38 and name   HN)
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   26 and name   HN) 4.883 2.980 2.980 weight 1.000 ! spec=15Nnoesy, no=389, id=2736, vol=5.134000e+03
assign (segid "   B" and resid   25 and name  HD2) (segid "   B" and resid   26 and name   HN) 4.883 2.980 2.980 weight 1.000 ! spec=15Nnoesy, no=389, id=2736, vol=5.134000e+03
assign (segid "   A" and resid   26 and name HG21) (segid "   A" and resid   26 and name   HN) 2.435 0.741 0.741 weight 1.000 ! spec=15Nnoesy, no=390, id=2737, vol=1.377000e+04
    or (segid "   A" and resid   26 and name HG22) (segid "   A" and resid   26 and name   HN)
    or (segid "   A" and resid   26 and name HG23) (segid "   A" and resid   26 and name   HN)
assign (segid "   B" and resid   26 and name HG21) (segid "   B" and resid   26 and name   HN) 2.435 0.741 0.741 weight 1.000 ! spec=15Nnoesy, no=390, id=2737, vol=1.377000e+04
    or (segid "   B" and resid   26 and name HG22) (segid "   B" and resid   26 and name   HN)
    or (segid "   B" and resid   26 and name HG23) (segid "   B" and resid   26 and name   HN)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   26 and name   HN) 2.548 0.811 0.811 weight 1.000 ! spec=15Nnoesy, no=392, id=2739, vol=1.409000e+04
assign (segid "   B" and resid   25 and name   HA) (segid "   B" and resid   26 and name   HN) 2.548 0.811 0.811 weight 1.000 ! spec=15Nnoesy, no=392, id=2739, vol=1.409000e+04
assign (segid "   A" and resid   38 and name HG22) (segid "   A" and resid   26 and name   HN) 4.309 2.321 2.321 weight 1.000 ! spec=15Nnoesy, no=394, id=2741, vol=3.540000e+03
    or (segid "   A" and resid   38 and name HG21) (segid "   A" and resid   26 and name   HN)
    or (segid "   A" and resid   38 and name HG23) (segid "   A" and resid   26 and name   HN)
assign (segid "   B" and resid   38 and name HG22) (segid "   B" and resid   26 and name   HN) 4.309 2.321 2.321 weight 1.000 ! spec=15Nnoesy, no=394, id=2741, vol=3.540000e+03
    or (segid "   B" and resid   38 and name HG21) (segid "   B" and resid   26 and name   HN)
    or (segid "   B" and resid   38 and name HG23) (segid "   B" and resid   26 and name   HN)
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   71 and name HD12) 4.585 2.628 2.628 weight 1.000 ! spec=15Nnoesy, no=398, id=2744, vol=5.110000e+03
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   71 and name HD13)
assign (segid "   B" and resid   68 and name   HN) (segid "   B" and resid   71 and name HD12) 4.585 2.628 2.628 weight 1.000 ! spec=15Nnoesy, no=398, id=2744, vol=5.110000e+03
    or (segid "   B" and resid   68 and name   HN) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid   68 and name   HN) (segid "   B" and resid   71 and name HD13)
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   67 and name  HA1) 3.472 1.507 1.507 weight 1.000 ! spec=15Nnoesy, no=401, id=2747, vol=7.568000e+03
assign (segid "   B" and resid   68 and name   HN) (segid "   B" and resid   67 and name  HA1) 3.472 1.507 1.507 weight 1.000 ! spec=15Nnoesy, no=401, id=2747, vol=7.568000e+03
assign (segid "   A" and resid   71 and name HG22) (segid "   A" and resid   68 and name   HN) 3.485 1.518 1.518 weight 1.000 ! spec=15Nnoesy, no=402, id=2748, vol=8.056000e+03
    or (segid "   A" and resid   71 and name HG21) (segid "   A" and resid   68 and name   HN)
    or (segid "   A" and resid   71 and name HG23) (segid "   A" and resid   68 and name   HN)
assign (segid "   B" and resid   71 and name HG22) (segid "   B" and resid   68 and name   HN) 3.485 1.518 1.518 weight 1.000 ! spec=15Nnoesy, no=402, id=2748, vol=8.056000e+03
    or (segid "   B" and resid   71 and name HG21) (segid "   B" and resid   68 and name   HN)
    or (segid "   B" and resid   71 and name HG23) (segid "   B" and resid   68 and name   HN)
assign (segid "   A" and resid   71 and name   HB) (segid "   A" and resid   68 and name   HN) 3.300 1.361 1.361 weight 1.000 ! spec=15Nnoesy, no=404, id=2750, vol=3.315000e+03
assign (segid "   B" and resid   71 and name   HB) (segid "   B" and resid   68 and name   HN) 3.300 1.361 1.361 weight 1.000 ! spec=15Nnoesy, no=404, id=2750, vol=3.315000e+03
assign (segid "   A" and resid   50 and name  HG2) (segid "   A" and resid   50 and name   HN) 3.617 1.635 1.635 weight 1.000 ! spec=15Nnoesy, no=407, id=2753, vol=8.567000e+03
assign (segid "   B" and resid   50 and name  HG2) (segid "   B" and resid   50 and name   HN) 3.617 1.635 1.635 weight 1.000 ! spec=15Nnoesy, no=407, id=2753, vol=8.567000e+03
assign (segid "   A" and resid   50 and name  HD1) (segid "   A" and resid   50 and name   HN) 4.774 2.848 2.848 weight 1.000 ! spec=15Nnoesy, no=409, id=2754, vol=6.115000e+03
assign (segid "   B" and resid   50 and name  HD1) (segid "   B" and resid   50 and name   HN) 4.774 2.848 2.848 weight 1.000 ! spec=15Nnoesy, no=409, id=2754, vol=6.115000e+03
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   81 and name   HN) 2.457 0.755 0.755 weight 1.000 ! spec=15Nnoesy, no=413, id=2757, vol=2.044000e+04
assign (segid "   B" and resid   80 and name   HA) (segid "   B" and resid   81 and name   HN) 2.457 0.755 0.755 weight 1.000 ! spec=15Nnoesy, no=413, id=2757, vol=2.044000e+04
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  109 and name HG12) 3.481 1.515 1.515 weight 1.000 ! spec=15Nnoesy, no=414, id=2758, vol=8.977000e+03
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  109 and name HG11)
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  109 and name HG13)
assign (segid "   B" and resid   81 and name   HN) (segid "   B" and resid  109 and name HG12) 3.481 1.515 1.515 weight 1.000 ! spec=15Nnoesy, no=414, id=2758, vol=8.977000e+03
    or (segid "   B" and resid   81 and name   HN) (segid "   B" and resid  109 and name HG11)
    or (segid "   B" and resid   81 and name   HN) (segid "   B" and resid  109 and name HG13)
assign (segid "   A" and resid  109 and name HG22) (segid "   A" and resid   81 and name   HN) 2.509 0.787 0.787 weight 1.000 ! spec=15Nnoesy, no=416, id=2759, vol=1.374000e+04
    or (segid "   A" and resid  109 and name HG21) (segid "   A" and resid   81 and name   HN)
    or (segid "   A" and resid  109 and name HG23) (segid "   A" and resid   81 and name   HN)
assign (segid "   B" and resid  109 and name HG22) (segid "   B" and resid   81 and name   HN) 2.509 0.787 0.787 weight 1.000 ! spec=15Nnoesy, no=416, id=2759, vol=1.374000e+04
    or (segid "   B" and resid  109 and name HG21) (segid "   B" and resid   81 and name   HN)
    or (segid "   B" and resid  109 and name HG23) (segid "   B" and resid   81 and name   HN)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  110 and name   HA) 4.499 2.530 2.530 weight 1.000 ! spec=15Nnoesy, no=417, id=2760, vol=3.761000e+03
assign (segid "   B" and resid   81 and name   HN) (segid "   B" and resid  110 and name   HA) 4.499 2.530 2.530 weight 1.000 ! spec=15Nnoesy, no=417, id=2760, vol=3.761000e+03
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name HG21) 2.590 2.590 3.410 weight 1.000 ! spec=15Nnoesy, no=418, id=2761, vol=1.791000e+04
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name HG22)
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name HG23)
assign (segid "   B" and resid   81 and name   HN) (segid "   B" and resid   81 and name HG21) 2.590 2.590 3.410 weight 1.000 ! spec=15Nnoesy, no=418, id=2761, vol=1.791000e+04
    or (segid "   B" and resid   81 and name   HN) (segid "   B" and resid   81 and name HG22)
    or (segid "   B" and resid   81 and name   HN) (segid "   B" and resid   81 and name HG23)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  111 and name   HN) 4.013 2.013 2.013 weight 1.000 ! spec=15Nnoesy, no=419, id=2762, vol=4.051000e+03
assign (segid "   B" and resid   81 and name   HN) (segid "   B" and resid  111 and name   HN) 4.013 2.013 2.013 weight 1.000 ! spec=15Nnoesy, no=419, id=2762, vol=4.051000e+03
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   82 and name   HN) 4.580 2.622 2.622 weight 1.000 ! spec=15Nnoesy, no=420, id=2763, vol=3.194000e+03
assign (segid "   B" and resid   81 and name   HN) (segid "   B" and resid   82 and name   HN) 4.580 2.622 2.622 weight 1.000 ! spec=15Nnoesy, no=420, id=2763, vol=3.194000e+03
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name   HN) 4.623 2.671 2.671 weight 1.000 ! spec=15Nnoesy, no=422, id=2765, vol=3.427000e+03
assign (segid "   B" and resid   81 and name   HN) (segid "   B" and resid   80 and name   HN) 4.623 2.671 2.671 weight 1.000 ! spec=15Nnoesy, no=422, id=2765, vol=3.427000e+03
assign (segid "   A" and resid   10 and name  HA2) (segid "   A" and resid   11 and name   HN) 2.816 0.991 0.991 weight 1.000 ! spec=15Nnoesy, no=423, id=2766, vol=1.861000e+04
assign (segid "   B" and resid   10 and name  HA2) (segid "   B" and resid   11 and name   HN) 2.816 0.991 0.991 weight 1.000 ! spec=15Nnoesy, no=423, id=2766, vol=1.861000e+04
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HG1) 4.191 2.196 2.196 weight 1.000 ! spec=15Nnoesy, no=424, id=2767, vol=6.693000e+03
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   11 and name  HG1) 4.191 2.196 2.196 weight 1.000 ! spec=15Nnoesy, no=424, id=2767, vol=6.693000e+03
assign (segid "   A" and resid   10 and name  HA1) (segid "   A" and resid   11 and name   HN) 3.105 1.205 1.205 weight 1.000 ! spec=15Nnoesy, no=425, id=2768, vol=1.241000e+04
assign (segid "   B" and resid   10 and name  HA1) (segid "   B" and resid   11 and name   HN) 3.105 1.205 1.205 weight 1.000 ! spec=15Nnoesy, no=425, id=2768, vol=1.241000e+04
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name   HN) 3.212 1.289 1.289 weight 1.000 ! spec=15Nnoesy, no=426, id=2769, vol=6.806000e+03
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   12 and name   HN) 3.212 1.289 1.289 weight 1.000 ! spec=15Nnoesy, no=426, id=2769, vol=6.806000e+03
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name   HA) 2.837 1.006 1.006 weight 1.000 ! spec=15Nnoesy, no=427, id=2770, vol=1.147000e+04
assign (segid "   B" and resid   11 and name   HN) (segid "   B" and resid   11 and name   HA) 2.837 1.006 1.006 weight 1.000 ! spec=15Nnoesy, no=427, id=2770, vol=1.147000e+04
assign (segid "   A" and resid   11 and name  HG2) (segid "   A" and resid   11 and name   HN) 2.974 1.106 1.106 weight 1.000 ! spec=15Nnoesy, no=428, id=2771, vol=9.340000e+03
assign (segid "   B" and resid   11 and name  HG2) (segid "   B" and resid   11 and name   HN) 2.974 1.106 1.106 weight 1.000 ! spec=15Nnoesy, no=428, id=2771, vol=9.340000e+03
assign (segid "   A" and resid  111 and name   HB) (segid "   A" and resid   79 and name   HN) 3.419 1.461 1.461 weight 1.000 ! spec=15Nnoesy, no=431, id=2774, vol=8.783000e+03
assign (segid "   B" and resid  111 and name   HB) (segid "   B" and resid   79 and name   HN) 3.419 1.461 1.461 weight 1.000 ! spec=15Nnoesy, no=431, id=2774, vol=8.783000e+03
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   79 and name  HB1) 3.566 1.590 1.590 weight 1.000 ! spec=15Nnoesy, no=432, id=2775, vol=4.990000e+03
assign (segid "   B" and resid   79 and name   HN) (segid "   B" and resid   79 and name  HB1) 3.566 1.590 1.590 weight 1.000 ! spec=15Nnoesy, no=432, id=2775, vol=4.990000e+03
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   79 and name   HN) 3.077 1.183 1.183 weight 1.000 ! spec=15Nnoesy, no=436, id=2779, vol=6.283000e+03
assign (segid "   B" and resid   79 and name   HA) (segid "   B" and resid   79 and name   HN) 3.077 1.183 1.183 weight 1.000 ! spec=15Nnoesy, no=436, id=2779, vol=6.283000e+03
assign (segid "   A" and resid   43 and name HD22) (segid "   A" and resid   43 and name   HN) 4.343 2.357 2.357 weight 1.000 ! spec=15Nnoesy, no=440, id=2780, vol=4.153000e+03
assign (segid "   B" and resid   43 and name HD22) (segid "   B" and resid   43 and name   HN) 4.343 2.357 2.357 weight 1.000 ! spec=15Nnoesy, no=440, id=2780, vol=4.153000e+03
assign (segid "   A" and resid   43 and name HD22) (segid "   A" and resid   39 and name HD12) 2.832 1.003 1.003 weight 1.000 ! spec=15Nnoesy, no=443, id=2783, vol=9.579000e+03
    or (segid "   A" and resid   43 and name HD22) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   43 and name HD22) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   43 and name HD22) (segid "   B" and resid   39 and name HD12) 2.832 1.003 1.003 weight 1.000 ! spec=15Nnoesy, no=443, id=2783, vol=9.579000e+03
    or (segid "   B" and resid   43 and name HD22) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   43 and name HD22) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   43 and name HD22) (segid "   A" and resid   43 and name HD21) 1.593 0.317 0.317 weight 1.000 ! spec=15Nnoesy, no=444, id=2784, vol=8.034000e+04
assign (segid "   B" and resid   43 and name HD22) (segid "   B" and resid   43 and name HD21) 1.593 0.317 0.317 weight 1.000 ! spec=15Nnoesy, no=444, id=2784, vol=8.034000e+04
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   95 and name   HN) 4.871 2.966 2.966 weight 1.000 ! spec=15Nnoesy, no=445, id=2785, vol=3.869000e+03
assign (segid "   B" and resid   93 and name   HA) (segid "   B" and resid   95 and name   HN) 4.871 2.966 2.966 weight 1.000 ! spec=15Nnoesy, no=445, id=2785, vol=3.869000e+03
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name   HN) 3.195 1.276 1.276 weight 1.000 ! spec=15Nnoesy, no=446, id=2786, vol=1.636000e+04
assign (segid "   B" and resid   95 and name  HB2) (segid "   B" and resid   95 and name   HN) 3.195 1.276 1.276 weight 1.000 ! spec=15Nnoesy, no=446, id=2786, vol=1.636000e+04
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name   HN) 3.414 1.457 1.457 weight 1.000 ! spec=15Nnoesy, no=448, id=2788, vol=4.307000e+03
assign (segid "   B" and resid   95 and name   HN) (segid "   B" and resid   94 and name   HN) 3.414 1.457 1.457 weight 1.000 ! spec=15Nnoesy, no=448, id=2788, vol=4.307000e+03
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   96 and name   HN) 2.473 0.764 0.764 weight 1.000 ! spec=15Nnoesy, no=449, id=2789, vol=1.416000e+04
assign (segid "   B" and resid   95 and name   HN) (segid "   B" and resid   96 and name   HN) 2.473 0.764 0.764 weight 1.000 ! spec=15Nnoesy, no=449, id=2789, vol=1.416000e+04
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name   HN) 2.803 0.982 0.982 weight 1.000 ! spec=15Nnoesy, no=450, id=2790, vol=1.679000e+04
assign (segid "   B" and resid   95 and name   HA) (segid "   B" and resid   95 and name   HN) 2.803 0.982 0.982 weight 1.000 ! spec=15Nnoesy, no=450, id=2790, vol=1.679000e+04
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   87 and name   HN) 2.686 0.902 0.902 weight 1.000 ! spec=15Nnoesy, no=452, id=2791, vol=1.004000e+04
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   87 and name   HN)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   87 and name   HN)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   87 and name   HN) 2.686 0.902 0.902 weight 1.000 ! spec=15Nnoesy, no=452, id=2791, vol=1.004000e+04
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   87 and name   HN)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   87 and name   HN)
assign (segid "   A" and resid   87 and name HG22) (segid "   A" and resid   87 and name   HN) 2.322 0.674 0.674 weight 1.000 ! spec=15Nnoesy, no=460, id=2798, vol=1.231000e+04
    or (segid "   A" and resid   87 and name HG21) (segid "   A" and resid   87 and name   HN)
    or (segid "   A" and resid   87 and name HG23) (segid "   A" and resid   87 and name   HN)
assign (segid "   B" and resid   87 and name HG22) (segid "   B" and resid   87 and name   HN) 2.322 0.674 0.674 weight 1.000 ! spec=15Nnoesy, no=460, id=2798, vol=1.231000e+04
    or (segid "   B" and resid   87 and name HG21) (segid "   B" and resid   87 and name   HN)
    or (segid "   B" and resid   87 and name HG23) (segid "   B" and resid   87 and name   HN)
assign (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid   87 and name   HN) 3.856 1.859 1.859 weight 1.000 ! spec=15Nnoesy, no=462, id=2799, vol=3.568000e+03
assign (segid "   B" and resid  101 and name  HB1) (segid "   B" and resid   87 and name   HN) 3.856 1.859 1.859 weight 1.000 ! spec=15Nnoesy, no=462, id=2799, vol=3.568000e+03
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name   HN) 3.639 1.655 1.655 weight 1.000 ! spec=15Nnoesy, no=464, id=2801, vol=1.123000e+04
assign (segid "   B" and resid   59 and name  HB2) (segid "   B" and resid   59 and name   HN) 3.639 1.655 1.655 weight 1.000 ! spec=15Nnoesy, no=464, id=2801, vol=1.123000e+04
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name   HN) 3.175 1.260 1.260 weight 1.000 ! spec=15Nnoesy, no=467, id=2803, vol=1.123000e+04
assign (segid "   B" and resid   59 and name  HG2) (segid "   B" and resid   59 and name   HN) 3.175 1.260 1.260 weight 1.000 ! spec=15Nnoesy, no=467, id=2803, vol=1.123000e+04
assign (segid "   A" and resid   59 and name  HD1) (segid "   A" and resid   59 and name   HN) 4.736 2.804 2.804 weight 1.000 ! spec=15Nnoesy, no=469, id=2805, vol=3.395000e+03
assign (segid "   B" and resid   59 and name  HD1) (segid "   B" and resid   59 and name   HN) 4.736 2.804 2.804 weight 1.000 ! spec=15Nnoesy, no=469, id=2805, vol=3.395000e+03
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name   HN) 4.112 2.113 2.113 weight 1.000 ! spec=15Nnoesy, no=472, id=2808, vol=3.790000e+03
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   43 and name   HN) 4.112 2.113 2.113 weight 1.000 ! spec=15Nnoesy, no=472, id=2808, vol=3.790000e+03
assign (segid "   A" and resid   44 and name HG11) (segid "   A" and resid   44 and name   HN) 2.830 1.001 1.001 weight 1.000 ! spec=15Nnoesy, no=475, id=2811, vol=1.024000e+04
assign (segid "   B" and resid   44 and name HG11) (segid "   B" and resid   44 and name   HN) 2.830 1.001 1.001 weight 1.000 ! spec=15Nnoesy, no=475, id=2811, vol=1.024000e+04
assign (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   44 and name   HN) 4.277 2.286 2.286 weight 1.000 ! spec=15Nnoesy, no=477, id=2813, vol=5.681000e+03
assign (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   44 and name   HN) 4.277 2.286 2.286 weight 1.000 ! spec=15Nnoesy, no=477, id=2813, vol=5.681000e+03
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name HD12) 4.025 2.025 2.025 weight 1.000 ! spec=15Nnoesy, no=479, id=2815, vol=5.231000e+03
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name HD11)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name HD13)
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   44 and name HD12) 4.025 2.025 2.025 weight 1.000 ! spec=15Nnoesy, no=479, id=2815, vol=5.231000e+03
    or (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   44 and name HD11)
    or (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   44 and name HD13)
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   44 and name   HN) 3.866 1.868 1.868 weight 1.000 ! spec=15Nnoesy, no=481, id=2816, vol=3.238000e+03
assign (segid "   B" and resid   47 and name  HB2) (segid "   B" and resid   44 and name   HN) 3.866 1.868 1.868 weight 1.000 ! spec=15Nnoesy, no=481, id=2816, vol=3.238000e+03
assign (segid "   A" and resid   44 and name HG22) (segid "   A" and resid   44 and name   HN) 3.849 1.851 1.851 weight 1.000 ! spec=15Nnoesy, no=482, id=2817, vol=7.272000e+03
    or (segid "   A" and resid   44 and name HG21) (segid "   A" and resid   44 and name   HN)
    or (segid "   A" and resid   44 and name HG23) (segid "   A" and resid   44 and name   HN)
assign (segid "   B" and resid   44 and name HG22) (segid "   B" and resid   44 and name   HN) 3.849 1.851 1.851 weight 1.000 ! spec=15Nnoesy, no=482, id=2817, vol=7.272000e+03
    or (segid "   B" and resid   44 and name HG21) (segid "   B" and resid   44 and name   HN)
    or (segid "   B" and resid   44 and name HG23) (segid "   B" and resid   44 and name   HN)
assign (segid "   A" and resid   77 and name HD22) (segid "   A" and resid   77 and name HD21) 1.954 0.477 0.477 weight 1.000 ! spec=15Nnoesy, no=484, id=2818, vol=2.712000e+04
assign (segid "   B" and resid   77 and name HD22) (segid "   B" and resid   77 and name HD21) 1.954 0.477 0.477 weight 1.000 ! spec=15Nnoesy, no=484, id=2818, vol=2.712000e+04
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name HD22) 3.730 1.739 1.739 weight 1.000 ! spec=15Nnoesy, no=485, id=2819, vol=1.078000e+04
assign (segid "   B" and resid   77 and name  HB2) (segid "   B" and resid   77 and name HD22) 3.730 1.739 1.739 weight 1.000 ! spec=15Nnoesy, no=485, id=2819, vol=1.078000e+04
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   77 and name HD22) 4.198 2.203 2.203 weight 1.000 ! spec=15Nnoesy, no=486, id=2820, vol=8.908000e+03
assign (segid "   B" and resid   77 and name  HB1) (segid "   B" and resid   77 and name HD22) 4.198 2.203 2.203 weight 1.000 ! spec=15Nnoesy, no=486, id=2820, vol=8.908000e+03
assign (segid "   A" and resid  104 and name HG22) (segid "   A" and resid   54 and name   HN) 3.846 1.849 1.849 weight 1.000 ! spec=15Nnoesy, no=491, id=2823, vol=3.459000e+03
    or (segid "   A" and resid  104 and name HG21) (segid "   A" and resid   54 and name   HN)
    or (segid "   A" and resid  104 and name HG23) (segid "   A" and resid   54 and name   HN)
assign (segid "   B" and resid  104 and name HG22) (segid "   B" and resid   54 and name   HN) 3.846 1.849 1.849 weight 1.000 ! spec=15Nnoesy, no=491, id=2823, vol=3.459000e+03
    or (segid "   B" and resid  104 and name HG21) (segid "   B" and resid   54 and name   HN)
    or (segid "   B" and resid  104 and name HG23) (segid "   B" and resid   54 and name   HN)
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   54 and name   HN) 3.148 1.239 1.239 weight 1.000 ! spec=15Nnoesy, no=492, id=2824, vol=1.033000e+04
assign (segid "   B" and resid   54 and name  HB2) (segid "   B" and resid   54 and name   HN) 3.148 1.239 1.239 weight 1.000 ! spec=15Nnoesy, no=492, id=2824, vol=1.033000e+04
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name   HN) 3.587 1.608 1.608 weight 1.000 ! spec=15Nnoesy, no=494, id=2826, vol=6.733000e+03
assign (segid "   B" and resid   13 and name  HB1) (segid "   B" and resid   13 and name   HN) 3.587 1.608 1.608 weight 1.000 ! spec=15Nnoesy, no=494, id=2826, vol=6.733000e+03
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name   HN) 4.003 2.003 2.003 weight 1.000 ! spec=15Nnoesy, no=495, id=2827, vol=7.011000e+03
assign (segid "   B" and resid   13 and name   HN) (segid "   B" and resid   14 and name   HN) 4.003 2.003 2.003 weight 1.000 ! spec=15Nnoesy, no=495, id=2827, vol=7.011000e+03
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name   HN) 3.112 1.211 1.211 weight 1.000 ! spec=15Nnoesy, no=497, id=2829, vol=9.102000e+03
assign (segid "   B" and resid   13 and name  HB2) (segid "   B" and resid   13 and name   HN) 3.112 1.211 1.211 weight 1.000 ! spec=15Nnoesy, no=497, id=2829, vol=9.102000e+03
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   86 and name   HN) 4.151 2.154 2.154 weight 1.000 ! spec=15Nnoesy, no=502, id=2832, vol=3.551000e+03
assign (segid "   B" and resid   85 and name   HB) (segid "   B" and resid   86 and name   HN) 4.151 2.154 2.154 weight 1.000 ! spec=15Nnoesy, no=502, id=2832, vol=3.551000e+03
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name  HG1) 3.307 1.367 1.367 weight 1.000 ! spec=15Nnoesy, no=506, id=2835, vol=6.781000e+03
assign (segid "   B" and resid   86 and name   HN) (segid "   B" and resid   85 and name  HG1) 3.307 1.367 1.367 weight 1.000 ! spec=15Nnoesy, no=506, id=2835, vol=6.781000e+03
assign (segid "   A" and resid   27 and name HG21) (segid "   A" and resid   36 and name   HN) 3.518 1.547 1.547 weight 1.000 ! spec=15Nnoesy, no=513, id=2842, vol=8.613000e+03
    or (segid "   A" and resid   27 and name HG22) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   27 and name HG23) (segid "   A" and resid   36 and name   HN)
assign (segid "   B" and resid   27 and name HG21) (segid "   B" and resid   36 and name   HN) 3.518 1.547 1.547 weight 1.000 ! spec=15Nnoesy, no=513, id=2842, vol=8.613000e+03
    or (segid "   B" and resid   27 and name HG22) (segid "   B" and resid   36 and name   HN)
    or (segid "   B" and resid   27 and name HG23) (segid "   B" and resid   36 and name   HN)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   29 and name   HN) 4.101 2.102 2.102 weight 1.000 ! spec=15Nnoesy, no=514, id=2843, vol=3.795000e+03
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   29 and name   HN) 4.101 2.102 2.102 weight 1.000 ! spec=15Nnoesy, no=514, id=2843, vol=3.795000e+03
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   27 and name   HA) 4.364 2.381 2.381 weight 1.000 ! spec=15Nnoesy, no=516, id=2845, vol=3.653000e+03
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   27 and name   HA) 4.364 2.381 2.381 weight 1.000 ! spec=15Nnoesy, no=516, id=2845, vol=3.653000e+03
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   30 and name   HN) 3.665 1.679 1.679 weight 1.000 ! spec=15Nnoesy, no=519, id=2848, vol=6.227000e+03
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   30 and name   HN) 3.665 1.679 1.679 weight 1.000 ! spec=15Nnoesy, no=519, id=2848, vol=6.227000e+03
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  103 and name   HN) 2.808 0.985 0.985 weight 1.000 ! spec=15Nnoesy, no=520, id=2849, vol=7.852000e+03
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  103 and name   HN) 2.808 0.985 0.985 weight 1.000 ! spec=15Nnoesy, no=520, id=2849, vol=7.852000e+03
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  103 and name   HN) 2.705 0.915 0.915 weight 1.000 ! spec=15Nnoesy, no=521, id=2850, vol=1.470000e+04
assign (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid  103 and name   HN) 2.705 0.915 0.915 weight 1.000 ! spec=15Nnoesy, no=521, id=2850, vol=1.470000e+04
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid  103 and name   HN) 3.855 1.858 1.858 weight 1.000 ! spec=15Nnoesy, no=522, id=2851, vol=6.741000e+03
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid  103 and name   HN) 3.855 1.858 1.858 weight 1.000 ! spec=15Nnoesy, no=522, id=2851, vol=6.741000e+03
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  103 and name   HA) 3.071 1.179 1.179 weight 1.000 ! spec=15Nnoesy, no=523, id=2852, vol=5.954000e+03
assign (segid "   B" and resid  103 and name   HN) (segid "   B" and resid  103 and name   HA) 3.071 1.179 1.179 weight 1.000 ! spec=15Nnoesy, no=523, id=2852, vol=5.954000e+03
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  104 and name HG12) 3.523 3.523 2.477 weight 1.000 ! spec=15Nnoesy, no=524, id=2853, vol=1.379000e+04
assign (segid "   B" and resid  103 and name   HN) (segid "   B" and resid  104 and name HG12) 3.523 3.523 2.477 weight 1.000 ! spec=15Nnoesy, no=524, id=2853, vol=1.379000e+04
assign (segid "   A" and resid  102 and name   HB) (segid "   A" and resid  103 and name   HN) 2.723 0.927 0.927 weight 1.000 ! spec=15Nnoesy, no=525, id=2854, vol=7.181000e+03
assign (segid "   B" and resid  102 and name   HB) (segid "   B" and resid  103 and name   HN) 2.723 0.927 0.927 weight 1.000 ! spec=15Nnoesy, no=525, id=2854, vol=7.181000e+03
assign (segid "   A" and resid   29 and name HG21) (segid "   A" and resid  103 and name   HN) 3.983 1.983 1.983 weight 1.000 ! spec=15Nnoesy, no=530, id=2857, vol=6.211000e+03
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid  103 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid  103 and name   HN)
assign (segid "   B" and resid   29 and name HG21) (segid "   B" and resid  103 and name   HN) 3.983 1.983 1.983 weight 1.000 ! spec=15Nnoesy, no=530, id=2857, vol=6.211000e+03
    or (segid "   B" and resid   29 and name HG22) (segid "   B" and resid  103 and name   HN)
    or (segid "   B" and resid   29 and name HG23) (segid "   B" and resid  103 and name   HN)
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid  103 and name   HN) 3.136 1.229 1.229 weight 1.000 ! spec=15Nnoesy, no=534, id=2859, vol=1.379000e+04
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid  103 and name   HN)
    or (segid "   A" and resid   28 and name  HB3) (segid "   A" and resid  103 and name   HN)
assign (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid  103 and name   HN) 3.136 1.229 1.229 weight 1.000 ! spec=15Nnoesy, no=534, id=2859, vol=1.379000e+04
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid  103 and name   HN)
    or (segid "   B" and resid   28 and name  HB3) (segid "   B" and resid  103 and name   HN)
assign (segid "   A" and resid   62 and name HD21) (segid "   A" and resid   62 and name HD22) 1.500 0.281 0.281 weight 1.000 ! spec=15Nnoesy, no=535, id=2860, vol=9.243000e+04
assign (segid "   B" and resid   62 and name HD21) (segid "   B" and resid   62 and name HD22) 1.500 0.281 0.281 weight 1.000 ! spec=15Nnoesy, no=535, id=2860, vol=9.243000e+04
assign (segid "   A" and resid   62 and name HD22) (segid "   A" and resid   62 and name  HB1) 3.809 1.813 1.813 weight 1.000 ! spec=15Nnoesy, no=536, id=2861, vol=8.340000e+03
assign (segid "   B" and resid   62 and name HD22) (segid "   B" and resid   62 and name  HB1) 3.809 1.813 1.813 weight 1.000 ! spec=15Nnoesy, no=536, id=2861, vol=8.340000e+03
assign (segid "   A" and resid   62 and name HD22) (segid "   A" and resid   67 and name   HN) 3.922 1.922 1.922 weight 1.000 ! spec=15Nnoesy, no=537, id=2862, vol=5.215000e+03
assign (segid "   B" and resid   62 and name HD22) (segid "   B" and resid   67 and name   HN) 3.922 1.922 1.922 weight 1.000 ! spec=15Nnoesy, no=537, id=2862, vol=5.215000e+03
assign (segid "   A" and resid   62 and name HD22) (segid "   A" and resid   62 and name  HB2) 2.777 0.964 0.964 weight 1.000 ! spec=15Nnoesy, no=538, id=2863, vol=9.420000e+03
assign (segid "   B" and resid   62 and name HD22) (segid "   B" and resid   62 and name  HB2) 2.777 0.964 0.964 weight 1.000 ! spec=15Nnoesy, no=538, id=2863, vol=9.420000e+03
assign (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name   HN) 2.509 0.787 0.787 weight 1.000 ! spec=15Nnoesy, no=539, id=2864, vol=2.642000e+04
assign (segid "   B" and resid  100 and name   HA) (segid "   B" and resid  100 and name   HN) 2.509 0.787 0.787 weight 1.000 ! spec=15Nnoesy, no=539, id=2864, vol=2.642000e+04
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  100 and name  HB2) 3.516 1.546 1.546 weight 1.000 ! spec=15Nnoesy, no=540, id=2865, vol=1.376000e+04
assign (segid "   B" and resid  100 and name   HN) (segid "   B" and resid  100 and name  HB2) 3.516 1.546 1.546 weight 1.000 ! spec=15Nnoesy, no=540, id=2865, vol=1.376000e+04
assign (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name   HN) 2.545 0.809 0.809 weight 1.000 ! spec=15Nnoesy, no=542, id=2867, vol=1.332000e+04
assign (segid "   B" and resid  100 and name  HB1) (segid "   B" and resid  100 and name   HN) 2.545 0.809 0.809 weight 1.000 ! spec=15Nnoesy, no=542, id=2867, vol=1.332000e+04
assign (segid "   A" and resid  100 and name  HD1) (segid "   A" and resid  100 and name   HN) 5.046 3.183 3.183 weight 1.000 ! spec=15Nnoesy, no=543, id=2868, vol=4.085000e+03
assign (segid "   B" and resid  100 and name  HD1) (segid "   B" and resid  100 and name   HN) 5.046 3.183 3.183 weight 1.000 ! spec=15Nnoesy, no=543, id=2868, vol=4.085000e+03
assign (segid "   A" and resid  100 and name  HD2) (segid "   A" and resid  100 and name   HN) 3.551 1.576 1.576 weight 1.000 ! spec=15Nnoesy, no=545, id=2870, vol=8.215000e+03
assign (segid "   B" and resid  100 and name  HD2) (segid "   B" and resid  100 and name   HN) 3.551 1.576 1.576 weight 1.000 ! spec=15Nnoesy, no=545, id=2870, vol=8.215000e+03
assign (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   99 and name  HH2) 4.740 2.809 2.809 weight 1.000 ! spec=15Nnoesy, no=546, id=2871, vol=4.489000e+03
assign (segid "   B" and resid   99 and name  HE1) (segid "   B" and resid   99 and name  HH2) 4.740 2.809 2.809 weight 1.000 ! spec=15Nnoesy, no=546, id=2871, vol=4.489000e+03
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   66 and name   HN) 3.181 1.265 1.265 weight 1.000 ! spec=15Nnoesy, no=554, id=2874, vol=7.920000e+03
assign (segid "   B" and resid   66 and name   HA) (segid "   B" and resid   66 and name   HN) 3.181 1.265 1.265 weight 1.000 ! spec=15Nnoesy, no=554, id=2874, vol=7.920000e+03
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   65 and name   HN) 3.590 1.611 1.611 weight 1.000 ! spec=15Nnoesy, no=555, id=2875, vol=3.835000e+03
assign (segid "   B" and resid   66 and name   HN) (segid "   B" and resid   65 and name   HN) 3.590 1.611 1.611 weight 1.000 ! spec=15Nnoesy, no=555, id=2875, vol=3.835000e+03
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   66 and name   HN) 3.491 1.523 1.523 weight 1.000 ! spec=15Nnoesy, no=556, id=2876, vol=6.958000e+03
assign (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   66 and name   HN) 3.491 1.523 1.523 weight 1.000 ! spec=15Nnoesy, no=556, id=2876, vol=6.958000e+03
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name   HN) 4.255 2.263 2.263 weight 1.000 ! spec=15Nnoesy, no=557, id=2877, vol=5.166000e+03
assign (segid "   B" and resid   66 and name  HB2) (segid "   B" and resid   66 and name   HN) 4.255 2.263 2.263 weight 1.000 ! spec=15Nnoesy, no=557, id=2877, vol=5.166000e+03
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   66 and name   HN) 3.491 1.523 1.523 weight 1.000 ! spec=15Nnoesy, no=560, id=2880, vol=5.745000e+03
assign (segid "   B" and resid   66 and name  HB1) (segid "   B" and resid   66 and name   HN) 3.491 1.523 1.523 weight 1.000 ! spec=15Nnoesy, no=560, id=2880, vol=5.745000e+03
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   47 and name   HN) 3.875 1.877 1.877 weight 1.000 ! spec=15Nnoesy, no=561, id=2881, vol=5.689000e+03
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   47 and name   HN) 3.875 1.877 1.877 weight 1.000 ! spec=15Nnoesy, no=561, id=2881, vol=5.689000e+03
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   47 and name   HN) 2.484 0.771 0.771 weight 1.000 ! spec=15Nnoesy, no=562, id=2882, vol=2.891000e+04
assign (segid "   B" and resid   44 and name   HN) (segid "   B" and resid   47 and name   HN) 2.484 0.771 0.771 weight 1.000 ! spec=15Nnoesy, no=562, id=2882, vol=2.891000e+04
assign (segid "   A" and resid   47 and name   HA) (segid "   A" and resid   47 and name   HN) 2.805 0.983 0.983 weight 1.000 ! spec=15Nnoesy, no=563, id=2883, vol=1.600000e+04
assign (segid "   B" and resid   47 and name   HA) (segid "   B" and resid   47 and name   HN) 2.805 0.983 0.983 weight 1.000 ! spec=15Nnoesy, no=563, id=2883, vol=1.600000e+04
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   48 and name   HN) 3.776 1.783 1.783 weight 1.000 ! spec=15Nnoesy, no=564, id=2884, vol=1.012000e+04
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   48 and name   HN) 3.776 1.783 1.783 weight 1.000 ! spec=15Nnoesy, no=564, id=2884, vol=1.012000e+04
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name   HN) 3.183 1.267 1.267 weight 1.000 ! spec=15Nnoesy, no=565, id=2885, vol=2.205000e+04
assign (segid "   B" and resid   47 and name  HB1) (segid "   B" and resid   47 and name   HN) 3.183 1.267 1.267 weight 1.000 ! spec=15Nnoesy, no=565, id=2885, vol=2.205000e+04
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   44 and name HD12) 4.231 2.237 2.237 weight 1.000 ! spec=15Nnoesy, no=566, id=2886, vol=5.568000e+03
    or (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   44 and name HD11)
    or (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   44 and name HD13)
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   44 and name HD12) 4.231 2.237 2.237 weight 1.000 ! spec=15Nnoesy, no=566, id=2886, vol=5.568000e+03
    or (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   44 and name HD11)
    or (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   44 and name HD13)
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   45 and name   HN) 3.360 1.411 1.411 weight 1.000 ! spec=15Nnoesy, no=567, id=2887, vol=7.602000e+03
assign (segid "   B" and resid   47 and name   HN) (segid "   B" and resid   45 and name   HN) 3.360 1.411 1.411 weight 1.000 ! spec=15Nnoesy, no=567, id=2887, vol=7.602000e+03
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   47 and name   HN) 2.677 0.896 0.896 weight 1.000 ! spec=15Nnoesy, no=568, id=2888, vol=2.262000e+04
assign (segid "   B" and resid   47 and name  HB2) (segid "   B" and resid   47 and name   HN) 2.677 0.896 0.896 weight 1.000 ! spec=15Nnoesy, no=568, id=2888, vol=2.262000e+04
assign (segid "   A" and resid   22 and name   HB) (segid "   A" and resid   24 and name   HN) 3.211 1.289 1.289 weight 1.000 ! spec=15Nnoesy, no=571, id=2891, vol=7.499000e+03
assign (segid "   B" and resid   22 and name   HB) (segid "   B" and resid   24 and name   HN) 3.211 1.289 1.289 weight 1.000 ! spec=15Nnoesy, no=571, id=2891, vol=7.499000e+03
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   22 and name   HA) 3.816 1.820 1.820 weight 1.000 ! spec=15Nnoesy, no=572, id=2892, vol=7.420000e+03
assign (segid "   B" and resid   24 and name   HN) (segid "   B" and resid   22 and name   HA) 3.816 1.820 1.820 weight 1.000 ! spec=15Nnoesy, no=572, id=2892, vol=7.420000e+03
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name   HN) 4.104 2.105 2.105 weight 1.000 ! spec=15Nnoesy, no=580, id=2899, vol=7.272000e+03
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   19 and name   HN) 4.104 2.105 2.105 weight 1.000 ! spec=15Nnoesy, no=580, id=2899, vol=7.272000e+03
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name   HN) 3.436 1.475 1.475 weight 1.000 ! spec=15Nnoesy, no=585, id=2904, vol=4.102000e+03
assign (segid "   B" and resid   19 and name   HA) (segid "   B" and resid   19 and name   HN) 3.436 1.475 1.475 weight 1.000 ! spec=15Nnoesy, no=585, id=2904, vol=4.102000e+03
assign (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   19 and name   HN) 2.525 2.525 3.475 weight 1.000 ! spec=15Nnoesy, no=586, id=2905, vol=2.153000e+04
    or (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   19 and name   HN)
assign (segid "   B" and resid   20 and name HG22) (segid "   B" and resid   19 and name   HN) 2.525 2.525 3.475 weight 1.000 ! spec=15Nnoesy, no=586, id=2905, vol=2.153000e+04
    or (segid "   B" and resid   20 and name HG21) (segid "   B" and resid   19 and name   HN)
    or (segid "   B" and resid   20 and name HG23) (segid "   B" and resid   19 and name   HN)
assign (segid "   A" and resid   56 and name HG21) (segid "   A" and resid   19 and name   HN) 2.932 2.932 3.068 weight 1.000 ! spec=15Nnoesy, no=587, id=2906, vol=2.153000e+04
    or (segid "   A" and resid   56 and name HG22) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   56 and name HG23) (segid "   A" and resid   19 and name   HN)
assign (segid "   B" and resid   56 and name HG21) (segid "   B" and resid   19 and name   HN) 2.932 2.932 3.068 weight 1.000 ! spec=15Nnoesy, no=587, id=2906, vol=2.153000e+04
    or (segid "   B" and resid   56 and name HG22) (segid "   B" and resid   19 and name   HN)
    or (segid "   B" and resid   56 and name HG23) (segid "   B" and resid   19 and name   HN)
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   76 and name  HB1) 3.151 1.241 1.241 weight 1.000 ! spec=15Nnoesy, no=591, id=2909, vol=8.136000e+03
assign (segid "   B" and resid   72 and name   HN) (segid "   B" and resid   76 and name  HB1) 3.151 1.241 1.241 weight 1.000 ! spec=15Nnoesy, no=591, id=2909, vol=8.136000e+03
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   72 and name   HN) 3.043 1.158 1.158 weight 1.000 ! spec=15Nnoesy, no=592, id=2910, vol=8.658000e+03
assign (segid "   B" and resid   72 and name   HA) (segid "   B" and resid   72 and name   HN) 3.043 1.158 1.158 weight 1.000 ! spec=15Nnoesy, no=592, id=2910, vol=8.658000e+03
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   76 and name  HE1) 4.712 2.775 2.775 weight 1.000 ! spec=15Nnoesy, no=595, id=2913, vol=4.625000e+03
assign (segid "   B" and resid   72 and name   HN) (segid "   B" and resid   76 and name  HE1) 4.712 2.775 2.775 weight 1.000 ! spec=15Nnoesy, no=595, id=2913, vol=4.625000e+03
assign (segid "   A" and resid   96 and name HE22) (segid "   A" and resid   96 and name  HB2) 5.073 3.217 3.217 weight 1.000 ! spec=15Nnoesy, no=597, id=2915, vol=7.943000e+03
assign (segid "   B" and resid   96 and name HE22) (segid "   B" and resid   96 and name  HB2) 5.073 3.217 3.217 weight 1.000 ! spec=15Nnoesy, no=597, id=2915, vol=7.943000e+03
assign (segid "   A" and resid   96 and name HE22) (segid "   A" and resid   96 and name  HB1) 4.616 2.663 2.663 weight 1.000 ! spec=15Nnoesy, no=598, id=2916, vol=8.442000e+03
assign (segid "   B" and resid   96 and name HE22) (segid "   B" and resid   96 and name  HB1) 4.616 2.663 2.663 weight 1.000 ! spec=15Nnoesy, no=598, id=2916, vol=8.442000e+03
assign (segid "   A" and resid   96 and name HE22) (segid "   A" and resid   96 and name   HA) 3.707 1.718 1.718 weight 1.000 ! spec=15Nnoesy, no=599, id=2917, vol=1.098000e+04
assign (segid "   B" and resid   96 and name HE22) (segid "   B" and resid   96 and name   HA) 3.707 1.718 1.718 weight 1.000 ! spec=15Nnoesy, no=599, id=2917, vol=1.098000e+04
assign (segid "   A" and resid  116 and name  HB2) (segid "   A" and resid  116 and name   HN) 2.782 0.968 0.968 weight 1.000 ! spec=15Nnoesy, no=602, id=2919, vol=1.022000e+04
    or (segid "   A" and resid  116 and name  HB1) (segid "   A" and resid  116 and name   HN)
    or (segid "   A" and resid  116 and name  HB3) (segid "   A" and resid  116 and name   HN)
assign (segid "   B" and resid  116 and name  HB2) (segid "   B" and resid  116 and name   HN) 2.782 0.968 0.968 weight 1.000 ! spec=15Nnoesy, no=602, id=2919, vol=1.022000e+04
    or (segid "   B" and resid  116 and name  HB1) (segid "   B" and resid  116 and name   HN)
    or (segid "   B" and resid  116 and name  HB3) (segid "   B" and resid  116 and name   HN)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   13 and name   HA) 3.693 1.704 1.704 weight 1.000 ! spec=15Nnoesy, no=603, id=2920, vol=1.134000e+04
assign (segid "   B" and resid   15 and name   HN) (segid "   B" and resid   13 and name   HA) 3.693 1.704 1.704 weight 1.000 ! spec=15Nnoesy, no=603, id=2920, vol=1.134000e+04
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   15 and name   HN) 3.501 1.532 1.532 weight 1.000 ! spec=15Nnoesy, no=604, id=2921, vol=4.301000e+03
assign (segid "   B" and resid   14 and name   HB) (segid "   B" and resid   15 and name   HN) 3.501 1.532 1.532 weight 1.000 ! spec=15Nnoesy, no=604, id=2921, vol=4.301000e+03
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   15 and name   HN) 4.345 2.360 2.360 weight 1.000 ! spec=15Nnoesy, no=616, id=2932, vol=9.749000e+03
assign (segid "   B" and resid   13 and name  HB2) (segid "   B" and resid   15 and name   HN) 4.345 2.360 2.360 weight 1.000 ! spec=15Nnoesy, no=616, id=2932, vol=9.749000e+03
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   58 and name   HN) 4.257 2.265 2.265 weight 1.000 ! spec=15Nnoesy, no=618, id=2934, vol=5.833000e+03
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   58 and name   HN)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   58 and name   HN)
assign (segid "   B" and resid   18 and name HG12) (segid "   B" and resid   58 and name   HN) 4.257 2.265 2.265 weight 1.000 ! spec=15Nnoesy, no=618, id=2934, vol=5.833000e+03
    or (segid "   B" and resid   18 and name HG11) (segid "   B" and resid   58 and name   HN)
    or (segid "   B" and resid   18 and name HG13) (segid "   B" and resid   58 and name   HN)
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   82 and name   HN) 4.016 2.016 2.016 weight 1.000 ! spec=15Nnoesy, no=624, id=2939, vol=7.511000e+03
assign (segid "   B" and resid   58 and name   HN) (segid "   B" and resid   82 and name   HN) 4.016 2.016 2.016 weight 1.000 ! spec=15Nnoesy, no=624, id=2939, vol=7.511000e+03
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name   HN) 2.477 0.767 0.767 weight 1.000 ! spec=15Nnoesy, no=628, id=2943, vol=1.977000e+04
assign (segid "   B" and resid   96 and name  HB2) (segid "   B" and resid   96 and name   HN) 2.477 0.767 0.767 weight 1.000 ! spec=15Nnoesy, no=628, id=2943, vol=1.977000e+04
assign (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   96 and name   HN) 3.299 1.360 1.360 weight 1.000 ! spec=15Nnoesy, no=629, id=2944, vol=1.392000e+04
assign (segid "   B" and resid   96 and name  HB1) (segid "   B" and resid   96 and name   HN) 3.299 1.360 1.360 weight 1.000 ! spec=15Nnoesy, no=629, id=2944, vol=1.392000e+04
assign (segid "   A" and resid   74 and name  HE2) (segid "   A" and resid   74 and name   HN) 4.710 2.773 2.773 weight 1.000 ! spec=15Nnoesy, no=631, id=2946, vol=5.022000e+03
assign (segid "   B" and resid   74 and name  HE2) (segid "   B" and resid   74 and name   HN) 4.710 2.773 2.773 weight 1.000 ! spec=15Nnoesy, no=631, id=2946, vol=5.022000e+03
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   74 and name   HN) 3.535 1.562 1.562 weight 1.000 ! spec=15Nnoesy, no=632, id=2947, vol=5.391000e+03
assign (segid "   B" and resid   73 and name  HB2) (segid "   B" and resid   74 and name   HN) 3.535 1.562 1.562 weight 1.000 ! spec=15Nnoesy, no=632, id=2947, vol=5.391000e+03
assign (segid "   A" and resid   74 and name  HE1) (segid "   A" and resid   74 and name   HN) 4.822 2.907 2.907 weight 1.000 ! spec=15Nnoesy, no=635, id=2950, vol=3.557000e+03
assign (segid "   B" and resid   74 and name  HE1) (segid "   B" and resid   74 and name   HN) 4.822 2.907 2.907 weight 1.000 ! spec=15Nnoesy, no=635, id=2950, vol=3.557000e+03
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name  HD2) 4.440 2.464 2.464 weight 1.000 ! spec=15Nnoesy, no=637, id=2952, vol=1.791000e+04
assign (segid "   B" and resid   74 and name   HN) (segid "   B" and resid   74 and name  HD2) 4.440 2.464 2.464 weight 1.000 ! spec=15Nnoesy, no=637, id=2952, vol=1.791000e+04
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   74 and name   HN) 4.175 2.179 2.179 weight 1.000 ! spec=15Nnoesy, no=638, id=2953, vol=5.705000e+03
assign (segid "   B" and resid   74 and name  HG1) (segid "   B" and resid   74 and name   HN) 4.175 2.179 2.179 weight 1.000 ! spec=15Nnoesy, no=638, id=2953, vol=5.705000e+03
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name   HN) 2.625 0.861 0.861 weight 1.000 ! spec=15Nnoesy, no=639, id=2954, vol=1.816000e+04
assign (segid "   B" and resid   74 and name   HA) (segid "   B" and resid   74 and name   HN) 2.625 0.861 0.861 weight 1.000 ! spec=15Nnoesy, no=639, id=2954, vol=1.816000e+04
assign (segid "   A" and resid   74 and name  HG2) (segid "   A" and resid   74 and name   HN) 2.767 2.767 3.233 weight 1.000 ! spec=15Nnoesy, no=640, id=2955, vol=1.420000e+04
assign (segid "   B" and resid   74 and name  HG2) (segid "   B" and resid   74 and name   HN) 2.767 2.767 3.233 weight 1.000 ! spec=15Nnoesy, no=640, id=2955, vol=1.420000e+04
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   74 and name   HN) 3.768 1.774 1.774 weight 1.000 ! spec=15Nnoesy, no=641, id=2956, vol=6.741000e+03
assign (segid "   B" and resid   72 and name   HA) (segid "   B" and resid   74 and name   HN) 3.768 1.774 1.774 weight 1.000 ! spec=15Nnoesy, no=641, id=2956, vol=6.741000e+03
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   73 and name   HA) 3.308 1.368 1.368 weight 1.000 ! spec=15Nnoesy, no=643, id=2958, vol=5.705000e+03
assign (segid "   B" and resid   74 and name   HN) (segid "   B" and resid   73 and name   HA) 3.308 1.368 1.368 weight 1.000 ! spec=15Nnoesy, no=643, id=2958, vol=5.705000e+03
assign (segid "   A" and resid   74 and name  HD1) (segid "   A" and resid   74 and name   HN) 4.315 2.328 2.328 weight 1.000 ! spec=15Nnoesy, no=644, id=2959, vol=1.302000e+04
assign (segid "   B" and resid   74 and name  HD1) (segid "   B" and resid   74 and name   HN) 4.315 2.328 2.328 weight 1.000 ! spec=15Nnoesy, no=644, id=2959, vol=1.302000e+04
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   76 and name   HN) 3.714 1.724 1.724 weight 1.000 ! spec=15Nnoesy, no=645, id=2960, vol=8.999000e+03
assign (segid "   B" and resid   74 and name   HN) (segid "   B" and resid   76 and name   HN) 3.714 1.724 1.724 weight 1.000 ! spec=15Nnoesy, no=645, id=2960, vol=8.999000e+03
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HN) 3.820 1.824 1.824 weight 1.000 ! spec=15Nnoesy, no=646, id=2961, vol=9.204000e+03
assign (segid "   B" and resid   21 and name   HN) (segid "   B" and resid   20 and name   HN) 3.820 1.824 1.824 weight 1.000 ! spec=15Nnoesy, no=646, id=2961, vol=9.204000e+03
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   20 and name   HN) 3.298 1.360 1.360 weight 1.000 ! spec=15Nnoesy, no=648, id=2962, vol=9.067000e+03
assign (segid "   B" and resid   19 and name  HB2) (segid "   B" and resid   20 and name   HN) 3.298 1.360 1.360 weight 1.000 ! spec=15Nnoesy, no=648, id=2962, vol=9.067000e+03
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   20 and name   HN) 3.808 1.812 1.812 weight 1.000 ! spec=15Nnoesy, no=649, id=2963, vol=1.032000e+04
assign (segid "   B" and resid   19 and name   HN) (segid "   B" and resid   20 and name   HN) 3.808 1.812 1.812 weight 1.000 ! spec=15Nnoesy, no=649, id=2963, vol=1.032000e+04
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   20 and name   HN) 3.684 1.696 1.696 weight 1.000 ! spec=15Nnoesy, no=650, id=2964, vol=6.862000e+03
assign (segid "   B" and resid   56 and name   HA) (segid "   B" and resid   20 and name   HN) 3.684 1.696 1.696 weight 1.000 ! spec=15Nnoesy, no=650, id=2964, vol=6.862000e+03
assign (segid "   A" and resid   20 and name HG12) (segid "   A" and resid   20 and name   HN) 3.010 1.132 1.132 weight 1.000 ! spec=15Nnoesy, no=651, id=2965, vol=2.295000e+04
    or (segid "   A" and resid   20 and name HG11) (segid "   A" and resid   20 and name   HN)
    or (segid "   A" and resid   20 and name HG13) (segid "   A" and resid   20 and name   HN)
assign (segid "   B" and resid   20 and name HG12) (segid "   B" and resid   20 and name   HN) 3.010 1.132 1.132 weight 1.000 ! spec=15Nnoesy, no=651, id=2965, vol=2.295000e+04
    or (segid "   B" and resid   20 and name HG11) (segid "   B" and resid   20 and name   HN)
    or (segid "   B" and resid   20 and name HG13) (segid "   B" and resid   20 and name   HN)
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name   HN) 2.861 1.023 1.023 weight 1.000 ! spec=15Nnoesy, no=652, id=2966, vol=1.126000e+04
assign (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   20 and name   HN) 2.861 1.023 1.023 weight 1.000 ! spec=15Nnoesy, no=652, id=2966, vol=1.126000e+04
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   20 and name   HN) 3.846 1.848 1.848 weight 1.000 ! spec=15Nnoesy, no=653, id=2967, vol=7.761000e+03
assign (segid "   B" and resid   55 and name   HA) (segid "   B" and resid   20 and name   HN) 3.846 1.848 1.848 weight 1.000 ! spec=15Nnoesy, no=653, id=2967, vol=7.761000e+03
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   20 and name   HN) 4.441 2.465 2.465 weight 1.000 ! spec=15Nnoesy, no=654, id=2968, vol=6.420000e+03
assign (segid "   B" and resid   19 and name  HB1) (segid "   B" and resid   20 and name   HN) 4.441 2.465 2.465 weight 1.000 ! spec=15Nnoesy, no=654, id=2968, vol=6.420000e+03
assign (segid "   A" and resid  118 and name  HB1) (segid "   A" and resid  118 and name   HN) 3.740 1.749 1.749 weight 1.000 ! spec=15Nnoesy, no=660, id=2974, vol=4.545000e+03
assign (segid "   B" and resid  118 and name  HB1) (segid "   B" and resid  118 and name   HN) 3.740 1.749 1.749 weight 1.000 ! spec=15Nnoesy, no=660, id=2974, vol=4.545000e+03
assign (segid "   A" and resid  117 and name   HB) (segid "   A" and resid  118 and name   HN) 2.074 0.537 0.537 weight 1.000 ! spec=15Nnoesy, no=661, id=2975, vol=4.551000e+04
assign (segid "   B" and resid  117 and name   HB) (segid "   B" and resid  118 and name   HN) 2.074 0.537 0.537 weight 1.000 ! spec=15Nnoesy, no=661, id=2975, vol=4.551000e+04
assign (segid "   A" and resid  118 and name  HB2) (segid "   A" and resid  118 and name   HN) 2.988 1.116 1.116 weight 1.000 ! spec=15Nnoesy, no=662, id=2976, vol=9.397000e+03
assign (segid "   B" and resid  118 and name  HB2) (segid "   B" and resid  118 and name   HN) 2.988 1.116 1.116 weight 1.000 ! spec=15Nnoesy, no=662, id=2976, vol=9.397000e+03
assign (segid "   A" and resid  118 and name   HA) (segid "   A" and resid  118 and name   HN) 2.482 0.770 0.770 weight 1.000 ! spec=15Nnoesy, no=663, id=2977, vol=2.700000e+04
assign (segid "   B" and resid  118 and name   HA) (segid "   B" and resid  118 and name   HN) 2.482 0.770 0.770 weight 1.000 ! spec=15Nnoesy, no=663, id=2977, vol=2.700000e+04
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   41 and name   HN) 2.343 0.686 0.686 weight 1.000 ! spec=15Nnoesy, no=669, id=2983, vol=3.954000e+04
    or (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   40 and name  HB3) (segid "   A" and resid   41 and name   HN)
assign (segid "   B" and resid   40 and name  HB2) (segid "   B" and resid   41 and name   HN) 2.343 0.686 0.686 weight 1.000 ! spec=15Nnoesy, no=669, id=2983, vol=3.954000e+04
    or (segid "   B" and resid   40 and name  HB1) (segid "   B" and resid   41 and name   HN)
    or (segid "   B" and resid   40 and name  HB3) (segid "   B" and resid   41 and name   HN)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name   HN) 2.548 0.811 0.811 weight 1.000 ! spec=15Nnoesy, no=671, id=2985, vol=1.741000e+04
assign (segid "   B" and resid   41 and name   HN) (segid "   B" and resid   40 and name   HN) 2.548 0.811 0.811 weight 1.000 ! spec=15Nnoesy, no=671, id=2985, vol=1.741000e+04
assign (segid "   A" and resid   39 and name HD12) (segid "   A" and resid   41 and name   HN) 3.481 1.515 1.515 weight 1.000 ! spec=15Nnoesy, no=672, id=2986, vol=1.523000e+04
    or (segid "   A" and resid   39 and name HD11) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   39 and name HD13) (segid "   A" and resid   41 and name   HN)
assign (segid "   B" and resid   39 and name HD12) (segid "   B" and resid   41 and name   HN) 3.481 1.515 1.515 weight 1.000 ! spec=15Nnoesy, no=672, id=2986, vol=1.523000e+04
    or (segid "   B" and resid   39 and name HD11) (segid "   B" and resid   41 and name   HN)
    or (segid "   B" and resid   39 and name HD13) (segid "   B" and resid   41 and name   HN)
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   42 and name   HN) 4.105 2.107 2.107 weight 1.000 ! spec=15Nnoesy, no=675, id=2988, vol=6.291000e+03
assign (segid "   B" and resid   49 and name   HA) (segid "   B" and resid   42 and name   HN) 4.105 2.107 2.107 weight 1.000 ! spec=15Nnoesy, no=675, id=2988, vol=6.291000e+03
assign (segid "   A" and resid  115 and name   HN) (segid "   A" and resid   76 and name   HA) 3.972 1.972 1.972 weight 1.000 ! spec=15Nnoesy, no=684, id=2996, vol=5.697000e+03
assign (segid "   B" and resid  115 and name   HN) (segid "   B" and resid   76 and name   HA) 3.972 1.972 1.972 weight 1.000 ! spec=15Nnoesy, no=684, id=2996, vol=5.697000e+03
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid  112 and name HD12) 4.694 2.754 2.754 weight 1.000 ! spec=15Nnoesy, no=689, id=2997, vol=3.283000e+03
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid  112 and name HD11)
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid  112 and name HD13)
assign (segid "   B" and resid   77 and name   HN) (segid "   B" and resid  112 and name HD12) 4.694 2.754 2.754 weight 1.000 ! spec=15Nnoesy, no=689, id=2997, vol=3.283000e+03
    or (segid "   B" and resid   77 and name   HN) (segid "   B" and resid  112 and name HD11)
    or (segid "   B" and resid   77 and name   HN) (segid "   B" and resid  112 and name HD13)
assign (segid "   A" and resid  115 and name  HD1) (segid "   A" and resid   77 and name   HN) 4.437 2.461 2.461 weight 1.000 ! spec=15Nnoesy, no=690, id=2998, vol=3.528000e+03
assign (segid "   B" and resid  115 and name  HD1) (segid "   B" and resid   77 and name   HN) 4.437 2.461 2.461 weight 1.000 ! spec=15Nnoesy, no=690, id=2998, vol=3.528000e+03
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   77 and name   HN) 2.347 0.689 0.689 weight 1.000 ! spec=15Nnoesy, no=691, id=2999, vol=1.292000e+04
assign (segid "   B" and resid   76 and name   HA) (segid "   B" and resid   77 and name   HN) 2.347 0.689 0.689 weight 1.000 ! spec=15Nnoesy, no=691, id=2999, vol=1.292000e+04
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid  114 and name   HA) 3.519 1.548 1.548 weight 1.000 ! spec=15Nnoesy, no=692, id=3000, vol=4.852000e+03
assign (segid "   B" and resid   77 and name   HN) (segid "   B" and resid  114 and name   HA) 3.519 1.548 1.548 weight 1.000 ! spec=15Nnoesy, no=692, id=3000, vol=4.852000e+03
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name HD21) 4.351 2.366 2.366 weight 1.000 ! spec=15Nnoesy, no=694, id=3002, vol=3.790000e+03
assign (segid "   B" and resid   77 and name   HN) (segid "   B" and resid   77 and name HD21) 4.351 2.366 2.366 weight 1.000 ! spec=15Nnoesy, no=694, id=3002, vol=3.790000e+03
assign (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   46 and name   HN) 4.510 2.543 2.543 weight 1.000 ! spec=15Nnoesy, no=699, id=3007, vol=3.659000e+03
assign (segid "   B" and resid   46 and name HD21) (segid "   B" and resid   46 and name   HN) 4.510 2.543 2.543 weight 1.000 ! spec=15Nnoesy, no=699, id=3007, vol=3.659000e+03
assign (segid "   A" and resid    5 and name   HA) (segid "   A" and resid    6 and name   HN) 2.300 0.661 0.661 weight 1.000 ! spec=15Nnoesy, no=702, id=3009, vol=4.454000e+04
assign (segid "   B" and resid    5 and name   HA) (segid "   B" and resid    6 and name   HN) 2.300 0.661 0.661 weight 1.000 ! spec=15Nnoesy, no=702, id=3009, vol=4.454000e+04
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    6 and name   HN) 3.260 1.329 1.329 weight 1.000 ! spec=15Nnoesy, no=703, id=3010, vol=1.891000e+04
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    6 and name   HN)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    6 and name   HN)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    6 and name   HN) 3.260 1.329 1.329 weight 1.000 ! spec=15Nnoesy, no=703, id=3010, vol=1.891000e+04
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    6 and name   HN)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    6 and name   HN)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name   HN) 2.688 0.903 0.903 weight 1.000 ! spec=15Nnoesy, no=704, id=3011, vol=1.310000e+04
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    6 and name   HN) 2.688 0.903 0.903 weight 1.000 ! spec=15Nnoesy, no=704, id=3011, vol=1.310000e+04
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    6 and name   HN) 4.456 2.482 2.482 weight 1.000 ! spec=15Nnoesy, no=705, id=3012, vol=6.404000e+03
assign (segid "   B" and resid    5 and name  HB2) (segid "   B" and resid    6 and name   HN) 4.456 2.482 2.482 weight 1.000 ! spec=15Nnoesy, no=705, id=3012, vol=6.404000e+03
assign (segid "   A" and resid    5 and name  HG2) (segid "   A" and resid    6 and name   HN) 3.146 1.237 1.237 weight 1.000 ! spec=15Nnoesy, no=706, id=3013, vol=1.816000e+04
assign (segid "   B" and resid    5 and name  HG2) (segid "   B" and resid    6 and name   HN) 3.146 1.237 1.237 weight 1.000 ! spec=15Nnoesy, no=706, id=3013, vol=1.816000e+04
assign (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    6 and name   HN) 2.364 0.698 0.698 weight 1.000 ! spec=15Nnoesy, no=707, id=3014, vol=2.462000e+04
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    6 and name   HN)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    6 and name   HN)
assign (segid "   B" and resid    6 and name HG22) (segid "   B" and resid    6 and name   HN) 2.364 0.698 0.698 weight 1.000 ! spec=15Nnoesy, no=707, id=3014, vol=2.462000e+04
    or (segid "   B" and resid    6 and name HG21) (segid "   B" and resid    6 and name   HN)
    or (segid "   B" and resid    6 and name HG23) (segid "   B" and resid    6 and name   HN)
assign (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid    6 and name   HN) 4.189 2.193 2.193 weight 1.000 ! spec=15Nnoesy, no=708, id=3015, vol=5.568000e+03
assign (segid "   B" and resid    5 and name  HB1) (segid "   B" and resid    6 and name   HN) 4.189 2.193 2.193 weight 1.000 ! spec=15Nnoesy, no=708, id=3015, vol=5.568000e+03
assign (segid "   A" and resid    6 and name   HB) (segid "   A" and resid    6 and name   HN) 2.756 0.950 0.950 weight 1.000 ! spec=15Nnoesy, no=709, id=3016, vol=1.816000e+04
assign (segid "   B" and resid    6 and name   HB) (segid "   B" and resid    6 and name   HN) 2.756 0.950 0.950 weight 1.000 ! spec=15Nnoesy, no=709, id=3016, vol=1.816000e+04
assign (segid "   A" and resid   21 and name  HE1) (segid "   A" and resid   21 and name  HZ2) 3.446 1.484 1.484 weight 1.000 ! spec=15Nnoesy, no=710, id=3017, vol=8.170000e+03
assign (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   21 and name  HZ2) 3.446 1.484 1.484 weight 1.000 ! spec=15Nnoesy, no=710, id=3017, vol=8.170000e+03
assign (segid "   A" and resid   21 and name  HE1) (segid "   A" and resid   21 and name  HD1) 2.980 1.110 1.110 weight 1.000 ! spec=15Nnoesy, no=713, id=3018, vol=1.886000e+04
assign (segid "   B" and resid   21 and name  HE1) (segid "   B" and resid   21 and name  HD1) 2.980 1.110 1.110 weight 1.000 ! spec=15Nnoesy, no=713, id=3018, vol=1.886000e+04
assign (segid "   A" and resid   92 and name HG21) (segid "   A" and resid   92 and name   HN) 2.303 0.663 0.663 weight 1.000 ! spec=15Nnoesy, no=714, id=3019, vol=1.770000e+04
    or (segid "   A" and resid   92 and name HG22) (segid "   A" and resid   92 and name   HN)
    or (segid "   A" and resid   92 and name HG23) (segid "   A" and resid   92 and name   HN)
assign (segid "   B" and resid   92 and name HG21) (segid "   B" and resid   92 and name   HN) 2.303 0.663 0.663 weight 1.000 ! spec=15Nnoesy, no=714, id=3019, vol=1.770000e+04
    or (segid "   B" and resid   92 and name HG22) (segid "   B" and resid   92 and name   HN)
    or (segid "   B" and resid   92 and name HG23) (segid "   B" and resid   92 and name   HN)
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   92 and name   HN) 2.671 0.892 0.892 weight 1.000 ! spec=15Nnoesy, no=716, id=3020, vol=1.012000e+04
assign (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   92 and name   HN) 2.671 0.892 0.892 weight 1.000 ! spec=15Nnoesy, no=716, id=3020, vol=1.012000e+04
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name   HN) 3.061 1.171 1.171 weight 1.000 ! spec=15Nnoesy, no=717, id=3021, vol=5.552000e+03
assign (segid "   B" and resid   92 and name   HA) (segid "   B" and resid   92 and name   HN) 3.061 1.171 1.171 weight 1.000 ! spec=15Nnoesy, no=717, id=3021, vol=5.552000e+03
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   37 and name   HA) 4.021 2.021 2.021 weight 1.000 ! spec=15Nnoesy, no=720, id=3024, vol=4.267000e+03
assign (segid "   B" and resid   92 and name   HN) (segid "   B" and resid   37 and name   HA) 4.021 2.021 2.021 weight 1.000 ! spec=15Nnoesy, no=720, id=3024, vol=4.267000e+03
assign (segid "   A" and resid   92 and name   HB) (segid "   A" and resid   92 and name   HN) 3.175 1.260 1.260 weight 1.000 ! spec=15Nnoesy, no=721, id=3025, vol=4.858000e+03
assign (segid "   B" and resid   92 and name   HB) (segid "   B" and resid   92 and name   HN) 3.175 1.260 1.260 weight 1.000 ! spec=15Nnoesy, no=721, id=3025, vol=4.858000e+03
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   92 and name   HN) 3.944 1.945 1.945 weight 1.000 ! spec=15Nnoesy, no=722, id=3026, vol=4.858000e+03
assign (segid "   B" and resid   38 and name   HA) (segid "   B" and resid   92 and name   HN) 3.944 1.945 1.945 weight 1.000 ! spec=15Nnoesy, no=722, id=3026, vol=4.858000e+03
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid  115 and name  HB1) 5.216 3.401 3.401 weight 1.000 ! spec=15Nnoesy, no=734, id=3035, vol=3.744000e+03
assign (segid "   B" and resid   75 and name   HN) (segid "   B" and resid  115 and name  HB1) 5.216 3.401 3.401 weight 1.000 ! spec=15Nnoesy, no=734, id=3035, vol=3.744000e+03
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name  HB2) 4.182 2.186 2.186 weight 1.000 ! spec=15Nnoesy, no=736, id=3037, vol=3.756000e+03
assign (segid "   B" and resid   99 and name   HN) (segid "   B" and resid   99 and name  HB2) 4.182 2.186 2.186 weight 1.000 ! spec=15Nnoesy, no=736, id=3037, vol=3.756000e+03
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name  HB1) 3.315 1.374 1.374 weight 1.000 ! spec=15Nnoesy, no=739, id=3038, vol=4.687000e+03
assign (segid "   B" and resid   99 and name   HN) (segid "   B" and resid   99 and name  HB1) 3.315 1.374 1.374 weight 1.000 ! spec=15Nnoesy, no=739, id=3038, vol=4.687000e+03
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name   HN) 3.143 1.235 1.235 weight 1.000 ! spec=15Nnoesy, no=741, id=3039, vol=4.966000e+03
assign (segid "   B" and resid  102 and name   HA) (segid "   B" and resid  102 and name   HN) 3.143 1.235 1.235 weight 1.000 ! spec=15Nnoesy, no=741, id=3039, vol=4.966000e+03
assign (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  102 and name   HN) 2.867 1.028 1.028 weight 1.000 ! spec=15Nnoesy, no=742, id=3040, vol=6.348000e+03
assign (segid "   B" and resid  101 and name   HA) (segid "   B" and resid  102 and name   HN) 2.867 1.028 1.028 weight 1.000 ! spec=15Nnoesy, no=742, id=3040, vol=6.348000e+03
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    7 and name   HN) 4.045 2.045 2.045 weight 1.000 ! spec=15Nnoesy, no=748, id=3046, vol=3.807000e+03
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    7 and name   HN)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    7 and name   HN)
assign (segid "   B" and resid    6 and name HG12) (segid "   B" and resid    7 and name   HN) 4.045 2.045 2.045 weight 1.000 ! spec=15Nnoesy, no=748, id=3046, vol=3.807000e+03
    or (segid "   B" and resid    6 and name HG11) (segid "   B" and resid    7 and name   HN)
    or (segid "   B" and resid    6 and name HG13) (segid "   B" and resid    7 and name   HN)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    7 and name   HN) 2.420 0.732 0.732 weight 1.000 ! spec=15Nnoesy, no=749, id=3047, vol=2.462000e+04
assign (segid "   B" and resid    6 and name   HA) (segid "   B" and resid    7 and name   HN) 2.420 0.732 0.732 weight 1.000 ! spec=15Nnoesy, no=749, id=3047, vol=2.462000e+04
assign (segid "   A" and resid    7 and name  HB1) (segid "   A" and resid    7 and name   HN) 3.274 1.340 1.340 weight 1.000 ! spec=15Nnoesy, no=750, id=3048, vol=7.443000e+03
assign (segid "   B" and resid    7 and name  HB1) (segid "   B" and resid    7 and name   HN) 3.274 1.340 1.340 weight 1.000 ! spec=15Nnoesy, no=750, id=3048, vol=7.443000e+03
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    7 and name   HN) 2.899 1.050 1.050 weight 1.000 ! spec=15Nnoesy, no=752, id=3050, vol=1.208000e+04
assign (segid "   B" and resid    4 and name  HB2) (segid "   B" and resid    7 and name   HN) 2.899 1.050 1.050 weight 1.000 ! spec=15Nnoesy, no=752, id=3050, vol=1.208000e+04
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    7 and name   HN) 3.300 1.362 1.362 weight 1.000 ! spec=15Nnoesy, no=754, id=3052, vol=1.208000e+04
assign (segid "   B" and resid    7 and name  HB2) (segid "   B" and resid    7 and name   HN) 3.300 1.362 1.362 weight 1.000 ! spec=15Nnoesy, no=754, id=3052, vol=1.208000e+04
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   35 and name   HA) 2.861 1.023 1.023 weight 1.000 ! spec=15Nnoesy, no=755, id=3053, vol=1.196000e+04
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   35 and name   HA) 2.861 1.023 1.023 weight 1.000 ! spec=15Nnoesy, no=755, id=3053, vol=1.196000e+04
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name   HN) 3.863 1.865 1.865 weight 1.000 ! spec=15Nnoesy, no=757, id=3055, vol=6.629000e+03
assign (segid "   B" and resid   36 and name   HN) (segid "   B" and resid   35 and name   HN) 3.863 1.865 1.865 weight 1.000 ! spec=15Nnoesy, no=757, id=3055, vol=6.629000e+03
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   35 and name   HN) 1.854 0.430 0.430 weight 1.000 ! spec=15Nnoesy, no=760, id=3058, vol=4.956000e+04
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   35 and name   HN) 1.854 0.430 0.430 weight 1.000 ! spec=15Nnoesy, no=760, id=3058, vol=4.956000e+04
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name   HN) 3.775 1.781 1.781 weight 1.000 ! spec=15Nnoesy, no=761, id=3059, vol=1.529000e+04
assign (segid "   B" and resid   35 and name  HG1) (segid "   B" and resid   35 and name   HN) 3.775 1.781 1.781 weight 1.000 ! spec=15Nnoesy, no=761, id=3059, vol=1.529000e+04
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   35 and name   HN) 3.703 1.714 1.714 weight 1.000 ! spec=15Nnoesy, no=762, id=3060, vol=1.875000e+04
assign (segid "   B" and resid   34 and name  HG1) (segid "   B" and resid   35 and name   HN) 3.703 1.714 1.714 weight 1.000 ! spec=15Nnoesy, no=762, id=3060, vol=1.875000e+04
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   35 and name   HN) 2.981 1.111 1.111 weight 1.000 ! spec=15Nnoesy, no=764, id=3062, vol=2.764000e+04
assign (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   35 and name   HN) 2.981 1.111 1.111 weight 1.000 ! spec=15Nnoesy, no=764, id=3062, vol=2.764000e+04
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name   HN) 4.010 2.010 2.010 weight 1.000 ! spec=15Nnoesy, no=765, id=3063, vol=1.194000e+04
assign (segid "   B" and resid   35 and name   HN) (segid "   B" and resid   34 and name   HN) 4.010 2.010 2.010 weight 1.000 ! spec=15Nnoesy, no=765, id=3063, vol=1.194000e+04
assign (segid "   A" and resid   51 and name HE22) (segid "   A" and resid   51 and name  HG2) 4.615 2.663 2.663 weight 1.000 ! spec=15Nnoesy, no=766, id=3064, vol=3.716000e+03
assign (segid "   B" and resid   51 and name HE22) (segid "   B" and resid   51 and name  HG2) 4.615 2.663 2.663 weight 1.000 ! spec=15Nnoesy, no=766, id=3064, vol=3.716000e+03
assign (segid "   A" and resid   87 and name HG12) (segid "   A" and resid   88 and name   HN) 3.888 1.889 1.889 weight 1.000 ! spec=15Nnoesy, no=771, id=3066, vol=7.102000e+03
    or (segid "   A" and resid   87 and name HG11) (segid "   A" and resid   88 and name   HN)
    or (segid "   A" and resid   87 and name HG13) (segid "   A" and resid   88 and name   HN)
assign (segid "   B" and resid   87 and name HG12) (segid "   B" and resid   88 and name   HN) 3.888 1.889 1.889 weight 1.000 ! spec=15Nnoesy, no=771, id=3066, vol=7.102000e+03
    or (segid "   B" and resid   87 and name HG11) (segid "   B" and resid   88 and name   HN)
    or (segid "   B" and resid   87 and name HG13) (segid "   B" and resid   88 and name   HN)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name   HA) 3.217 1.294 1.294 weight 1.000 ! spec=15Nnoesy, no=775, id=3069, vol=6.862000e+03
assign (segid "   B" and resid   85 and name   HN) (segid "   B" and resid   85 and name   HA) 3.217 1.294 1.294 weight 1.000 ! spec=15Nnoesy, no=775, id=3069, vol=6.862000e+03
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name   HB) 2.884 1.040 1.040 weight 1.000 ! spec=15Nnoesy, no=778, id=3071, vol=9.249000e+03
assign (segid "   B" and resid   85 and name   HN) (segid "   B" and resid   85 and name   HB) 2.884 1.040 1.040 weight 1.000 ! spec=15Nnoesy, no=778, id=3071, vol=9.249000e+03
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   86 and name   HN) 4.273 2.282 2.282 weight 1.000 ! spec=15Nnoesy, no=779, id=3072, vol=3.351000e+03
assign (segid "   B" and resid   85 and name   HN) (segid "   B" and resid   86 and name   HN) 4.273 2.282 2.282 weight 1.000 ! spec=15Nnoesy, no=779, id=3072, vol=3.351000e+03
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   85 and name   HN) 4.097 2.099 2.099 weight 1.000 ! spec=15Nnoesy, no=780, id=3073, vol=3.238000e+03
assign (segid "   B" and resid   86 and name   HA) (segid "   B" and resid   85 and name   HN) 4.097 2.099 2.099 weight 1.000 ! spec=15Nnoesy, no=780, id=3073, vol=3.238000e+03
assign (segid "   A" and resid   84 and name  HB1) (segid "   A" and resid   85 and name   HN) 3.962 1.962 1.962 weight 1.000 ! spec=15Nnoesy, no=782, id=3075, vol=1.265000e+04
assign (segid "   B" and resid   84 and name  HB1) (segid "   B" and resid   85 and name   HN) 3.962 1.962 1.962 weight 1.000 ! spec=15Nnoesy, no=782, id=3075, vol=1.265000e+04
assign (segid "   A" and resid  106 and name HG21) (segid "   A" and resid   85 and name   HN) 2.898 1.050 1.050 weight 1.000 ! spec=15Nnoesy, no=784, id=3077, vol=1.027000e+04
    or (segid "   A" and resid  106 and name HG22) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid  106 and name HG23) (segid "   A" and resid   85 and name   HN)
assign (segid "   B" and resid  106 and name HG21) (segid "   B" and resid   85 and name   HN) 2.898 1.050 1.050 weight 1.000 ! spec=15Nnoesy, no=784, id=3077, vol=1.027000e+04
    or (segid "   B" and resid  106 and name HG22) (segid "   B" and resid   85 and name   HN)
    or (segid "   B" and resid  106 and name HG23) (segid "   B" and resid   85 and name   HN)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid  104 and name   HN) 2.944 1.083 1.083 weight 1.000 ! spec=15Nnoesy, no=786, id=3078, vol=7.136000e+03
assign (segid "   B" and resid   85 and name   HN) (segid "   B" and resid  104 and name   HN) 2.944 1.083 1.083 weight 1.000 ! spec=15Nnoesy, no=786, id=3078, vol=7.136000e+03
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid  104 and name   HA) 3.728 1.737 1.737 weight 1.000 ! spec=15Nnoesy, no=787, id=3079, vol=7.511000e+03
assign (segid "   B" and resid   85 and name   HN) (segid "   B" and resid  104 and name   HA) 3.728 1.737 1.737 weight 1.000 ! spec=15Nnoesy, no=787, id=3079, vol=7.511000e+03
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid   29 and name   HN) 4.869 2.963 2.963 weight 1.000 ! spec=15Nnoesy, no=789, id=3081, vol=4.557000e+03
assign (segid "   B" and resid  103 and name  HB1) (segid "   B" and resid   29 and name   HN) 4.869 2.963 2.963 weight 1.000 ! spec=15Nnoesy, no=789, id=3081, vol=4.557000e+03
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name   HN) 3.179 1.263 1.263 weight 1.000 ! spec=15Nnoesy, no=795, id=3084, vol=5.865000e+03
assign (segid "   B" and resid   29 and name   HA) (segid "   B" and resid   29 and name   HN) 3.179 1.263 1.263 weight 1.000 ! spec=15Nnoesy, no=795, id=3084, vol=5.865000e+03
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   94 and name   HN) 3.603 1.623 1.623 weight 1.000 ! spec=15Nnoesy, no=799, id=3088, vol=5.022000e+03
assign (segid "   B" and resid   93 and name   HA) (segid "   B" and resid   94 and name   HN) 3.603 1.623 1.623 weight 1.000 ! spec=15Nnoesy, no=799, id=3088, vol=5.022000e+03
assign (segid "   A" and resid   93 and name   HN) (segid "   A" and resid   94 and name   HN) 3.319 1.377 1.377 weight 1.000 ! spec=15Nnoesy, no=800, id=3089, vol=5.142000e+03
assign (segid "   B" and resid   93 and name   HN) (segid "   B" and resid   94 and name   HN) 3.319 1.377 1.377 weight 1.000 ! spec=15Nnoesy, no=800, id=3089, vol=5.142000e+03
assign (segid "   A" and resid   94 and name  HG2) (segid "   A" and resid   94 and name   HN) 5.250 3.445 3.445 weight 1.000 ! spec=15Nnoesy, no=803, id=3091, vol=3.909000e+03
assign (segid "   B" and resid   94 and name  HG2) (segid "   B" and resid   94 and name   HN) 5.250 3.445 3.445 weight 1.000 ! spec=15Nnoesy, no=803, id=3091, vol=3.909000e+03
assign (segid "   A" and resid   94 and name  HG1) (segid "   A" and resid   94 and name   HN) 4.117 2.118 2.118 weight 1.000 ! spec=15Nnoesy, no=804, id=3092, vol=6.412000e+03
assign (segid "   B" and resid   94 and name  HG1) (segid "   B" and resid   94 and name   HN) 4.117 2.118 2.118 weight 1.000 ! spec=15Nnoesy, no=804, id=3092, vol=6.412000e+03
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   28 and name   HN) 3.269 1.336 1.336 weight 1.000 ! spec=15Nnoesy, no=815, id=3097, vol=1.425000e+04
assign (segid "   B" and resid   36 and name   HA) (segid "   B" and resid   28 and name   HN) 3.269 1.336 1.336 weight 1.000 ! spec=15Nnoesy, no=815, id=3097, vol=1.425000e+04
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name   HA) 2.713 0.920 0.920 weight 1.000 ! spec=15Nnoesy, no=816, id=3098, vol=1.298000e+04
assign (segid "   B" and resid   28 and name   HN) (segid "   B" and resid   28 and name   HA) 2.713 0.920 0.920 weight 1.000 ! spec=15Nnoesy, no=816, id=3098, vol=1.298000e+04
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   28 and name   HN) 3.848 1.851 1.851 weight 1.000 ! spec=15Nnoesy, no=817, id=3099, vol=6.613000e+03
assign (segid "   B" and resid   38 and name   HN) (segid "   B" and resid   28 and name   HN) 3.848 1.851 1.851 weight 1.000 ! spec=15Nnoesy, no=817, id=3099, vol=6.613000e+03
assign (segid "   A" and resid   27 and name   HB) (segid "   A" and resid   28 and name   HN) 2.760 0.952 0.952 weight 1.000 ! spec=15Nnoesy, no=819, id=3101, vol=1.861000e+04
assign (segid "   B" and resid   27 and name   HB) (segid "   B" and resid   28 and name   HN) 2.760 0.952 0.952 weight 1.000 ! spec=15Nnoesy, no=819, id=3101, vol=1.861000e+04
assign (segid "   A" and resid   27 and name HG21) (segid "   A" and resid   28 and name   HN) 3.293 1.355 1.355 weight 1.000 ! spec=15Nnoesy, no=821, id=3102, vol=1.977000e+04
    or (segid "   A" and resid   27 and name HG22) (segid "   A" and resid   28 and name   HN)
    or (segid "   A" and resid   27 and name HG23) (segid "   A" and resid   28 and name   HN)
assign (segid "   B" and resid   27 and name HG21) (segid "   B" and resid   28 and name   HN) 3.293 1.355 1.355 weight 1.000 ! spec=15Nnoesy, no=821, id=3102, vol=1.977000e+04
    or (segid "   B" and resid   27 and name HG22) (segid "   B" and resid   28 and name   HN)
    or (segid "   B" and resid   27 and name HG23) (segid "   B" and resid   28 and name   HN)
assign (segid "   A" and resid   28 and name  HB2) (segid "   A" and resid   28 and name   HN) 2.110 0.557 0.557 weight 1.000 ! spec=15Nnoesy, no=823, id=3104, vol=3.163000e+04
    or (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name   HN)
    or (segid "   A" and resid   28 and name  HB3) (segid "   A" and resid   28 and name   HN)
assign (segid "   B" and resid   28 and name  HB2) (segid "   B" and resid   28 and name   HN) 2.110 0.557 0.557 weight 1.000 ! spec=15Nnoesy, no=823, id=3104, vol=3.163000e+04
    or (segid "   B" and resid   28 and name  HB1) (segid "   B" and resid   28 and name   HN)
    or (segid "   B" and resid   28 and name  HB3) (segid "   B" and resid   28 and name   HN)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name HE22) 4.892 2.991 2.991 weight 1.000 ! spec=15Nnoesy, no=830, id=3110, vol=3.375000e+03
assign (segid "   B" and resid   51 and name   HN) (segid "   B" and resid   51 and name HE22) 4.892 2.991 2.991 weight 1.000 ! spec=15Nnoesy, no=830, id=3110, vol=3.375000e+03
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name   HN) 2.819 0.993 0.993 weight 1.000 ! spec=15Nnoesy, no=831, id=3111, vol=1.873000e+04
assign (segid "   B" and resid   64 and name   HB) (segid "   B" and resid   64 and name   HN) 2.819 0.993 0.993 weight 1.000 ! spec=15Nnoesy, no=831, id=3111, vol=1.873000e+04
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name  HD2) 4.213 2.219 2.219 weight 1.000 ! spec=15Nnoesy, no=832, id=3112, vol=6.026000e+03
assign (segid "   B" and resid   64 and name   HN) (segid "   B" and resid   63 and name  HD2) 4.213 2.219 2.219 weight 1.000 ! spec=15Nnoesy, no=832, id=3112, vol=6.026000e+03
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   64 and name   HN) 2.694 0.907 0.907 weight 1.000 ! spec=15Nnoesy, no=833, id=3113, vol=1.237000e+04
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   64 and name   HN)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   64 and name   HN)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   64 and name   HN) 2.694 0.907 0.907 weight 1.000 ! spec=15Nnoesy, no=833, id=3113, vol=1.237000e+04
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   64 and name   HN)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   64 and name   HN)
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   64 and name   HN) 2.800 0.980 0.980 weight 1.000 ! spec=15Nnoesy, no=835, id=3115, vol=1.030000e+04
assign (segid "   B" and resid   63 and name  HB2) (segid "   B" and resid   64 and name   HN) 2.800 0.980 0.980 weight 1.000 ! spec=15Nnoesy, no=835, id=3115, vol=1.030000e+04
assign (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   64 and name   HN) 3.517 1.546 1.546 weight 1.000 ! spec=15Nnoesy, no=839, id=3118, vol=6.999000e+03
assign (segid "   B" and resid   63 and name   HA) (segid "   B" and resid   64 and name   HN) 3.517 1.546 1.546 weight 1.000 ! spec=15Nnoesy, no=839, id=3118, vol=6.999000e+03
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   12 and name   HN) 3.039 1.154 1.154 weight 1.000 ! spec=15Nnoesy, no=853, id=3128, vol=5.849000e+03
assign (segid "   B" and resid   12 and name  HB2) (segid "   B" and resid   12 and name   HN) 3.039 1.154 1.154 weight 1.000 ! spec=15Nnoesy, no=853, id=3128, vol=5.849000e+03
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HA) 2.858 1.021 1.021 weight 1.000 ! spec=15Nnoesy, no=854, id=3129, vol=1.429000e+04
assign (segid "   B" and resid   12 and name   HN) (segid "   B" and resid   12 and name   HA) 2.858 1.021 1.021 weight 1.000 ! spec=15Nnoesy, no=854, id=3129, vol=1.429000e+04
assign (segid "   A" and resid   25 and name  HE2) (segid "   A" and resid   25 and name   HN) 5.713 4.080 4.080 weight 1.000 ! spec=15Nnoesy, no=857, id=3132, vol=4.665000e+03
assign (segid "   B" and resid   25 and name  HE2) (segid "   B" and resid   25 and name   HN) 5.713 4.080 4.080 weight 1.000 ! spec=15Nnoesy, no=857, id=3132, vol=4.665000e+03
assign (segid "   A" and resid   25 and name  HD2) (segid "   A" and resid   25 and name   HN) 4.579 2.621 2.621 weight 1.000 ! spec=15Nnoesy, no=859, id=3134, vol=5.898000e+03
assign (segid "   B" and resid   25 and name  HD2) (segid "   B" and resid   25 and name   HN) 4.579 2.621 2.621 weight 1.000 ! spec=15Nnoesy, no=859, id=3134, vol=5.898000e+03
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   23 and name  HA1) 3.897 1.898 1.898 weight 1.000 ! spec=15Nnoesy, no=860, id=3135, vol=5.046000e+03
assign (segid "   B" and resid   25 and name   HN) (segid "   B" and resid   23 and name  HA1) 3.897 1.898 1.898 weight 1.000 ! spec=15Nnoesy, no=860, id=3135, vol=5.046000e+03
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   25 and name   HN) 4.127 2.129 2.129 weight 1.000 ! spec=15Nnoesy, no=861, id=3136, vol=1.081000e+04
assign (segid "   B" and resid   25 and name  HD1) (segid "   B" and resid   25 and name   HN) 4.127 2.129 2.129 weight 1.000 ! spec=15Nnoesy, no=861, id=3136, vol=1.081000e+04
assign (segid "   A" and resid   25 and name  HE1) (segid "   A" and resid   25 and name   HN) 5.180 3.355 3.355 weight 1.000 ! spec=15Nnoesy, no=862, id=3137, vol=6.484000e+03
assign (segid "   B" and resid   25 and name  HE1) (segid "   B" and resid   25 and name   HN) 5.180 3.355 3.355 weight 1.000 ! spec=15Nnoesy, no=862, id=3137, vol=6.484000e+03
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name   HN) 2.516 0.791 0.791 weight 1.000 ! spec=15Nnoesy, no=867, id=3142, vol=1.507000e+04
assign (segid "   B" and resid   25 and name  HB2) (segid "   B" and resid   25 and name   HN) 2.516 0.791 0.791 weight 1.000 ! spec=15Nnoesy, no=867, id=3142, vol=1.507000e+04
assign (segid "   A" and resid   25 and name  HG2) (segid "   A" and resid   25 and name   HN) 4.426 2.449 2.449 weight 1.000 ! spec=15Nnoesy, no=869, id=3144, vol=5.247000e+03
assign (segid "   B" and resid   25 and name  HG2) (segid "   B" and resid   25 and name   HN) 4.426 2.449 2.449 weight 1.000 ! spec=15Nnoesy, no=869, id=3144, vol=5.247000e+03
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   98 and name   HN) 4.257 2.265 2.265 weight 1.000 ! spec=15Nnoesy, no=874, id=3149, vol=4.108000e+03
assign (segid "   B" and resid   99 and name   HA) (segid "   B" and resid   98 and name   HN) 4.257 2.265 2.265 weight 1.000 ! spec=15Nnoesy, no=874, id=3149, vol=4.108000e+03
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   90 and name HD12) 3.436 1.476 1.476 weight 1.000 ! spec=15Nnoesy, no=875, id=3150, vol=4.312000e+03
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   90 and name HD11)
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   90 and name HD13)
assign (segid "   B" and resid   98 and name   HN) (segid "   B" and resid   90 and name HD12) 3.436 1.476 1.476 weight 1.000 ! spec=15Nnoesy, no=875, id=3150, vol=4.312000e+03
    or (segid "   B" and resid   98 and name   HN) (segid "   B" and resid   90 and name HD11)
    or (segid "   B" and resid   98 and name   HN) (segid "   B" and resid   90 and name HD13)
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid  111 and name   HN) 3.314 1.373 1.373 weight 1.000 ! spec=15Nnoesy, no=878, id=3153, vol=8.238000e+03
assign (segid "   B" and resid   80 and name   HA) (segid "   B" and resid  111 and name   HN) 3.314 1.373 1.373 weight 1.000 ! spec=15Nnoesy, no=878, id=3153, vol=8.238000e+03
assign (segid "   A" and resid  111 and name   HB) (segid "   A" and resid  111 and name   HN) 2.928 1.071 1.071 weight 1.000 ! spec=15Nnoesy, no=881, id=3156, vol=1.237000e+04
assign (segid "   B" and resid  111 and name   HB) (segid "   B" and resid  111 and name   HN) 2.928 1.071 1.071 weight 1.000 ! spec=15Nnoesy, no=881, id=3156, vol=1.237000e+04
assign (segid "   A" and resid  111 and name   HN) (segid "   A" and resid  110 and name  HB1) 4.537 2.573 2.573 weight 1.000 ! spec=15Nnoesy, no=882, id=3157, vol=5.986000e+03
assign (segid "   B" and resid  111 and name   HN) (segid "   B" and resid  110 and name  HB1) 4.537 2.573 2.573 weight 1.000 ! spec=15Nnoesy, no=882, id=3157, vol=5.986000e+03
assign (segid "   A" and resid  111 and name   HN) (segid "   A" and resid  110 and name  HB2) 4.321 2.334 2.334 weight 1.000 ! spec=15Nnoesy, no=885, id=3159, vol=5.391000e+03
assign (segid "   B" and resid  111 and name   HN) (segid "   B" and resid  110 and name  HB2) 4.321 2.334 2.334 weight 1.000 ! spec=15Nnoesy, no=885, id=3159, vol=5.391000e+03
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   32 and name  HG1) 3.972 1.972 1.972 weight 1.000 ! spec=15Nnoesy, no=888, id=3162, vol=8.533000e+03
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   32 and name  HG1) 3.972 1.972 1.972 weight 1.000 ! spec=15Nnoesy, no=888, id=3162, vol=8.533000e+03
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   31 and name   HA) 3.556 1.580 1.580 weight 1.000 ! spec=15Nnoesy, no=891, id=3165, vol=4.483000e+03
assign (segid "   B" and resid   33 and name   HN) (segid "   B" and resid   31 and name   HA) 3.556 1.580 1.580 weight 1.000 ! spec=15Nnoesy, no=891, id=3165, vol=4.483000e+03
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name   HN) 3.108 1.208 1.208 weight 1.000 ! spec=15Nnoesy, no=893, id=3167, vol=1.249000e+04
assign (segid "   B" and resid   32 and name   HA) (segid "   B" and resid   33 and name   HN) 3.108 1.208 1.208 weight 1.000 ! spec=15Nnoesy, no=893, id=3167, vol=1.249000e+04
assign (segid "   A" and resid   31 and name HG22) (segid "   A" and resid   33 and name   HN) 4.580 2.622 2.622 weight 1.000 ! spec=15Nnoesy, no=896, id=3169, vol=3.343000e+03
    or (segid "   A" and resid   31 and name HG21) (segid "   A" and resid   33 and name   HN)
    or (segid "   A" and resid   31 and name HG23) (segid "   A" and resid   33 and name   HN)
assign (segid "   B" and resid   31 and name HG22) (segid "   B" and resid   33 and name   HN) 4.580 2.622 2.622 weight 1.000 ! spec=15Nnoesy, no=896, id=3169, vol=3.343000e+03
    or (segid "   B" and resid   31 and name HG21) (segid "   B" and resid   33 and name   HN)
    or (segid "   B" and resid   31 and name HG23) (segid "   B" and resid   33 and name   HN)
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   76 and name   HN) 5.058 3.198 3.198 weight 1.000 ! spec=15Nnoesy, no=900, id=3171, vol=3.926000e+03
assign (segid "   B" and resid   73 and name  HB2) (segid "   B" and resid   76 and name   HN) 5.058 3.198 3.198 weight 1.000 ! spec=15Nnoesy, no=900, id=3171, vol=3.926000e+03
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   76 and name   HN) 4.450 2.476 2.476 weight 1.000 ! spec=15Nnoesy, no=901, id=3172, vol=6.219000e+03
assign (segid "   B" and resid   74 and name  HB1) (segid "   B" and resid   76 and name   HN) 4.450 2.476 2.476 weight 1.000 ! spec=15Nnoesy, no=901, id=3172, vol=6.219000e+03
assign (segid "   A" and resid   75 and name  HB2) (segid "   A" and resid   76 and name   HN) 4.259 2.268 2.268 weight 1.000 ! spec=15Nnoesy, no=903, id=3174, vol=7.397000e+03
assign (segid "   B" and resid   75 and name  HB2) (segid "   B" and resid   76 and name   HN) 4.259 2.268 2.268 weight 1.000 ! spec=15Nnoesy, no=903, id=3174, vol=7.397000e+03
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   76 and name   HN) 4.194 2.199 2.199 weight 1.000 ! spec=15Nnoesy, no=905, id=3176, vol=3.319000e+03
assign (segid "   B" and resid   74 and name   HA) (segid "   B" and resid   76 and name   HN) 4.194 2.199 2.199 weight 1.000 ! spec=15Nnoesy, no=905, id=3176, vol=3.319000e+03
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   73 and name   HA) 3.295 1.357 1.357 weight 1.000 ! spec=15Nnoesy, no=910, id=3180, vol=7.352000e+03
assign (segid "   B" and resid   76 and name   HN) (segid "   B" and resid   73 and name   HA) 3.295 1.357 1.357 weight 1.000 ! spec=15Nnoesy, no=910, id=3180, vol=7.352000e+03
assign (segid "   A" and resid   71 and name HG22) (segid "   A" and resid   76 and name   HN) 4.047 2.047 2.047 weight 1.000 ! spec=15Nnoesy, no=911, id=3181, vol=3.875000e+03
    or (segid "   A" and resid   71 and name HG21) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   71 and name HG23) (segid "   A" and resid   76 and name   HN)
assign (segid "   B" and resid   71 and name HG22) (segid "   B" and resid   76 and name   HN) 4.047 2.047 2.047 weight 1.000 ! spec=15Nnoesy, no=911, id=3181, vol=3.875000e+03
    or (segid "   B" and resid   71 and name HG21) (segid "   B" and resid   76 and name   HN)
    or (segid "   B" and resid   71 and name HG23) (segid "   B" and resid   76 and name   HN)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name   HA) 2.603 0.847 0.847 weight 1.000 ! spec=15Nnoesy, no=915, id=3184, vol=1.527000e+04
assign (segid "   B" and resid   82 and name   HN) (segid "   B" and resid   81 and name   HA) 2.603 0.847 0.847 weight 1.000 ! spec=15Nnoesy, no=915, id=3184, vol=1.527000e+04
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name   HN) 3.057 1.169 1.169 weight 1.000 ! spec=15Nnoesy, no=917, id=3185, vol=7.215000e+03
assign (segid "   B" and resid   82 and name   HA) (segid "   B" and resid   82 and name   HN) 3.057 1.169 1.169 weight 1.000 ! spec=15Nnoesy, no=917, id=3185, vol=7.215000e+03
assign (segid "   A" and resid   81 and name   HB) (segid "   A" and resid   82 and name   HN) 4.112 2.114 2.114 weight 1.000 ! spec=15Nnoesy, no=919, id=3187, vol=5.424000e+03
assign (segid "   B" and resid   81 and name   HB) (segid "   B" and resid   82 and name   HN) 4.112 2.114 2.114 weight 1.000 ! spec=15Nnoesy, no=919, id=3187, vol=5.424000e+03
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name HG21) 2.971 1.103 1.103 weight 1.000 ! spec=15Nnoesy, no=921, id=3189, vol=1.125000e+04
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name HG22)
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name HG23)
assign (segid "   B" and resid   82 and name   HN) (segid "   B" and resid   81 and name HG21) 2.971 1.103 1.103 weight 1.000 ! spec=15Nnoesy, no=921, id=3189, vol=1.125000e+04
    or (segid "   B" and resid   82 and name   HN) (segid "   B" and resid   81 and name HG22)
    or (segid "   B" and resid   82 and name   HN) (segid "   B" and resid   81 and name HG23)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   83 and name   HN) 4.365 2.381 2.381 weight 1.000 ! spec=15Nnoesy, no=922, id=3190, vol=4.102000e+03
assign (segid "   B" and resid   82 and name   HN) (segid "   B" and resid   83 and name   HN) 4.365 2.381 2.381 weight 1.000 ! spec=15Nnoesy, no=922, id=3190, vol=4.102000e+03
assign (segid "   A" and resid   82 and name HG21) (segid "   A" and resid   82 and name   HN) 2.894 1.047 1.047 weight 1.000 ! spec=15Nnoesy, no=924, id=3191, vol=1.218000e+04
    or (segid "   A" and resid   82 and name HG22) (segid "   A" and resid   82 and name   HN)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid   82 and name   HN)
assign (segid "   B" and resid   82 and name HG21) (segid "   B" and resid   82 and name   HN) 2.894 1.047 1.047 weight 1.000 ! spec=15Nnoesy, no=924, id=3191, vol=1.218000e+04
    or (segid "   B" and resid   82 and name HG22) (segid "   B" and resid   82 and name   HN)
    or (segid "   B" and resid   82 and name HG23) (segid "   B" and resid   82 and name   HN)
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name   HN) 4.335 2.349 2.349 weight 1.000 ! spec=15Nnoesy, no=925, id=3192, vol=4.324000e+03
assign (segid "   B" and resid   49 and name  HB1) (segid "   B" and resid   49 and name   HN) 4.335 2.349 2.349 weight 1.000 ! spec=15Nnoesy, no=925, id=3192, vol=4.324000e+03
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   49 and name   HN) 2.936 1.077 1.077 weight 1.000 ! spec=15Nnoesy, no=926, id=3193, vol=1.091000e+04
assign (segid "   B" and resid   49 and name   HA) (segid "   B" and resid   49 and name   HN) 2.936 1.077 1.077 weight 1.000 ! spec=15Nnoesy, no=926, id=3193, vol=1.091000e+04
assign (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   49 and name   HN) 3.027 1.146 1.146 weight 1.000 ! spec=15Nnoesy, no=927, id=3194, vol=6.814000e+03
assign (segid "   B" and resid   49 and name  HB2) (segid "   B" and resid   49 and name   HN) 3.027 1.146 1.146 weight 1.000 ! spec=15Nnoesy, no=927, id=3194, vol=6.814000e+03
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   50 and name   HN) 4.209 2.215 2.215 weight 1.000 ! spec=15Nnoesy, no=928, id=3195, vol=3.750000e+03
assign (segid "   B" and resid   49 and name   HN) (segid "   B" and resid   50 and name   HN) 4.209 2.215 2.215 weight 1.000 ! spec=15Nnoesy, no=928, id=3195, vol=3.750000e+03
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name HD21) 2.577 0.830 0.830 weight 1.000 ! spec=15Nnoesy, no=934, id=3199, vol=1.094000e+04
assign (segid "   B" and resid   77 and name  HB2) (segid "   B" and resid   77 and name HD21) 2.577 0.830 0.830 weight 1.000 ! spec=15Nnoesy, no=934, id=3199, vol=1.094000e+04
assign (segid "   A" and resid  109 and name HG12) (segid "   A" and resid   83 and name   HN) 2.996 1.122 1.122 weight 1.000 ! spec=15Nnoesy, no=937, id=3202, vol=1.019000e+04
    or (segid "   A" and resid  109 and name HG11) (segid "   A" and resid   83 and name   HN)
    or (segid "   A" and resid  109 and name HG13) (segid "   A" and resid   83 and name   HN)
assign (segid "   B" and resid  109 and name HG12) (segid "   B" and resid   83 and name   HN) 2.996 1.122 1.122 weight 1.000 ! spec=15Nnoesy, no=937, id=3202, vol=1.019000e+04
    or (segid "   B" and resid  109 and name HG11) (segid "   B" and resid   83 and name   HN)
    or (segid "   B" and resid  109 and name HG13) (segid "   B" and resid   83 and name   HN)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   83 and name   HN) 3.630 1.647 1.647 weight 1.000 ! spec=15Nnoesy, no=939, id=3204, vol=5.536000e+03
assign (segid "   B" and resid   82 and name   HB) (segid "   B" and resid   83 and name   HN) 3.630 1.647 1.647 weight 1.000 ! spec=15Nnoesy, no=939, id=3204, vol=5.536000e+03
assign (segid "   A" and resid   83 and name   HB) (segid "   A" and resid   83 and name   HN) 2.717 0.923 0.923 weight 1.000 ! spec=15Nnoesy, no=941, id=3206, vol=1.220000e+04
assign (segid "   B" and resid   83 and name   HB) (segid "   B" and resid   83 and name   HN) 2.717 0.923 0.923 weight 1.000 ! spec=15Nnoesy, no=941, id=3206, vol=1.220000e+04
assign (segid "   A" and resid  108 and name   HA) (segid "   A" and resid   83 and name   HN) 3.859 1.861 1.861 weight 1.000 ! spec=15Nnoesy, no=944, id=3207, vol=5.030000e+03
assign (segid "   B" and resid  108 and name   HA) (segid "   B" and resid   83 and name   HN) 3.859 1.861 1.861 weight 1.000 ! spec=15Nnoesy, no=944, id=3207, vol=5.030000e+03
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   76 and name  HD1) 3.234 1.308 1.308 weight 1.000 ! spec=15Nnoesy, no=946, id=3208, vol=6.773000e+03
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   76 and name  HD1) 3.234 1.308 1.308 weight 1.000 ! spec=15Nnoesy, no=946, id=3208, vol=6.773000e+03
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   76 and name  HH2) 3.915 1.916 1.916 weight 1.000 ! spec=15Nnoesy, no=947, id=3209, vol=1.920000e+04
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   76 and name  HH2) 3.915 1.916 1.916 weight 1.000 ! spec=15Nnoesy, no=947, id=3209, vol=1.920000e+04
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   76 and name  HB2) 3.916 1.917 1.917 weight 1.000 ! spec=15Nnoesy, no=948, id=3210, vol=1.265000e+04
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   76 and name  HB2) 3.916 1.917 1.917 weight 1.000 ! spec=15Nnoesy, no=948, id=3210, vol=1.265000e+04
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   76 and name  HZ2) 2.896 1.049 1.049 weight 1.000 ! spec=15Nnoesy, no=949, id=3211, vol=1.827000e+04
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   76 and name  HZ2) 2.896 1.049 1.049 weight 1.000 ! spec=15Nnoesy, no=949, id=3211, vol=1.827000e+04
assign (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   76 and name  HE1) 3.158 1.246 1.246 weight 1.000 ! spec=15Nnoesy, no=950, id=3212, vol=5.954000e+03
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   76 and name  HE1)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   76 and name  HE1)
assign (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   76 and name  HE1) 3.158 1.246 1.246 weight 1.000 ! spec=15Nnoesy, no=950, id=3212, vol=5.954000e+03
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   76 and name  HE1)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   76 and name  HE1)
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   76 and name  HB1) 4.064 2.065 2.065 weight 1.000 ! spec=15Nnoesy, no=952, id=3213, vol=9.113000e+03
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   76 and name  HB1) 4.064 2.065 2.065 weight 1.000 ! spec=15Nnoesy, no=952, id=3213, vol=9.113000e+03
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid  112 and name HD22) 4.082 2.082 2.082 weight 1.000 ! spec=15Nnoesy, no=954, id=3214, vol=3.670000e+03
    or (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid  112 and name HD21)
    or (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid  112 and name HD23)
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid  112 and name HD22) 4.082 2.082 2.082 weight 1.000 ! spec=15Nnoesy, no=954, id=3214, vol=3.670000e+03
    or (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid  112 and name HD21)
    or (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid  112 and name HD23)
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   71 and name HG22) 4.326 2.339 2.339 weight 1.000 ! spec=15Nnoesy, no=955, id=3215, vol=4.250000e+03
    or (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   71 and name HG21)
    or (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   71 and name HG23)
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   71 and name HG22) 4.326 2.339 2.339 weight 1.000 ! spec=15Nnoesy, no=955, id=3215, vol=4.250000e+03
    or (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   71 and name HG21)
    or (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   71 and name HG23)
assign (segid "   A" and resid   76 and name  HE1) (segid "   A" and resid   76 and name   HN) 4.909 3.013 3.013 weight 1.000 ! spec=15Nnoesy, no=956, id=3216, vol=3.202000e+03
assign (segid "   B" and resid   76 and name  HE1) (segid "   B" and resid   76 and name   HN) 4.909 3.013 3.013 weight 1.000 ! spec=15Nnoesy, no=956, id=3216, vol=3.202000e+03
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   39 and name   HN) 3.532 1.559 1.559 weight 1.000 ! spec=15Nnoesy, no=959, id=3219, vol=3.864000e+03
assign (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   39 and name   HN) 3.532 1.559 1.559 weight 1.000 ! spec=15Nnoesy, no=959, id=3219, vol=3.864000e+03
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   91 and name HG21) 3.473 1.507 1.507 weight 1.000 ! spec=15Nnoesy, no=966, id=3223, vol=7.011000e+03
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   91 and name HG22)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   91 and name HG23)
assign (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   91 and name HG21) 3.473 1.507 1.507 weight 1.000 ! spec=15Nnoesy, no=966, id=3223, vol=7.011000e+03
    or (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   91 and name HG22)
    or (segid "   B" and resid   39 and name   HN) (segid "   B" and resid   91 and name HG23)
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name   HA) 3.161 1.249 1.249 weight 1.000 ! spec=15Nnoesy, no=972, id=3226, vol=8.454000e+03
assign (segid "   B" and resid    3 and name   HN) (segid "   B" and resid    3 and name   HA) 3.161 1.249 1.249 weight 1.000 ! spec=15Nnoesy, no=972, id=3226, vol=8.454000e+03
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   67 and name   HN) 3.435 1.474 1.474 weight 1.000 ! spec=15Nnoesy, no=976, id=3228, vol=8.965000e+03
assign (segid "   B" and resid   66 and name   HA) (segid "   B" and resid   67 and name   HN) 3.435 1.474 1.474 weight 1.000 ! spec=15Nnoesy, no=976, id=3228, vol=8.965000e+03
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   67 and name   HN) 3.339 1.393 1.393 weight 1.000 ! spec=15Nnoesy, no=977, id=3229, vol=5.391000e+03
assign (segid "   B" and resid   68 and name   HN) (segid "   B" and resid   67 and name   HN) 3.339 1.393 1.393 weight 1.000 ! spec=15Nnoesy, no=977, id=3229, vol=5.391000e+03
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   67 and name   HN) 4.234 2.241 2.241 weight 1.000 ! spec=15Nnoesy, no=978, id=3230, vol=5.761000e+03
assign (segid "   B" and resid   66 and name  HB2) (segid "   B" and resid   67 and name   HN) 4.234 2.241 2.241 weight 1.000 ! spec=15Nnoesy, no=978, id=3230, vol=5.761000e+03
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   67 and name   HN) 2.719 0.924 0.924 weight 1.000 ! spec=15Nnoesy, no=980, id=3231, vol=1.094000e+04
assign (segid "   B" and resid   66 and name   HN) (segid "   B" and resid   67 and name   HN) 2.719 0.924 0.924 weight 1.000 ! spec=15Nnoesy, no=980, id=3231, vol=1.094000e+04
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid  113 and name   HN) 2.881 1.038 1.038 weight 1.000 ! spec=15Nnoesy, no=985, id=3236, vol=5.006000e+03
assign (segid "   B" and resid   77 and name   HN) (segid "   B" and resid  113 and name   HN) 2.881 1.038 1.038 weight 1.000 ! spec=15Nnoesy, no=985, id=3236, vol=5.006000e+03
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   32 and name  HG2) 5.057 3.197 3.197 weight 1.000 ! spec=15Nnoesy, no=993, id=3242, vol=3.194000e+03
assign (segid "   B" and resid   31 and name   HN) (segid "   B" and resid   32 and name  HG2) 5.057 3.197 3.197 weight 1.000 ! spec=15Nnoesy, no=993, id=3242, vol=3.194000e+03
assign (segid "   A" and resid  102 and name HG22) (segid "   A" and resid   31 and name   HN) 3.794 1.800 1.800 weight 1.000 ! spec=15Nnoesy, no=994, id=3243, vol=5.174000e+03
    or (segid "   A" and resid  102 and name HG21) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid  102 and name HG23) (segid "   A" and resid   31 and name   HN)
assign (segid "   B" and resid  102 and name HG22) (segid "   B" and resid   31 and name   HN) 3.794 1.800 1.800 weight 1.000 ! spec=15Nnoesy, no=994, id=3243, vol=5.174000e+03
    or (segid "   B" and resid  102 and name HG21) (segid "   B" and resid   31 and name   HN)
    or (segid "   B" and resid  102 and name HG23) (segid "   B" and resid   31 and name   HN)
assign (segid "   A" and resid   31 and name HG11) (segid "   A" and resid   31 and name   HN) 3.956 1.956 1.956 weight 1.000 ! spec=15Nnoesy, no=998, id=3245, vol=7.988000e+03
assign (segid "   B" and resid   31 and name HG11) (segid "   B" and resid   31 and name   HN) 3.956 1.956 1.956 weight 1.000 ! spec=15Nnoesy, no=998, id=3245, vol=7.988000e+03
assign (segid "   A" and resid   31 and name HG12) (segid "   A" and resid   31 and name   HN) 3.822 1.826 1.826 weight 1.000 ! spec=15Nnoesy, no=999, id=3246, vol=7.988000e+03
assign (segid "   B" and resid   31 and name HG12) (segid "   B" and resid   31 and name   HN) 3.822 1.826 1.826 weight 1.000 ! spec=15Nnoesy, no=999, id=3246, vol=7.988000e+03
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid   83 and name   HA) 3.479 1.513 1.513 weight 1.000 ! spec=15Nnoesy, no=1004, id=3248, vol=7.306000e+03
assign (segid "   B" and resid  107 and name   HN) (segid "   B" and resid   83 and name   HA) 3.479 1.513 1.513 weight 1.000 ! spec=15Nnoesy, no=1004, id=3248, vol=7.306000e+03
assign (segid "   A" and resid   82 and name HG21) (segid "   A" and resid  107 and name   HN) 3.138 1.231 1.231 weight 1.000 ! spec=15Nnoesy, no=1010, id=3254, vol=9.522000e+03
    or (segid "   A" and resid   82 and name HG22) (segid "   A" and resid  107 and name   HN)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid  107 and name   HN)
assign (segid "   B" and resid   82 and name HG21) (segid "   B" and resid  107 and name   HN) 3.138 1.231 1.231 weight 1.000 ! spec=15Nnoesy, no=1010, id=3254, vol=9.522000e+03
    or (segid "   B" and resid   82 and name HG22) (segid "   B" and resid  107 and name   HN)
    or (segid "   B" and resid   82 and name HG23) (segid "   B" and resid  107 and name   HN)
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name   HA) 3.421 1.463 1.463 weight 1.000 ! spec=15Nnoesy, no=1011, id=3255, vol=3.704000e+03
assign (segid "   B" and resid  101 and name   HN) (segid "   B" and resid  101 and name   HA) 3.421 1.463 1.463 weight 1.000 ! spec=15Nnoesy, no=1011, id=3255, vol=3.704000e+03
assign (segid "   A" and resid   31 and name HG22) (segid "   A" and resid  101 and name   HN) 3.373 1.422 1.422 weight 1.000 ! spec=15Nnoesy, no=1012, id=3256, vol=4.091000e+03
    or (segid "   A" and resid   31 and name HG21) (segid "   A" and resid  101 and name   HN)
    or (segid "   A" and resid   31 and name HG23) (segid "   A" and resid  101 and name   HN)
assign (segid "   B" and resid   31 and name HG22) (segid "   B" and resid  101 and name   HN) 3.373 1.422 1.422 weight 1.000 ! spec=15Nnoesy, no=1012, id=3256, vol=4.091000e+03
    or (segid "   B" and resid   31 and name HG21) (segid "   B" and resid  101 and name   HN)
    or (segid "   B" and resid   31 and name HG23) (segid "   B" and resid  101 and name   HN)
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  101 and name   HN) 3.031 1.148 1.148 weight 1.000 ! spec=15Nnoesy, no=1013, id=3257, vol=5.825000e+03
assign (segid "   B" and resid  101 and name  HB2) (segid "   B" and resid  101 and name   HN) 3.031 1.148 1.148 weight 1.000 ! spec=15Nnoesy, no=1013, id=3257, vol=5.825000e+03
assign (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  101 and name   HN) 4.301 2.312 2.312 weight 1.000 ! spec=15Nnoesy, no=1014, id=3258, vol=4.739000e+03
assign (segid "   B" and resid  101 and name  HB1) (segid "   B" and resid  101 and name   HN) 4.301 2.312 2.312 weight 1.000 ! spec=15Nnoesy, no=1014, id=3258, vol=4.739000e+03
assign (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   46 and name HD22) 1.755 0.385 0.385 weight 1.000 ! spec=15Nnoesy, no=1015, id=3259, vol=8.407000e+04
assign (segid "   B" and resid   46 and name HD21) (segid "   B" and resid   46 and name HD22) 1.755 0.385 0.385 weight 1.000 ! spec=15Nnoesy, no=1015, id=3259, vol=8.407000e+04
assign (segid "   A" and resid  117 and name   HA) (segid "   A" and resid  117 and name   HN) 3.131 1.225 1.225 weight 1.000 ! spec=15Nnoesy, no=1016, id=3260, vol=7.204000e+03
assign (segid "   B" and resid  117 and name   HA) (segid "   B" and resid  117 and name   HN) 3.131 1.225 1.225 weight 1.000 ! spec=15Nnoesy, no=1016, id=3260, vol=7.204000e+03
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   56 and name   HN) 4.486 2.515 2.515 weight 1.000 ! spec=15Nnoesy, no=1019, id=3262, vol=3.824000e+03
assign (segid "   B" and resid   55 and name   HN) (segid "   B" and resid   56 and name   HN) 4.486 2.515 2.515 weight 1.000 ! spec=15Nnoesy, no=1019, id=3262, vol=3.824000e+03
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name   HN) 3.006 1.129 1.129 weight 1.000 ! spec=15Nnoesy, no=1021, id=3264, vol=7.124000e+03
assign (segid "   B" and resid   55 and name  HB1) (segid "   B" and resid   55 and name   HN) 3.006 1.129 1.129 weight 1.000 ! spec=15Nnoesy, no=1021, id=3264, vol=7.124000e+03
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   55 and name   HN) 3.387 1.434 1.434 weight 1.000 ! spec=15Nnoesy, no=1024, id=3267, vol=1.432000e+04
assign (segid "   B" and resid   20 and name   HA) (segid "   B" and resid   55 and name   HN) 3.387 1.434 1.434 weight 1.000 ! spec=15Nnoesy, no=1024, id=3267, vol=1.432000e+04
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   55 and name   HN) 4.357 2.373 2.373 weight 1.000 ! spec=15Nnoesy, no=1026, id=3269, vol=3.886000e+03
assign (segid "   B" and resid   55 and name  HG2) (segid "   B" and resid   55 and name   HN) 4.357 2.373 2.373 weight 1.000 ! spec=15Nnoesy, no=1026, id=3269, vol=3.886000e+03
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name HD22) 3.811 1.815 1.815 weight 1.000 ! spec=15Nnoesy, no=1029, id=3272, vol=5.407000e+03
assign (segid "   B" and resid   45 and name  HB1) (segid "   B" and resid   45 and name HD22) 3.811 1.815 1.815 weight 1.000 ! spec=15Nnoesy, no=1029, id=3272, vol=5.407000e+03
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   45 and name HD22) 3.260 1.328 1.328 weight 1.000 ! spec=15Nnoesy, no=1030, id=3273, vol=6.444000e+03
assign (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   45 and name HD22) 3.260 1.328 1.328 weight 1.000 ! spec=15Nnoesy, no=1030, id=3273, vol=6.444000e+03
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid  104 and name   HN) 2.941 1.081 1.081 weight 1.000 ! spec=15Nnoesy, no=1045, id=3284, vol=1.019000e+04
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid  104 and name   HN)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid  104 and name   HN) 2.941 1.081 1.081 weight 1.000 ! spec=15Nnoesy, no=1045, id=3284, vol=1.019000e+04
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid  104 and name   HN)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid  104 and name   HN)
assign (segid "   A" and resid  104 and name   HB) (segid "   A" and resid  104 and name   HN) 3.315 1.373 1.373 weight 1.000 ! spec=15Nnoesy, no=1046, id=3285, vol=1.009000e+04
assign (segid "   B" and resid  104 and name   HB) (segid "   B" and resid  104 and name   HN) 3.315 1.373 1.373 weight 1.000 ! spec=15Nnoesy, no=1046, id=3285, vol=1.009000e+04
assign (segid "   A" and resid  103 and name  HG2) (segid "   A" and resid  104 and name   HN) 3.959 1.959 1.959 weight 1.000 ! spec=15Nnoesy, no=1049, id=3288, vol=6.235000e+03
assign (segid "   B" and resid  103 and name  HG2) (segid "   B" and resid  104 and name   HN) 3.959 1.959 1.959 weight 1.000 ! spec=15Nnoesy, no=1049, id=3288, vol=6.235000e+03
assign (segid "   A" and resid   87 and name HG22) (segid "   A" and resid  104 and name   HN) 3.113 1.211 1.211 weight 1.000 ! spec=15Nnoesy, no=1050, id=3289, vol=1.019000e+04
    or (segid "   A" and resid   87 and name HG21) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid   87 and name HG23) (segid "   A" and resid  104 and name   HN)
assign (segid "   B" and resid   87 and name HG22) (segid "   B" and resid  104 and name   HN) 3.113 1.211 1.211 weight 1.000 ! spec=15Nnoesy, no=1050, id=3289, vol=1.019000e+04
    or (segid "   B" and resid   87 and name HG21) (segid "   B" and resid  104 and name   HN)
    or (segid "   B" and resid   87 and name HG23) (segid "   B" and resid  104 and name   HN)
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  104 and name   HA) 2.586 0.836 0.836 weight 1.000 ! spec=15Nnoesy, no=1052, id=3291, vol=1.798000e+04
assign (segid "   B" and resid  104 and name   HN) (segid "   B" and resid  104 and name   HA) 2.586 0.836 0.836 weight 1.000 ! spec=15Nnoesy, no=1052, id=3291, vol=1.798000e+04
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   40 and name   HN) 3.555 1.580 1.580 weight 1.000 ! spec=15Nnoesy, no=1054, id=3293, vol=3.739000e+03
assign (segid "   B" and resid   39 and name  HB1) (segid "   B" and resid   40 and name   HN) 3.555 1.580 1.580 weight 1.000 ! spec=15Nnoesy, no=1054, id=3293, vol=3.739000e+03
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name   HN) 2.241 0.628 0.628 weight 1.000 ! spec=15Nnoesy, no=1057, id=3296, vol=1.996000e+04
    or (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   40 and name   HN)
    or (segid "   A" and resid   40 and name  HB3) (segid "   A" and resid   40 and name   HN)
assign (segid "   B" and resid   40 and name  HB2) (segid "   B" and resid   40 and name   HN) 2.241 0.628 0.628 weight 1.000 ! spec=15Nnoesy, no=1057, id=3296, vol=1.996000e+04
    or (segid "   B" and resid   40 and name  HB1) (segid "   B" and resid   40 and name   HN)
    or (segid "   B" and resid   40 and name  HB3) (segid "   B" and resid   40 and name   HN)
assign (segid "   A" and resid  110 and name   HN) (segid "   A" and resid  110 and name  HB2) 3.740 1.748 1.748 weight 1.000 ! spec=15Nnoesy, no=1066, id=3303, vol=5.793000e+03
assign (segid "   B" and resid  110 and name   HN) (segid "   B" and resid  110 and name  HB2) 3.740 1.748 1.748 weight 1.000 ! spec=15Nnoesy, no=1066, id=3303, vol=5.793000e+03
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid  106 and name   HN) 3.390 1.436 1.436 weight 1.000 ! spec=15Nnoesy, no=1067, id=3304, vol=5.640000e+03
assign (segid "   B" and resid   84 and name   HA) (segid "   B" and resid  106 and name   HN) 3.390 1.436 1.436 weight 1.000 ! spec=15Nnoesy, no=1067, id=3304, vol=5.640000e+03
assign (segid "   A" and resid  106 and name   HN) (segid "   A" and resid   84 and name   HN) 4.219 2.225 2.225 weight 1.000 ! spec=15Nnoesy, no=1068, id=3305, vol=3.431000e+03
assign (segid "   B" and resid  106 and name   HN) (segid "   B" and resid   84 and name   HN) 4.219 2.225 2.225 weight 1.000 ! spec=15Nnoesy, no=1068, id=3305, vol=3.431000e+03
assign (segid "   A" and resid   84 and name  HB1) (segid "   A" and resid  106 and name   HN) 5.128 3.287 3.287 weight 1.000 ! spec=15Nnoesy, no=1069, id=3306, vol=3.335000e+03
assign (segid "   B" and resid   84 and name  HB1) (segid "   B" and resid  106 and name   HN) 5.128 3.287 3.287 weight 1.000 ! spec=15Nnoesy, no=1069, id=3306, vol=3.335000e+03
assign (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name   HN) 3.491 1.523 1.523 weight 1.000 ! spec=15Nnoesy, no=1070, id=3307, vol=3.363000e+03
assign (segid "   B" and resid  106 and name   HA) (segid "   B" and resid  106 and name   HN) 3.491 1.523 1.523 weight 1.000 ! spec=15Nnoesy, no=1070, id=3307, vol=3.363000e+03
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   30 and name   HN) 2.913 1.061 1.061 weight 1.000 ! spec=15Nnoesy, no=1074, id=3311, vol=8.988000e+03
assign (segid "   B" and resid   30 and name  HB1) (segid "   B" and resid   30 and name   HN) 2.913 1.061 1.061 weight 1.000 ! spec=15Nnoesy, no=1074, id=3311, vol=8.988000e+03
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   30 and name   HN) 3.054 1.166 1.166 weight 1.000 ! spec=15Nnoesy, no=1075, id=3312, vol=7.454000e+03
assign (segid "   B" and resid   30 and name   HA) (segid "   B" and resid   30 and name   HN) 3.054 1.166 1.166 weight 1.000 ! spec=15Nnoesy, no=1075, id=3312, vol=7.454000e+03
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name   HA) 2.189 0.599 0.599 weight 1.000 ! spec=15Nnoesy, no=1081, id=3317, vol=3.050000e+04
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   29 and name   HA) 2.189 0.599 0.599 weight 1.000 ! spec=15Nnoesy, no=1081, id=3317, vol=3.050000e+04
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   30 and name   HN) 3.935 1.936 1.936 weight 1.000 ! spec=15Nnoesy, no=1082, id=3318, vol=5.689000e+03
assign (segid "   B" and resid   29 and name   HB) (segid "   B" and resid   30 and name   HN) 3.935 1.936 1.936 weight 1.000 ! spec=15Nnoesy, no=1082, id=3318, vol=5.689000e+03
assign (segid "   A" and resid   36 and name HG22) (segid "   A" and resid   30 and name   HN) 2.674 0.894 0.894 weight 1.000 ! spec=15Nnoesy, no=1084, id=3320, vol=1.041000e+04
    or (segid "   A" and resid   36 and name HG21) (segid "   A" and resid   30 and name   HN)
    or (segid "   A" and resid   36 and name HG23) (segid "   A" and resid   30 and name   HN)
assign (segid "   B" and resid   36 and name HG22) (segid "   B" and resid   30 and name   HN) 2.674 0.894 0.894 weight 1.000 ! spec=15Nnoesy, no=1084, id=3320, vol=1.041000e+04
    or (segid "   B" and resid   36 and name HG21) (segid "   B" and resid   30 and name   HN)
    or (segid "   B" and resid   36 and name HG23) (segid "   B" and resid   30 and name   HN)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   31 and name   HN) 4.676 2.733 2.733 weight 1.000 ! spec=15Nnoesy, no=1085, id=3321, vol=3.597000e+03
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   31 and name   HN) 4.676 2.733 2.733 weight 1.000 ! spec=15Nnoesy, no=1085, id=3321, vol=3.597000e+03
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   30 and name   HN) 2.425 0.735 0.735 weight 1.000 ! spec=15Nnoesy, no=1086, id=3322, vol=2.288000e+04
assign (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   30 and name   HN) 2.425 0.735 0.735 weight 1.000 ! spec=15Nnoesy, no=1086, id=3322, vol=2.288000e+04
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   34 and name   HN) 2.941 1.082 1.082 weight 1.000 ! spec=15Nnoesy, no=1087, id=3323, vol=1.098000e+04
assign (segid "   B" and resid   30 and name   HN) (segid "   B" and resid   34 and name   HN) 2.941 1.082 1.082 weight 1.000 ! spec=15Nnoesy, no=1087, id=3323, vol=1.098000e+04
assign (segid "   A" and resid   51 and name HE21) (segid "   A" and resid   51 and name  HG2) 3.557 1.581 1.581 weight 1.000 ! spec=15Nnoesy, no=1088, id=3324, vol=4.733000e+03
assign (segid "   B" and resid   51 and name HE21) (segid "   B" and resid   51 and name  HG2) 3.557 1.581 1.581 weight 1.000 ! spec=15Nnoesy, no=1088, id=3324, vol=4.733000e+03
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name HD21) 4.368 2.385 2.385 weight 1.000 ! spec=15Nnoesy, no=1090, id=3326, vol=6.974000e+03
assign (segid "   B" and resid   45 and name  HB1) (segid "   B" and resid   45 and name HD21) 4.368 2.385 2.385 weight 1.000 ! spec=15Nnoesy, no=1090, id=3326, vol=6.974000e+03
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   45 and name HD21) 3.890 1.891 1.891 weight 1.000 ! spec=15Nnoesy, no=1091, id=3327, vol=1.051000e+04
assign (segid "   B" and resid   45 and name  HB2) (segid "   B" and resid   45 and name HD21) 3.890 1.891 1.891 weight 1.000 ! spec=15Nnoesy, no=1091, id=3327, vol=1.051000e+04
assign (segid "   A" and resid   45 and name HD21) (segid "   A" and resid   44 and name HG22) 3.862 1.864 1.864 weight 1.000 ! spec=15Nnoesy, no=1092, id=3328, vol=6.356000e+03
    or (segid "   A" and resid   45 and name HD21) (segid "   A" and resid   44 and name HG21)
    or (segid "   A" and resid   45 and name HD21) (segid "   A" and resid   44 and name HG23)
assign (segid "   B" and resid   45 and name HD21) (segid "   B" and resid   44 and name HG22) 3.862 1.864 1.864 weight 1.000 ! spec=15Nnoesy, no=1092, id=3328, vol=6.356000e+03
    or (segid "   B" and resid   45 and name HD21) (segid "   B" and resid   44 and name HG21)
    or (segid "   B" and resid   45 and name HD21) (segid "   B" and resid   44 and name HG23)
assign (segid "   A" and resid   45 and name HD21) (segid "   A" and resid   45 and name   HA) 4.668 2.723 2.723 weight 1.000 ! spec=15Nnoesy, no=1093, id=3329, vol=6.428000e+03
assign (segid "   B" and resid   45 and name HD21) (segid "   B" and resid   45 and name   HA) 4.668 2.723 2.723 weight 1.000 ! spec=15Nnoesy, no=1093, id=3329, vol=6.428000e+03
assign (segid "   A" and resid   45 and name HD22) (segid "   A" and resid   45 and name HD21) 1.726 0.372 0.372 weight 1.000 ! spec=15Nnoesy, no=1094, id=3330, vol=6.072000e+04
assign (segid "   B" and resid   45 and name HD22) (segid "   B" and resid   45 and name HD21) 1.726 0.372 0.372 weight 1.000 ! spec=15Nnoesy, no=1094, id=3330, vol=6.072000e+04
assign (segid "   A" and resid   43 and name   HA) (segid "   A" and resid   43 and name HD21) 4.491 2.521 2.521 weight 1.000 ! spec=15Nnoesy, no=1095, id=3331, vol=3.146000e+03
assign (segid "   B" and resid   43 and name   HA) (segid "   B" and resid   43 and name HD21) 4.491 2.521 2.521 weight 1.000 ! spec=15Nnoesy, no=1095, id=3331, vol=3.146000e+03
assign (segid "   A" and resid   43 and name HD21) (segid "   A" and resid   39 and name HD12) 2.725 0.928 0.928 weight 1.000 ! spec=15Nnoesy, no=1096, id=3332, vol=7.443000e+03
    or (segid "   A" and resid   43 and name HD21) (segid "   A" and resid   39 and name HD11)
    or (segid "   A" and resid   43 and name HD21) (segid "   A" and resid   39 and name HD13)
assign (segid "   B" and resid   43 and name HD21) (segid "   B" and resid   39 and name HD12) 2.725 0.928 0.928 weight 1.000 ! spec=15Nnoesy, no=1096, id=3332, vol=7.443000e+03
    or (segid "   B" and resid   43 and name HD21) (segid "   B" and resid   39 and name HD11)
    or (segid "   B" and resid   43 and name HD21) (segid "   B" and resid   39 and name HD13)
assign (segid "   A" and resid   43 and name  HB1) (segid "   A" and resid   43 and name HD21) 3.600 1.620 1.620 weight 1.000 ! spec=15Nnoesy, no=1098, id=3334, vol=8.761000e+03
assign (segid "   B" and resid   43 and name  HB1) (segid "   B" and resid   43 and name HD21) 3.600 1.620 1.620 weight 1.000 ! spec=15Nnoesy, no=1098, id=3334, vol=8.761000e+03
assign (segid "   A" and resid   43 and name  HB2) (segid "   A" and resid   43 and name HD21) 2.670 0.891 0.891 weight 1.000 ! spec=15Nnoesy, no=1099, id=3335, vol=9.979000e+03
assign (segid "   B" and resid   43 and name  HB2) (segid "   B" and resid   43 and name HD21) 2.670 0.891 0.891 weight 1.000 ! spec=15Nnoesy, no=1099, id=3335, vol=9.979000e+03
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   70 and name   HN) 3.009 1.131 1.131 weight 1.000 ! spec=15Nnoesy, no=1100, id=3336, vol=6.725000e+03
assign (segid "   B" and resid   71 and name   HN) (segid "   B" and resid   70 and name   HN) 3.009 1.131 1.131 weight 1.000 ! spec=15Nnoesy, no=1100, id=3336, vol=6.725000e+03
assign (segid "   A" and resid   70 and name  HA2) (segid "   A" and resid   70 and name   HN) 3.056 1.168 1.168 weight 1.000 ! spec=15Nnoesy, no=1101, id=3337, vol=7.806000e+03
assign (segid "   B" and resid   70 and name  HA2) (segid "   B" and resid   70 and name   HN) 3.056 1.168 1.168 weight 1.000 ! spec=15Nnoesy, no=1101, id=3337, vol=7.806000e+03
assign (segid "   A" and resid   64 and name HG12) (segid "   A" and resid   70 and name   HN) 3.859 1.861 1.861 weight 1.000 ! spec=15Nnoesy, no=1102, id=3338, vol=8.897000e+03
    or (segid "   A" and resid   64 and name HG11) (segid "   A" and resid   70 and name   HN)
    or (segid "   A" and resid   64 and name HG13) (segid "   A" and resid   70 and name   HN)
assign (segid "   B" and resid   64 and name HG12) (segid "   B" and resid   70 and name   HN) 3.859 1.861 1.861 weight 1.000 ! spec=15Nnoesy, no=1102, id=3338, vol=8.897000e+03
    or (segid "   B" and resid   64 and name HG11) (segid "   B" and resid   70 and name   HN)
    or (segid "   B" and resid   64 and name HG13) (segid "   B" and resid   70 and name   HN)
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   70 and name   HN) 2.623 0.860 0.860 weight 1.000 ! spec=15Nnoesy, no=1104, id=3339, vol=1.322000e+04
assign (segid "   B" and resid   69 and name   HA) (segid "   B" and resid   70 and name   HN) 2.623 0.860 0.860 weight 1.000 ! spec=15Nnoesy, no=1104, id=3339, vol=1.322000e+04
assign (segid "   A" and resid   70 and name  HA1) (segid "   A" and resid   70 and name   HN) 3.364 1.415 1.415 weight 1.000 ! spec=15Nnoesy, no=1106, id=3341, vol=8.397000e+03
assign (segid "   B" and resid   70 and name  HA1) (segid "   B" and resid   70 and name   HN) 3.364 1.415 1.415 weight 1.000 ! spec=15Nnoesy, no=1106, id=3341, vol=8.397000e+03
assign (segid "   A" and resid   92 and name HG21) (segid "   A" and resid   37 and name   HN) 3.191 1.273 1.273 weight 1.000 ! spec=15Nnoesy, no=1109, id=3343, vol=1.668000e+04
    or (segid "   A" and resid   92 and name HG22) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   92 and name HG23) (segid "   A" and resid   37 and name   HN)
assign (segid "   B" and resid   92 and name HG21) (segid "   B" and resid   37 and name   HN) 3.191 1.273 1.273 weight 1.000 ! spec=15Nnoesy, no=1109, id=3343, vol=1.668000e+04
    or (segid "   B" and resid   92 and name HG22) (segid "   B" and resid   37 and name   HN)
    or (segid "   B" and resid   92 and name HG23) (segid "   B" and resid   37 and name   HN)
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   37 and name   HN) 3.942 1.942 1.942 weight 1.000 ! spec=15Nnoesy, no=1112, id=3346, vol=8.465000e+03
assign (segid "   B" and resid   91 and name   HA) (segid "   B" and resid   37 and name   HN) 3.942 1.942 1.942 weight 1.000 ! spec=15Nnoesy, no=1112, id=3346, vol=8.465000e+03
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid  110 and name   HA) 4.599 2.644 2.644 weight 1.000 ! spec=15Nnoesy, no=1123, id=3355, vol=3.045000e+03
assign (segid "   B" and resid   80 and name   HN) (segid "   B" and resid  110 and name   HA) 4.599 2.644 2.644 weight 1.000 ! spec=15Nnoesy, no=1123, id=3355, vol=3.045000e+03
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   80 and name  HB2) 4.263 2.271 2.271 weight 1.000 ! spec=15Nnoesy, no=1124, id=3356, vol=5.367000e+03
assign (segid "   B" and resid   80 and name   HN) (segid "   B" and resid   80 and name  HB2) 4.263 2.271 2.271 weight 1.000 ! spec=15Nnoesy, no=1124, id=3356, vol=5.367000e+03
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   79 and name   HA) 2.710 0.918 0.918 weight 1.000 ! spec=15Nnoesy, no=1125, id=3357, vol=1.229000e+04
assign (segid "   B" and resid   80 and name   HN) (segid "   B" and resid   79 and name   HA) 2.710 0.918 0.918 weight 1.000 ! spec=15Nnoesy, no=1125, id=3357, vol=1.229000e+04
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   46 and name   HN) 4.576 2.618 2.618 weight 1.000 ! spec=15Nnoesy, no=1126, id=3358, vol=7.874000e+03
assign (segid "   B" and resid   48 and name   HN) (segid "   B" and resid   46 and name   HN) 4.576 2.618 2.618 weight 1.000 ! spec=15Nnoesy, no=1126, id=3358, vol=7.874000e+03
assign (segid "   A" and resid   48 and name   HB) (segid "   A" and resid   48 and name   HN) 2.432 0.739 0.739 weight 1.000 ! spec=15Nnoesy, no=1128, id=3360, vol=2.070000e+04
assign (segid "   B" and resid   48 and name   HB) (segid "   B" and resid   48 and name   HN) 2.432 0.739 0.739 weight 1.000 ! spec=15Nnoesy, no=1128, id=3360, vol=2.070000e+04
assign (segid "   A" and resid   48 and name HG12) (segid "   A" and resid   48 and name   HN) 2.936 1.078 1.078 weight 1.000 ! spec=15Nnoesy, no=1132, id=3364, vol=2.561000e+04
    or (segid "   A" and resid   48 and name HG11) (segid "   A" and resid   48 and name   HN)
    or (segid "   A" and resid   48 and name HG13) (segid "   A" and resid   48 and name   HN)
assign (segid "   B" and resid   48 and name HG12) (segid "   B" and resid   48 and name   HN) 2.936 1.078 1.078 weight 1.000 ! spec=15Nnoesy, no=1132, id=3364, vol=2.561000e+04
    or (segid "   B" and resid   48 and name HG11) (segid "   B" and resid   48 and name   HN)
    or (segid "   B" and resid   48 and name HG13) (segid "   B" and resid   48 and name   HN)
assign (segid "   A" and resid   33 and name  HA2) (segid "   A" and resid   34 and name   HN) 3.058 1.169 1.169 weight 1.000 ! spec=15Nnoesy, no=1133, id=3365, vol=1.131000e+04
assign (segid "   B" and resid   33 and name  HA2) (segid "   B" and resid   34 and name   HN) 3.058 1.169 1.169 weight 1.000 ! spec=15Nnoesy, no=1133, id=3365, vol=1.131000e+04
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name   HN) 2.612 0.853 0.853 weight 1.000 ! spec=15Nnoesy, no=1135, id=3367, vol=1.736000e+04
assign (segid "   B" and resid   34 and name   HA) (segid "   B" and resid   34 and name   HN) 2.612 0.853 0.853 weight 1.000 ! spec=15Nnoesy, no=1135, id=3367, vol=1.736000e+04
assign (segid "   A" and resid   33 and name  HA1) (segid "   A" and resid   34 and name   HN) 3.214 1.291 1.291 weight 1.000 ! spec=15Nnoesy, no=1136, id=3368, vol=1.207000e+04
assign (segid "   B" and resid   33 and name  HA1) (segid "   B" and resid   34 and name   HN) 3.214 1.291 1.291 weight 1.000 ! spec=15Nnoesy, no=1136, id=3368, vol=1.207000e+04
assign (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name   HN) 3.622 1.640 1.640 weight 1.000 ! spec=15Nnoesy, no=1137, id=3369, vol=9.465000e+03
assign (segid "   B" and resid   34 and name  HB1) (segid "   B" and resid   34 and name   HN) 3.622 1.640 1.640 weight 1.000 ! spec=15Nnoesy, no=1137, id=3369, vol=9.465000e+03
assign (segid "   A" and resid   34 and name  HG1) (segid "   A" and resid   34 and name   HN) 3.116 1.214 1.214 weight 1.000 ! spec=15Nnoesy, no=1138, id=3370, vol=2.356000e+04
assign (segid "   B" and resid   34 and name  HG1) (segid "   B" and resid   34 and name   HN) 3.116 1.214 1.214 weight 1.000 ! spec=15Nnoesy, no=1138, id=3370, vol=2.356000e+04
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name   HN) 2.123 0.564 0.564 weight 1.000 ! spec=15Nnoesy, no=1140, id=3372, vol=1.609000e+04
assign (segid "   B" and resid   34 and name  HG2) (segid "   B" and resid   34 and name   HN) 2.123 0.564 0.564 weight 1.000 ! spec=15Nnoesy, no=1140, id=3372, vol=1.609000e+04
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HE2) 5.008 3.134 3.134 weight 1.000 ! spec=15Nnoesy, no=1141, id=3373, vol=4.807000e+03
assign (segid "   B" and resid   34 and name   HN) (segid "   B" and resid   34 and name  HE2) 5.008 3.134 3.134 weight 1.000 ! spec=15Nnoesy, no=1141, id=3373, vol=4.807000e+03
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name   HN) 2.018 0.509 0.509 weight 1.000 ! spec=15Nnoesy, no=1143, id=3375, vol=3.572000e+04
assign (segid "   B" and resid   34 and name  HB2) (segid "   B" and resid   34 and name   HN) 2.018 0.509 0.509 weight 1.000 ! spec=15Nnoesy, no=1143, id=3375, vol=3.572000e+04
assign (segid "   A" and resid   34 and name  HE1) (segid "   A" and resid   34 and name   HN) 4.853 2.944 2.944 weight 1.000 ! spec=15Nnoesy, no=1145, id=3377, vol=3.614000e+03
assign (segid "   B" and resid   34 and name  HE1) (segid "   B" and resid   34 and name   HN) 4.853 2.944 2.944 weight 1.000 ! spec=15Nnoesy, no=1145, id=3377, vol=3.614000e+03
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name  HB1) 3.106 1.206 1.206 weight 1.000 ! spec=15Nnoesy, no=1148, id=3378, vol=7.693000e+03
assign (segid "   B" and resid   79 and name   HN) (segid "   B" and resid   78 and name  HB1) 3.106 1.206 1.206 weight 1.000 ! spec=15Nnoesy, no=1148, id=3378, vol=7.693000e+03

assign (segid "   A" and resid    9 and name  HE1) (segid "   B" and resid  118 and name  HG2) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid    9 and name  HE2) (segid "   B" and resid  118 and name  HG2)
    or (segid "   A" and resid    9 and name  HE3) (segid "   B" and resid  118 and name  HG2)
assign (segid "   A" and resid    9 and name  HE1) (segid "   B" and resid  118 and name  HG3) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid    9 and name  HE2) (segid "   B" and resid  118 and name  HG3)
    or (segid "   A" and resid    9 and name  HE3) (segid "   B" and resid  118 and name  HG3)
assign (segid "   B" and resid    9 and name  HE1) (segid "   A" and resid  118 and name  HG2) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid    9 and name  HE2) (segid "   A" and resid  118 and name  HG2)
    or (segid "   B" and resid    9 and name  HE3) (segid "   A" and resid  118 and name  HG2)
assign (segid "   B" and resid    9 and name  HE1) (segid "   A" and resid  118 and name  HG3) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid    9 and name  HE2) (segid "   A" and resid  118 and name  HG3)
    or (segid "   B" and resid    9 and name  HE3) (segid "   A" and resid  118 and name  HG3)
assign (segid "   A" and resid    9 and name  HB2) (segid "   B" and resid  113 and name  HB2) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid    9 and name  HB2) (segid "   B" and resid  113 and name  HB3)
    or (segid "   A" and resid    9 and name  HB3) (segid "   B" and resid  113 and name  HB2)
    or (segid "   A" and resid    9 and name  HB3) (segid "   B" and resid  113 and name  HB3)
assign (segid "   B" and resid    9 and name  HB2) (segid "   A" and resid  113 and name  HB2) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid    9 and name  HB2) (segid "   A" and resid  113 and name  HB3)
    or (segid "   B" and resid    9 and name  HB3) (segid "   A" and resid  113 and name  HB2)
    or (segid "   B" and resid    9 and name  HB3) (segid "   A" and resid  113 and name  HB3)
assign (segid "   A" and resid    9 and name  HE1) (segid "   B" and resid  118 and name  HB2) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid    9 and name  HE2) (segid "   B" and resid  118 and name  HB2)
    or (segid "   A" and resid    9 and name  HE3) (segid "   B" and resid  118 and name  HB2)
assign (segid "   A" and resid    9 and name  HE1) (segid "   B" and resid  118 and name  HB3) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid    9 and name  HE2) (segid "   B" and resid  118 and name  HB3)
    or (segid "   A" and resid    9 and name  HE3) (segid "   B" and resid  118 and name  HB3)
assign (segid "   B" and resid    9 and name  HE1) (segid "   A" and resid  118 and name  HB2) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid    9 and name  HE2) (segid "   A" and resid  118 and name  HB2)
    or (segid "   B" and resid    9 and name  HE3) (segid "   A" and resid  118 and name  HB2)
assign (segid "   B" and resid    9 and name  HE1) (segid "   A" and resid  118 and name  HB3) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid    9 and name  HE2) (segid "   A" and resid  118 and name  HB3)
    or (segid "   B" and resid    9 and name  HE3) (segid "   A" and resid  118 and name  HB3)
assign (segid "   A" and resid   11 and name  HG2) (segid "   B" and resid  111 and name HG11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   11 and name  HG2) (segid "   B" and resid  111 and name HG12)
    or (segid "   A" and resid   11 and name  HG2) (segid "   B" and resid  111 and name HG13) 
    or (segid "   A" and resid   11 and name  HG3) (segid "   B" and resid  111 and name HG11)  
    or (segid "   A" and resid   11 and name  HG3) (segid "   B" and resid  111 and name HG12)
    or (segid "   A" and resid   11 and name  HG3) (segid "   B" and resid  111 and name HG13) 
assign (segid "   B" and resid   11 and name  HG2) (segid "   A" and resid  111 and name HG11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   11 and name  HG2) (segid "   A" and resid  111 and name HG12)
    or (segid "   B" and resid   11 and name  HG2) (segid "   A" and resid  111 and name HG13) 
    or (segid "   B" and resid   11 and name  HG3) (segid "   A" and resid  111 and name HG11)  
    or (segid "   B" and resid   11 and name  HG3) (segid "   A" and resid  111 and name HG12)
    or (segid "   B" and resid   11 and name  HG3) (segid "   A" and resid  111 and name HG13) 
assign (segid "   A" and resid   12 and name   HN) (segid "   B" and resid  111 and name HG21) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   12 and name   HN) (segid "   B" and resid  111 and name HG22)
    or (segid "   A" and resid   12 and name   HN) (segid "   B" and resid  111 and name HG22)
assign (segid "   B" and resid   12 and name   HN) (segid "   A" and resid  111 and name HG21) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   12 and name   HN) (segid "   A" and resid  111 and name HG22)
    or (segid "   B" and resid   12 and name   HN) (segid "   A" and resid  111 and name HG22)
assign (segid "   A" and resid   12 and name  HD1) (segid "   B" and resid  112 and name HD11) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid   12 and name  HD1) (segid "   B" and resid  112 and name HD12)
    or (segid "   A" and resid   12 and name  HD1) (segid "   B" and resid  112 and name HD13)
    or (segid "   A" and resid   12 and name  HD2) (segid "   B" and resid  112 and name HD11)
    or (segid "   A" and resid   12 and name  HD2) (segid "   B" and resid  112 and name HD12)
    or (segid "   A" and resid   12 and name  HD2) (segid "   B" and resid  112 and name HD13)   
assign (segid "   B" and resid   12 and name  HD1) (segid "   A" and resid  112 and name HD11) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid   12 and name  HD1) (segid "   A" and resid  112 and name HD12)
    or (segid "   B" and resid   12 and name  HD1) (segid "   A" and resid  112 and name HD13)
    or (segid "   B" and resid   12 and name  HD2) (segid "   A" and resid  112 and name HD11)
    or (segid "   B" and resid   12 and name  HD2) (segid "   A" and resid  112 and name HD12)
    or (segid "   B" and resid   12 and name  HD2) (segid "   A" and resid  112 and name HD13)   
assign (segid "   A" and resid   12 and name  HB2) (segid "   B" and resid  112 and name   HG) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid   12 and name  HB3) (segid "   B" and resid  112 and name   HG) 
assign (segid "   B" and resid   12 and name  HB2) (segid "   A" and resid  112 and name   HG) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   12 and name  HB3) (segid "   A" and resid  112 and name   HG)
assign (segid "   A" and resid   12 and name  HE1) (segid "   B" and resid  113 and name   HA) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   12 and name  HE2) (segid "   B" and resid  113 and name   HA) 
assign (segid "   B" and resid   12 and name  HE1) (segid "   A" and resid  113 and name   HA) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   12 and name  HE2) (segid "   A" and resid  113 and name   HA) 
assign (segid "   A" and resid   13 and name   HN) (segid "   B" and resid  111 and name   HA) 5.000 3.200 0.000 weight 1.000 
assign (segid "   B" and resid   13 and name   HN) (segid "   A" and resid  111 and name   HA) 5.000 3.200 0.000 weight 1.000 
assign (segid "   A" and resid  112 and name HD11) (segid "   B" and resid   14 and name HG21) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid  112 and name HD12) (segid "   B" and resid   14 and name HG21)
    or (segid "   A" and resid  112 and name HD13) (segid "   B" and resid   14 and name HG21)
    or (segid "   A" and resid  112 and name HD11) (segid "   B" and resid   14 and name HG22)
    or (segid "   A" and resid  112 and name HD12) (segid "   B" and resid   14 and name HG22)
    or (segid "   A" and resid  112 and name HD13) (segid "   B" and resid   14 and name HG22)
    or (segid "   A" and resid  112 and name HD11) (segid "   B" and resid   14 and name HG23)
    or (segid "   A" and resid  112 and name HD12) (segid "   B" and resid   14 and name HG23)
    or (segid "   A" and resid  112 and name HD13) (segid "   B" and resid   14 and name HG23)
assign (segid "   B" and resid  112 and name HD11) (segid "   A" and resid   14 and name HG21) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid  112 and name HD12) (segid "   A" and resid   14 and name HG21)
    or (segid "   B" and resid  112 and name HD13) (segid "   A" and resid   14 and name HG21)
    or (segid "   B" and resid  112 and name HD11) (segid "   A" and resid   14 and name HG22)
    or (segid "   B" and resid  112 and name HD12) (segid "   A" and resid   14 and name HG22)
    or (segid "   B" and resid  112 and name HD13) (segid "   A" and resid   14 and name HG22)
    or (segid "   B" and resid  112 and name HD11) (segid "   A" and resid   14 and name HG23)
    or (segid "   B" and resid  112 and name HD12) (segid "   A" and resid   14 and name HG23)
    or (segid "   B" and resid  112 and name HD13) (segid "   A" and resid   14 and name HG23)
assign (segid "   A" and resid  112 and name HD11) (segid "   B" and resid   14 and name   HA) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid  112 and name HD12) (segid "   B" and resid   14 and name   HA)
    or (segid "   A" and resid  112 and name HD13) (segid "   B" and resid   14 and name   HA)
assign (segid "   B" and resid  112 and name HD11) (segid "   A" and resid   14 and name   HA) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid  112 and name HD12) (segid "   A" and resid   14 and name   HA)
    or (segid "   B" and resid  112 and name HD13) (segid "   A" and resid   14 and name   HA) 
assign (segid "   A" and resid   71 and name HD11) (segid "   B" and resid   14 and name   HB) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   71 and name HD12) (segid "   B" and resid   14 and name   HB)
    or (segid "   A" and resid   71 and name HD13) (segid "   B" and resid   14 and name   HB)
assign (segid "   B" and resid   71 and name HD11) (segid "   A" and resid   14 and name   HB) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   71 and name HD12) (segid "   A" and resid   14 and name   HB)
    or (segid "   B" and resid   71 and name HD13) (segid "   A" and resid   14 and name   HB) 
assign (segid "   A" and resid  112 and name HD21) (segid "   B" and resid   14 and name   HN) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid  112 and name HD22) (segid "   B" and resid   14 and name   HN)
    or (segid "   A" and resid  112 and name HD23) (segid "   B" and resid   14 and name   HN)
assign (segid "   B" and resid  112 and name HD21) (segid "   A" and resid   14 and name   HN) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid  112 and name HD22) (segid "   A" and resid   14 and name   HN)
    or (segid "   B" and resid  112 and name HD23) (segid "   A" and resid   14 and name   HN) 
assign (segid "   A" and resid   21 and name  HZ2) (segid "   B" and resid   31 and name HD11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   21 and name  HZ2) (segid "   B" and resid   31 and name HD12)
    or (segid "   A" and resid   21 and name  HZ2) (segid "   B" and resid   31 and name HD13)
assign (segid "   B" and resid   21 and name  HZ2) (segid "   A" and resid   31 and name HD11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   21 and name  HZ2) (segid "   A" and resid   31 and name HD12)
    or (segid "   B" and resid   21 and name  HZ2) (segid "   A" and resid   31 and name HD13)
assign (segid "   A" and resid   21 and name  HH2) (segid "   B" and resid   31 and name HD11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   21 and name  HH2) (segid "   B" and resid   31 and name HD12)
    or (segid "   A" and resid   21 and name  HH2) (segid "   B" and resid   31 and name HD13)
assign (segid "   B" and resid   21 and name  HH2) (segid "   A" and resid   31 and name HD11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   21 and name  HH2) (segid "   A" and resid   31 and name HD12)
    or (segid "   B" and resid   21 and name  HH2) (segid "   A" and resid   31 and name HD13)
assign (segid "   A" and resid   44 and name HG21) (segid "   B" and resid   99 and name  HZ2) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   44 and name HG22) (segid "   B" and resid   99 and name  HZ2)
    or (segid "   A" and resid   44 and name HG23) (segid "   B" and resid   99 and name  HZ2)
assign (segid "   B" and resid   44 and name HG21) (segid "   A" and resid   99 and name  HZ2) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   44 and name HG22) (segid "   A" and resid   99 and name  HZ2) 
    or (segid "   B" and resid   44 and name HG23) (segid "   A" and resid   99 and name  HZ2) 
assign (segid "   A" and resid   44 and name HG21) (segid "   B" and resid   99 and name  HE1) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   44 and name HG22) (segid "   B" and resid   99 and name  HE1)
    or (segid "   A" and resid   44 and name HG23) (segid "   B" and resid   99 and name  HE1)
assign (segid "   B" and resid   44 and name HG21) (segid "   A" and resid   99 and name  HE1) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   44 and name HG22) (segid "   A" and resid   99 and name  HE1) 
    or (segid "   B" and resid   44 and name HG23) (segid "   A" and resid   99 and name  HE1) 
assign (segid "   A" and resid   44 and name HD11) (segid "   B" and resid   99 and name  HD1) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   44 and name HD12) (segid "   B" and resid   99 and name  HD1)
    or (segid "   A" and resid   44 and name HD13) (segid "   B" and resid   99 and name  HD1)
assign (segid "   B" and resid   44 and name HD11) (segid "   A" and resid   99 and name  HD1) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   44 and name HD12) (segid "   A" and resid   99 and name  HD1) 
    or (segid "   B" and resid   44 and name HD13) (segid "   A" and resid   99 and name  HD1)
assign (segid "   A" and resid   86 and name   HN) (segid "   B" and resid   54 and name  HD1) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   86 and name   HN) (segid "   B" and resid   54 and name  HD2)
assign (segid "   B" and resid   86 and name   HN) (segid "   A" and resid   54 and name  HD1) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   86 and name   HN) (segid "   A" and resid   54 and name  HD2)
assign (segid "   A" and resid   69 and name   HA) (segid "   B" and resid  112 and name HD11) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid   69 and name   HA) (segid "   B" and resid  112 and name HD12)
    or (segid "   A" and resid   69 and name   HA) (segid "   B" and resid  112 and name HD13)
    or (segid "   A" and resid   69 and name   HA) (segid "   B" and resid  112 and name HD11)
    or (segid "   A" and resid   69 and name   HA) (segid "   B" and resid  112 and name HD12)
    or (segid "   A" and resid   69 and name   HA) (segid "   B" and resid  112 and name HD13)
assign (segid "   B" and resid   69 and name   HA) (segid "   A" and resid  112 and name HD11) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid   69 and name   HA) (segid "   A" and resid  112 and name HD12)
    or (segid "   B" and resid   69 and name   HA) (segid "   A" and resid  112 and name HD13)
    or (segid "   B" and resid   69 and name   HA) (segid "   A" and resid  112 and name HD11)
    or (segid "   B" and resid   69 and name   HA) (segid "   A" and resid  112 and name HD12)
    or (segid "   B" and resid   69 and name   HA) (segid "   A" and resid  112 and name HD13)
assign (segid "   A" and resid   70 and name  HA1) (segid "   B" and resid  112 and name   HG) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid   70 and name  HA2) (segid "   B" and resid  112 and name   HG)
assign (segid "   B" and resid   70 and name  HA1) (segid "   A" and resid  112 and name   HG) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid   70 and name  HA2) (segid "   A" and resid  112 and name   HG)
assign (segid "   A" and resid   70 and name  HA1) (segid "   B" and resid  112 and name HD11) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid   70 and name  HA1) (segid "   B" and resid  112 and name HD12)
    or (segid "   A" and resid   70 and name  HA1) (segid "   B" and resid  112 and name HD13)
    or (segid "   A" and resid   70 and name  HA2) (segid "   B" and resid  112 and name HD11)
    or (segid "   A" and resid   70 and name  HA2) (segid "   B" and resid  112 and name HD12)
    or (segid "   A" and resid   70 and name  HA2) (segid "   B" and resid  112 and name HD13)
assign (segid "   B" and resid   70 and name  HA1) (segid "   A" and resid  112 and name HD11) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid   70 and name  HA1) (segid "   A" and resid  112 and name HD12)
    or (segid "   B" and resid   70 and name  HA1) (segid "   A" and resid  112 and name HD13)
    or (segid "   B" and resid   70 and name  HA2) (segid "   A" and resid  112 and name HD11)
    or (segid "   B" and resid   70 and name  HA2) (segid "   A" and resid  112 and name HD12)
    or (segid "   B" and resid   70 and name  HA2) (segid "   A" and resid  112 and name HD13)
assign (segid "   A" and resid   70 and name   HN) (segid "   B" and resid  112 and name HD11) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid   70 and name   HN) (segid "   B" and resid  112 and name HD12)
    or (segid "   A" and resid   70 and name   HN) (segid "   B" and resid  112 and name HD13)
assign (segid "   B" and resid   70 and name   HN) (segid "   A" and resid  112 and name HD11) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid   70 and name   HN) (segid "   A" and resid  112 and name HD12)
    or (segid "   B" and resid   70 and name   HN) (segid "   A" and resid  112 and name HD13)
assign (segid "   A" and resid   70 and name  HA1) (segid "   B" and resid   76 and name  HE1) 5.000 3.200 0.000 weight 1.000
    or (segid "   A" and resid   70 and name  HA2) (segid "   B" and resid   76 and name  HE1)
assign (segid "   B" and resid   70 and name  HA1) (segid "   A" and resid   76 and name  HE1) 5.000 3.200 0.000 weight 1.000
    or (segid "   B" and resid   70 and name  HA2) (segid "   A" and resid   76 and name  HE1)
assign (segid "   A" and resid   70 and name   HN) (segid "   B" and resid   76 and name  HE1) 5.000 3.200 0.000 weight 1.000
assign (segid "   B" and resid   70 and name   HN) (segid "   A" and resid   76 and name  HE1) 5.000 3.200 0.000 weight 1.000
assign (segid "   A" and resid  112 and name HD11) (segid "   B" and resid   71 and name   HN) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid  112 and name HD12) (segid "   B" and resid   71 and name   HN)
    or (segid "   A" and resid  112 and name HD13) (segid "   B" and resid   71 and name   HN)
assign (segid "   B" and resid  112 and name HD11) (segid "   A" and resid   71 and name   HN) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid  112 and name HD12) (segid "   A" and resid   71 and name   HN)
    or (segid "   B" and resid  112 and name HD13) (segid "   A" and resid   71 and name   HN) 
assign (segid "   A" and resid   85 and name   HA) (segid "   B" and resid  106 and name HG21) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   85 and name   HA) (segid "   B" and resid  106 and name HG22)
    or (segid "   A" and resid   85 and name   HA) (segid "   B" and resid  106 and name HG23) 
assign (segid "   B" and resid   85 and name   HA) (segid "   A" and resid  106 and name HG21) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   85 and name   HA) (segid "   A" and resid  106 and name HG22)
    or (segid "   B" and resid   85 and name   HA) (segid "   A" and resid  106 and name HG23)
assign (segid "   A" and resid   85 and name HG21) (segid "   B" and resid  106 and name HG21) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid   85 and name HG21) (segid "   B" and resid  106 and name HG22)
    or (segid "   A" and resid   85 and name HG21) (segid "   B" and resid  106 and name HG23) 
    or (segid "   A" and resid   85 and name HG22) (segid "   B" and resid  106 and name HG21)
    or (segid "   A" and resid   85 and name HG22) (segid "   B" and resid  106 and name HG22)
    or (segid "   A" and resid   85 and name HG22) (segid "   B" and resid  106 and name HG23)
    or (segid "   A" and resid   85 and name HG23) (segid "   B" and resid  106 and name HG21)
    or (segid "   A" and resid   85 and name HG23) (segid "   B" and resid  106 and name HG22)
    or (segid "   A" and resid   85 and name HG23) (segid "   B" and resid  106 and name HG23)
assign (segid "   B" and resid   85 and name HG21) (segid "   A" and resid  106 and name HG21) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid   85 and name HG21) (segid "   A" and resid  106 and name HG22)
    or (segid "   B" and resid   85 and name HG21) (segid "   A" and resid  106 and name HG23)
    or (segid "   B" and resid   85 and name HG22) (segid "   A" and resid  106 and name HG21)
    or (segid "   B" and resid   85 and name HG22) (segid "   A" and resid  106 and name HG22)
    or (segid "   B" and resid   85 and name HG22) (segid "   A" and resid  106 and name HG23)
    or (segid "   B" and resid   85 and name HG23) (segid "   A" and resid  106 and name HG21)
    or (segid "   B" and resid   85 and name HG23) (segid "   A" and resid  106 and name HG22)
    or (segid "   B" and resid   85 and name HG23) (segid "   A" and resid  106 and name HG23)
assign (segid "   A" and resid  107 and name  HB1) (segid "   B" and resid  109 and name HG11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid  107 and name  HB1) (segid "   B" and resid  109 and name HG12)
    or (segid "   A" and resid  107 and name  HB1) (segid "   B" and resid  109 and name HG13) 
    or (segid "   A" and resid  107 and name  HB2) (segid "   B" and resid  109 and name HG11)  
    or (segid "   A" and resid  107 and name  HB2) (segid "   B" and resid  109 and name HG12)
    or (segid "   A" and resid  107 and name  HB2) (segid "   B" and resid  109 and name HG13)
    or (segid "   A" and resid  107 and name  HB3) (segid "   B" and resid  109 and name HG11)  
    or (segid "   A" and resid  107 and name  HB3) (segid "   B" and resid  109 and name HG12)
    or (segid "   A" and resid  107 and name  HB3) (segid "   B" and resid  109 and name HG13)
assign (segid "   B" and resid  107 and name  HB1) (segid "   A" and resid  109 and name HG11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid  107 and name  HB1) (segid "   A" and resid  109 and name HG12)
    or (segid "   B" and resid  107 and name  HB1) (segid "   A" and resid  109 and name HG13)
    or (segid "   B" and resid  107 and name  HB2) (segid "   A" and resid  109 and name HG11) 
    or (segid "   B" and resid  107 and name  HB2) (segid "   A" and resid  109 and name HG12)
    or (segid "   B" and resid  107 and name  HB2) (segid "   A" and resid  109 and name HG13)
    or (segid "   B" and resid  107 and name  HB3) (segid "   A" and resid  109 and name HG11) 
    or (segid "   B" and resid  107 and name  HB3) (segid "   A" and resid  109 and name HG12)
    or (segid "   B" and resid  107 and name  HB3) (segid "   A" and resid  109 and name HG13)
assign (segid "   A" and resid  108 and name   HN) (segid "   B" and resid  109 and name HG11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid  108 and name   HN) (segid "   B" and resid  109 and name HG12)
    or (segid "   A" and resid  108 and name   HN) (segid "   B" and resid  109 and name HG13) 
assign (segid "   B" and resid  108 and name   HN) (segid "   A" and resid  109 and name HG11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid  108 and name   HN) (segid "   A" and resid  109 and name HG12)
    or (segid "   B" and resid  108 and name   HN) (segid "   A" and resid  109 and name HG13)
assign (segid "   A" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD11)
    or (segid "   A" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD11)
    or (segid "   A" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD12)
    or (segid "   A" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD12)
    or (segid "   A" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD12)
    or (segid "   A" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD13)
    or (segid "   A" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD13)
    or (segid "   A" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD13)
assign (segid "   B" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD11)
    or (segid "   B" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD11)
    or (segid "   B" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD12)
    or (segid "   B" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD12)
    or (segid "   B" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD12)
    or (segid "   B" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD13)
    or (segid "   B" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD13)
    or (segid "   B" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD13)
assign (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD12)
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD12)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD12)
    or (segid "   A" and resid  112 and name HD11) (segid "   A" and resid   71 and name HD13)
    or (segid "   A" and resid  112 and name HD12) (segid "   A" and resid   71 and name HD13)
    or (segid "   A" and resid  112 and name HD13) (segid "   A" and resid   71 and name HD13)
assign (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD11) 5.000 3.200 0.000 weight 1.000 
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD12)
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD12)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD12)
    or (segid "   B" and resid  112 and name HD11) (segid "   B" and resid   71 and name HD13)
    or (segid "   B" and resid  112 and name HD12) (segid "   B" and resid   71 and name HD13)
    or (segid "   B" and resid  112 and name HD13) (segid "   B" and resid   71 and name HD13)
# Restraints file 2: NGF_ambig.tbl
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    7 and name  HB1) 4.969 3.086 3.086 weight 1.000 ! spec=13Cn...5deg, no=898, id=4131, vol=1.057000e+04
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    7 and name  HB1)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    7 and name  HB1)
    or (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    8 and name  HB2)
    or (segid "   A" and resid    9 and name  HE1) (segid "   A" and resid    8 and name  HB2)
    or (segid "   A" and resid    9 and name  HE3) (segid "   A" and resid    8 and name  HB2)
assign (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    7 and name  HB1) 4.969 3.086 3.086 weight 1.000 ! spec=13Cn...5deg, no=898, id=4131, vol=1.057000e+04
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    7 and name  HB1)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    7 and name  HB1)
    or (segid "   B" and resid    9 and name  HE2) (segid "   B" and resid    8 and name  HB2)
    or (segid "   B" and resid    9 and name  HE1) (segid "   B" and resid    8 and name  HB2)
    or (segid "   B" and resid    9 and name  HE3) (segid "   B" and resid    8 and name  HB2)
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   71 and name HD12) 4.280 2.290 2.290 weight 1.000 ! spec=13Cn...5deg, no=1000, id=4221, vol=2.513000e+04
    or (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   71 and name HD11)
    or (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   71 and name HD13)
    or (segid "   A" and resid   71 and name HD12) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   71 and name HD11) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   71 and name HD13) (segid "   A" and resid   76 and name  HB2)
assign (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   71 and name HD12) 4.280 2.290 2.290 weight 1.000 ! spec=13Cn...5deg, no=1000, id=4221, vol=2.513000e+04
    or (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   71 and name HD11)
    or (segid "   B" and resid   68 and name  HB1) (segid "   B" and resid   71 and name HD13)
    or (segid "   B" and resid   71 and name HD12) (segid "   B" and resid   76 and name  HB2)
    or (segid "   B" and resid   71 and name HD11) (segid "   B" and resid   76 and name  HB2)
    or (segid "   B" and resid   71 and name HD13) (segid "   B" and resid   76 and name  HB2)
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid  108 and name  HB1) 5.429 3.685 3.685 weight 1.000 ! spec=13Cn...5deg, no=1772, id=4881, vol=7.715000e+03
    or (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid  110 and name  HB1)
assign (segid "   B" and resid   15 and name  HB1) (segid "   B" and resid  108 and name  HB1) 5.429 3.685 3.685 weight 1.000 ! spec=13Cn...5deg, no=1772, id=4881, vol=7.715000e+03
    or (segid "   B" and resid   15 and name  HB1) (segid "   B" and resid  110 and name  HB1)
assign (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   93 and name  HB2) 3.504 1.534 1.534 weight 1.000 ! spec=13Cnoesy, no=462, id=374, vol=8.924000e+02
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   93 and name  HB2)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   93 and name  HB2)
    or (segid "   A" and resid   36 and name HG12) (segid "   A" and resid   30 and name  HB2)
    or (segid "   A" and resid   36 and name HG11) (segid "   A" and resid   30 and name  HB2)
    or (segid "   A" and resid   36 and name HG13) (segid "   A" and resid   30 and name  HB2)
assign (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   93 and name  HB2) 3.504 1.534 1.534 weight 1.000 ! spec=13Cnoesy, no=462, id=374, vol=8.924000e+02
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   93 and name  HB2)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   93 and name  HB2)
    or (segid "   B" and resid   36 and name HG12) (segid "   B" and resid   30 and name  HB2)
    or (segid "   B" and resid   36 and name HG11) (segid "   B" and resid   30 and name  HB2)
    or (segid "   B" and resid   36 and name HG13) (segid "   B" and resid   30 and name  HB2)
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid  100 and name  HG2) 4.953 3.067 3.067 weight 1.000 ! spec=13Cnoesy, no=522, id=418, vol=5.225000e+02
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid  102 and name HG12)
assign (segid "   B" and resid   91 and name   HA) (segid "   B" and resid  100 and name  HG2) 4.953 3.067 3.067 weight 1.000 ! spec=13Cnoesy, no=522, id=418, vol=5.225000e+02
    or (segid "   B" and resid   91 and name   HA) (segid "   B" and resid  102 and name HG12)
assign (segid "   A" and resid  102 and name HD12) (segid "   A" and resid  101 and name   HA) 5.156 3.323 3.323 weight 1.000 ! spec=13Cnoesy, no=1198, id=979, vol=4.869000e+02
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid  101 and name   HA)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid  101 and name   HA)
    or (segid "   A" and resid  102 and name HD12) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid  102 and name HD11) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid  102 and name HD13) (segid "   A" and resid   29 and name   HA)
assign (segid "   B" and resid  102 and name HD12) (segid "   B" and resid  101 and name   HA) 5.156 3.323 3.323 weight 1.000 ! spec=13Cnoesy, no=1198, id=979, vol=4.869000e+02
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid  101 and name   HA)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid  101 and name   HA)
    or (segid "   B" and resid  102 and name HD12) (segid "   B" and resid   29 and name   HA)
    or (segid "   B" and resid  102 and name HD11) (segid "   B" and resid   29 and name   HA)
    or (segid "   B" and resid  102 and name HD13) (segid "   B" and resid   29 and name   HA)
assign (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   54 and name  HB2) 4.549 2.587 2.587 weight 1.000 ! spec=13Cnoesy, no=1332, id=1087, vol=7.045000e+02
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   54 and name  HB2)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   54 and name  HB2)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid  105 and name  HB2)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid  105 and name  HB2)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid  105 and name  HB2)
assign (segid "   B" and resid   85 and name HG21) (segid "   B" and resid   54 and name  HB2) 4.549 2.587 2.587 weight 1.000 ! spec=13Cnoesy, no=1332, id=1087, vol=7.045000e+02
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid   54 and name  HB2)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid   54 and name  HB2)
    or (segid "   B" and resid   85 and name HG21) (segid "   B" and resid  105 and name  HB2)
    or (segid "   B" and resid   85 and name HG22) (segid "   B" and resid  105 and name  HB2)
    or (segid "   B" and resid   85 and name HG23) (segid "   B" and resid  105 and name  HB2)
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   16 and name  HB2) 5.206 3.387 3.387 weight 1.000 ! spec=13Cnoesy, no=1388, id=1130, vol=4.599000e+02
    or (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid  108 and name  HB1)
    or (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid  110 and name  HB1)
assign (segid "   B" and resid   15 and name  HB2) (segid "   B" and resid   16 and name  HB2) 5.206 3.387 3.387 weight 1.000 ! spec=13Cnoesy, no=1388, id=1130, vol=4.599000e+02
    or (segid "   B" and resid   15 and name  HB2) (segid "   B" and resid  108 and name  HB1)
    or (segid "   B" and resid   15 and name  HB2) (segid "   B" and resid  110 and name  HB1)
assign (segid "   A" and resid  115 and name  HB1) (segid "   A" and resid  114 and name   HN) 4.826 2.912 2.912 weight 1.000 ! spec=13Cnoesy, no=2778, id=2297, vol=5.281000e+02
    or (segid "   A" and resid  115 and name  HB1) (segid "   A" and resid   77 and name   HN)
assign (segid "   B" and resid  115 and name  HB1) (segid "   B" and resid  114 and name   HN) 4.826 2.912 2.912 weight 1.000 ! spec=13Cnoesy, no=2778, id=2297, vol=5.281000e+02
    or (segid "   B" and resid  115 and name  HB1) (segid "   B" and resid   77 and name   HN)
assign (segid "   A" and resid   39 and name HD12) (segid "   A" and resid   40 and name   HN) 4.496 2.526 2.526 weight 1.000 ! spec=13Cnoesy, no=2903, id=2406, vol=1.168000e+03
    or (segid "   A" and resid   39 and name HD11) (segid "   A" and resid   40 and name   HN)
    or (segid "   A" and resid   39 and name HD13) (segid "   A" and resid   40 and name   HN)
    or (segid "   A" and resid   39 and name HD12) (segid "   A" and resid   42 and name   HN)
    or (segid "   A" and resid   39 and name HD11) (segid "   A" and resid   42 and name   HN)
    or (segid "   A" and resid   39 and name HD13) (segid "   A" and resid   42 and name   HN)
assign (segid "   B" and resid   39 and name HD12) (segid "   B" and resid   40 and name   HN) 4.496 2.526 2.526 weight 1.000 ! spec=13Cnoesy, no=2903, id=2406, vol=1.168000e+03
    or (segid "   B" and resid   39 and name HD11) (segid "   B" and resid   40 and name   HN)
    or (segid "   B" and resid   39 and name HD13) (segid "   B" and resid   40 and name   HN)
    or (segid "   B" and resid   39 and name HD12) (segid "   B" and resid   42 and name   HN)
    or (segid "   B" and resid   39 and name HD11) (segid "   B" and resid   42 and name   HN)
    or (segid "   B" and resid   39 and name HD13) (segid "   B" and resid   42 and name   HN)
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   89 and name  HB2) 3.108 1.207 1.207 weight 1.000 ! spec=15Nn...5deg, no=461, id=6019, vol=1.081000e+03
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   89 and name  HB1)
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   89 and name  HB3)
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   98 and name  HB2)
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   98 and name  HB1)
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   98 and name  HB3)
assign (segid "   B" and resid  100 and name   HN) (segid "   B" and resid   89 and name  HB2) 3.108 1.207 1.207 weight 1.000 ! spec=15Nn...5deg, no=461, id=6019, vol=1.081000e+03
    or (segid "   B" and resid  100 and name   HN) (segid "   B" and resid   89 and name  HB1)
    or (segid "   B" and resid  100 and name   HN) (segid "   B" and resid   89 and name  HB3)
    or (segid "   B" and resid  100 and name   HN) (segid "   B" and resid   98 and name  HB2)
    or (segid "   B" and resid  100 and name   HN) (segid "   B" and resid   98 and name  HB1)
    or (segid "   B" and resid  100 and name   HN) (segid "   B" and resid   98 and name  HB3)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   87 and name HG12) 4.584 2.627 2.627 weight 1.000 ! spec=15Nn...5deg, no=970, id=6430, vol=2.608000e+02
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   87 and name HG11)
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   87 and name HG13)
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid  103 and name  HB1)
assign (segid "   B" and resid   85 and name   HN) (segid "   B" and resid   87 and name HG12) 4.584 2.627 2.627 weight 1.000 ! spec=15Nn...5deg, no=970, id=6430, vol=2.608000e+02
    or (segid "   B" and resid   85 and name   HN) (segid "   B" and resid   87 and name HG11)
    or (segid "   B" and resid   85 and name   HN) (segid "   B" and resid   87 and name HG13)
    or (segid "   B" and resid   85 and name   HN) (segid "   B" and resid  103 and name  HB1)
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           H1       SER   1  19.256 -25.327 -15.740
    2    H2   SER   1           H2       SER   1  18.162 -24.371 -14.878
    3    H3   SER   1           H3       SER   1  18.796 -25.770 -14.173
    4    HA   SER   1           HA       SER   1  20.998 -24.807 -14.193
    5    HB2  SER   1           HB3      SER   1  21.043 -22.278 -14.657
    6    HB3  SER   1           HB2      SER   1  20.935 -23.348 -16.054
    7    HG   SER   1           HG       SER   1  19.428 -21.491 -15.962
    8    H    SER   2           H        SER   2  21.606 -24.194 -12.183
    9    HA   SER   2           HA       SER   2  19.464 -23.349 -10.377
   10    HB2  SER   2           HB3      SER   2  21.175 -23.994  -8.600
   11    HB3  SER   2           HB2      SER   2  20.566 -25.308  -9.609
   12    HG   SER   2           HG       SER   2  22.708 -25.594  -9.655
   13    H    THR   3           H        THR   3  21.050 -21.595 -12.264
   14    HA   THR   3           HA       THR   3  22.611 -19.906 -10.515
   15    HB   THR   3           HB       THR   3  22.604 -18.465 -12.712
   16    HG1  THR   3           HG1      THR   3  22.180 -19.699 -14.549
   17   HG21  THR   3          HG21      THR   3  24.567 -19.605 -11.831
   18   HG22  THR   3          HG22      THR   3  24.473 -19.818 -13.578
   19   HG23  THR   3          HG23      THR   3  24.002 -21.134 -12.502
   20    H    HIS   4           H        HIS   4  20.032 -20.049  -9.578
   21    HA   HIS   4           HA       HIS   4  19.290 -17.256  -9.730
   22    HB2  HIS   4           HB3      HIS   4  16.894 -17.700 -10.081
   23    HB3  HIS   4           HB2      HIS   4  17.849 -18.229 -11.453
   24    HD1  HIS   4           HD1      HIS   4  17.967 -20.796 -11.892
   25    HD2  HIS   4           HD2      HIS   4  15.478 -19.700  -8.748
   26    HE1  HIS   4           HE1      HIS   4  16.587 -22.827 -11.382
   27    HE2  HIS   4           HE2      HIS   4  15.194 -22.192  -9.384
   28    HA   PRO   5           HA       PRO   5  18.968 -18.524  -5.417
   29    HB2  PRO   5           HB3      PRO   5  19.516 -16.139  -4.342
   30    HB3  PRO   5           HB2      PRO   5  20.787 -17.113  -5.092
   31    HG2  PRO   5           HG3      PRO   5  19.310 -14.752  -6.186
   32    HG3  PRO   5           HG2      PRO   5  21.031 -15.153  -6.324
   33    HD2  PRO   5           HD3      PRO   5  19.137 -15.625  -8.285
   34    HD3  PRO   5           HD2      PRO   5  20.684 -16.484  -8.147
   35    H    VAL   6           H        VAL   6  16.640 -18.066  -6.970
   36    HA   VAL   6           HA       VAL   6  14.457 -17.417  -6.880
   37    HB   VAL   6           HB       VAL   6  14.855 -17.109  -3.907
   38   HG11  VAL   6          HG11      VAL   6  12.488 -17.984  -5.554
   39   HG12  VAL   6          HG12      VAL   6  12.673 -16.441  -4.719
   40   HG13  VAL   6          HG13      VAL   6  12.544 -17.936  -3.793
   41   HG21  VAL   6          HG21      VAL   6  15.898 -19.198  -4.541
   42   HG22  VAL   6          HG22      VAL   6  14.462 -19.667  -5.450
   43   HG23  VAL   6          HG23      VAL   6  14.384 -19.512  -3.695
   44    H    PHE   7           H        PHE   7  16.030 -15.448  -7.686
   45    HA   PHE   7           HA       PHE   7  16.278 -13.222  -7.987
   46    HB2  PHE   7           HB3      PHE   7  13.788 -13.216  -7.919
   47    HB3  PHE   7           HB2      PHE   7  13.863 -12.925  -6.187
   48    HD1  PHE   7           HD1      PHE   7  14.550 -10.756  -5.323
   49    HD2  PHE   7           HD2      PHE   7  14.298 -11.487  -9.504
   50    HE1  PHE   7           HE1      PHE   7  14.612  -8.336  -5.742
   51    HE2  PHE   7           HE2      PHE   7  14.363  -9.066  -9.938
   52    HZ   PHE   7           HZ       PHE   7  14.520  -7.486  -8.057
   53    H    HIS   8           H        HIS   8  15.079 -13.352  -4.658
   54    HA   HIS   8           HA       HIS   8  17.689 -12.633  -3.600
   55    HB2  HIS   8           HB3      HIS   8  16.456 -10.480  -4.198
   56    HB3  HIS   8           HB2      HIS   8  15.267 -10.919  -2.983
   57    HD1  HIS   8           HD1      HIS   8  18.806  -9.731  -3.364
   58    HD2  HIS   8           HD2      HIS   8  16.046 -10.463  -0.340
   59    HE1  HIS   8           HE1      HIS   8  19.771  -8.679  -1.294
   60    HE2  HIS   8           HE2      HIS   8  18.112  -9.178   0.534
   61    H    MET   9           H        MET   9  16.643 -14.996  -3.359
   62    HA   MET   9           HA       MET   9  15.603 -16.612  -2.167
   63    HB2  MET   9           HB3      MET   9  16.231 -16.749   0.177
   64    HB3  MET   9           HB2      MET   9  17.589 -16.223  -0.797
   65    HG2  MET   9           HG3      MET   9  17.156 -13.898  -0.060
   66    HG3  MET   9           HG2      MET   9  15.883 -14.509   0.989
   67    HE1  MET   9           HE1      MET   9  19.298 -16.310   0.206
   68    HE2  MET   9           HE2      MET   9  20.330 -15.656   1.478
   69    HE3  MET   9           HE3      MET   9  19.732 -14.600   0.198
   70    H    GLY  10           H        GLY  10  13.811 -14.751  -3.002
   71    HA2  GLY  10           HA3      GLY  10  11.450 -15.190  -1.839
   72    HA3  GLY  10           HA2      GLY  10  12.117 -13.954  -0.779
   73    H    GLU  11           H        GLU  11  10.930 -12.195  -1.271
   74    HA   GLU  11           HA       GLU  11  10.362 -10.286  -2.346
   75    HB2  GLU  11           HB3      GLU  11  12.667 -10.366  -3.273
   76    HB3  GLU  11           HB2      GLU  11  12.054 -11.271  -4.657
   77    HG2  GLU  11           HG3      GLU  11  12.333  -8.938  -5.225
   78    HG3  GLU  11           HG2      GLU  11  10.624  -9.368  -5.250
   79    H    PHE  12           H        PHE  12  10.270 -13.125  -4.490
   80    HA   PHE  12           HA       PHE  12   8.106 -12.284  -6.076
   81    HB2  PHE  12           HB3      PHE  12   8.951 -15.079  -5.270
   82    HB3  PHE  12           HB2      PHE  12   7.724 -14.733  -6.485
   83    HD1  PHE  12           HD1      PHE  12  10.955 -15.735  -6.149
   84    HD2  PHE  12           HD2      PHE  12   8.665 -12.801  -8.208
   85    HE1  PHE  12           HE1      PHE  12  12.698 -15.589  -7.878
   86    HE2  PHE  12           HE2      PHE  12  10.402 -12.651  -9.941
   87    HZ   PHE  12           HZ       PHE  12  12.422 -14.046  -9.777
   88    H    SER  13           H        SER  13   5.883 -12.563  -5.864
   89    HA   SER  13           HA       SER  13   5.003 -13.375  -3.178
   90    HB2  SER  13           HB3      SER  13   4.865 -10.902  -3.555
   91    HB3  SER  13           HB2      SER  13   3.740 -11.203  -4.873
   92    HG   SER  13           HG       SER  13   3.370 -11.935  -2.148
   93    H    VAL  14           H        VAL  14   2.494 -13.754  -3.245
   94    HA   VAL  14           HA       VAL  14   2.022 -16.003  -4.865
   95    HB   VAL  14           HB       VAL  14  -0.338 -15.832  -4.097
   96   HG11  VAL  14          HG11      VAL  14   1.731 -15.425  -1.941
   97   HG12  VAL  14          HG12      VAL  14   1.337 -16.953  -2.725
   98   HG13  VAL  14          HG13      VAL  14   0.138 -16.143  -1.719
   99   HG21  VAL  14          HG21      VAL  14  -0.960 -14.085  -2.497
  100   HG22  VAL  14          HG22      VAL  14  -0.566 -13.403  -4.075
  101   HG23  VAL  14          HG23      VAL  14   0.595 -13.296  -2.752
  102    H    CYS  15           H        CYS  15   1.448 -12.633  -5.348
  103    HA   CYS  15           HA       CYS  15   0.452 -13.178  -8.049
  104    HB2  CYS  15           HB3      CYS  15  -1.459 -12.567  -6.554
  105    HB3  CYS  15           HB2      CYS  15  -0.650 -11.040  -6.200
  106    H    ASP  16           H        ASP  16   0.867 -11.374  -9.531
  107    HA   ASP  16           HA       ASP  16   3.344 -10.010  -8.771
  108    HB2  ASP  16           HB3      ASP  16   2.103 -10.481 -11.497
  109    HB3  ASP  16           HB2      ASP  16   3.580  -9.560 -11.230
  110    H    SER  17           H        SER  17   3.217  -8.024  -8.091
  111    HA   SER  17           HA       SER  17   1.008  -6.324  -9.024
  112    HB2  SER  17           HB3      SER  17   1.434  -5.060  -6.863
  113    HB3  SER  17           HB2      SER  17   0.800  -6.699  -6.663
  114    HG   SER  17           HG       SER  17   2.492  -7.042  -5.478
  115    H    VAL  18           H        VAL  18   1.435  -4.178  -9.576
  116    HA   VAL  18           HA       VAL  18   4.285  -3.490  -9.842
  117    HB   VAL  18           HB       VAL  18   3.422  -4.003 -12.042
  118   HG11  VAL  18          HG11      VAL  18   1.059  -3.700 -11.678
  119   HG12  VAL  18          HG12      VAL  18   1.583  -2.718 -13.047
  120   HG13  VAL  18          HG13      VAL  18   1.280  -1.960 -11.484
  121   HG21  VAL  18          HG21      VAL  18   3.733  -1.036 -11.629
  122   HG22  VAL  18          HG22      VAL  18   3.839  -1.863 -13.183
  123   HG23  VAL  18          HG23      VAL  18   5.023  -2.203 -11.922
  124    H    SER  19           H        SER  19   4.790  -1.795  -8.623
  125    HA   SER  19           HA       SER  19   2.649   0.064  -7.851
  126    HB2  SER  19           HB3      SER  19   3.996  -1.178  -6.065
  127    HB3  SER  19           HB2      SER  19   5.365  -0.173  -6.543
  128    HG   SER  19           HG       SER  19   2.900   0.616  -5.394
  129    H    VAL  20           H        VAL  20   2.575   1.918  -8.893
  130    HA   VAL  20           HA       VAL  20   5.083   3.007 -10.012
  131    HB   VAL  20           HB       VAL  20   2.294   3.285 -11.140
  132   HG11  VAL  20          HG11      VAL  20   4.946   4.227 -12.206
  133   HG12  VAL  20          HG12      VAL  20   3.622   5.235 -11.619
  134   HG13  VAL  20          HG13      VAL  20   3.418   4.279 -13.086
  135   HG21  VAL  20          HG21      VAL  20   4.619   1.646 -12.132
  136   HG22  VAL  20          HG22      VAL  20   3.077   1.859 -12.964
  137   HG23  VAL  20          HG23      VAL  20   3.135   1.022 -11.412
  138    H    TRP  21           H        TRP  21   5.536   5.116  -9.592
  139    HA   TRP  21           HA       TRP  21   3.692   6.566  -7.864
  140    HB2  TRP  21           HB3      TRP  21   6.547   7.098  -8.712
  141    HB3  TRP  21           HB2      TRP  21   5.598   8.249  -7.776
  142    HD1  TRP  21           HD1      TRP  21   7.219   4.773  -7.478
  143    HE1  TRP  21           HE1      TRP  21   7.461   4.193  -4.983
  144    HE3  TRP  21           HE3      TRP  21   4.678   8.738  -5.467
  145    HZ2  TRP  21           HZ2      TRP  21   6.687   5.271  -2.495
  146    HZ3  TRP  21           HZ3      TRP  21   4.480   8.886  -3.017
  147    HH2  TRP  21           HH2      TRP  21   5.463   7.190  -1.565
  148    H    VAL  22           H        VAL  22   2.073   7.272  -9.085
  149    HA   VAL  22           HA       VAL  22   2.560   8.323 -11.746
  150    HB   VAL  22           HB       VAL  22  -0.047   7.988 -10.251
  151   HG11  VAL  22          HG11      VAL  22  -1.101   8.164 -12.436
  152   HG12  VAL  22          HG12      VAL  22   0.474   8.416 -13.187
  153   HG13  VAL  22          HG13      VAL  22  -0.170   9.616 -12.069
  154   HG21  VAL  22          HG21      VAL  22   1.274   6.173 -12.262
  155   HG22  VAL  22          HG22      VAL  22  -0.346   5.963 -11.600
  156   HG23  VAL  22          HG23      VAL  22   1.059   5.846 -10.542
  157    H    GLY  23           H        GLY  23   2.717  10.412 -12.203
  158    HA2  GLY  23           HA3      GLY  23   1.613  12.351 -10.267
  159    HA3  GLY  23           HA2      GLY  23   2.989  12.681 -11.323
  160    H    ASP  24           H        ASP  24   1.323  11.018 -13.360
  161    HA   ASP  24           HA       ASP  24   0.158  13.391 -14.570
  162    HB2  ASP  24           HB3      ASP  24   0.637  10.613 -15.673
  163    HB3  ASP  24           HB2      ASP  24  -0.077  11.935 -16.593
  164    H    LYS  25           H        LYS  25  -1.069  11.813 -12.306
  165    HA   LYS  25           HA       LYS  25  -3.490  10.724 -13.395
  166    HB2  LYS  25           HB3      LYS  25  -2.353  10.161 -11.135
  167    HB3  LYS  25           HB2      LYS  25  -3.094  11.642 -10.550
  168    HG2  LYS  25           HG3      LYS  25  -5.295  10.775 -11.037
  169    HG3  LYS  25           HG2      LYS  25  -4.589   9.310 -11.725
  170    HD2  LYS  25           HD3      LYS  25  -3.493   8.945  -9.472
  171    HD3  LYS  25           HD2      LYS  25  -4.532  10.232  -8.862
  172    HE2  LYS  25           HE3      LYS  25  -5.586   8.117  -8.392
  173    HE3  LYS  25           HE2      LYS  25  -6.507   8.935  -9.655
  174    HZ1  LYS  25           HZ1      LYS  25  -4.500   6.782 -10.102
  175    HZ2  LYS  25           HZ2      LYS  25  -5.413   7.558 -11.303
  176    HZ3  LYS  25           HZ3      LYS  25  -6.186   6.593 -10.153
  177    H    THR  26           H        THR  26  -4.990  12.012 -14.289
  178    HA   THR  26           HA       THR  26  -4.993  14.838 -13.541
  179    HB   THR  26           HB       THR  26  -4.704  14.373 -15.920
  180    HG1  THR  26           HG1      THR  26  -6.956  15.732 -14.959
  181   HG21  THR  26          HG21      THR  26  -6.570  13.431 -17.237
  182   HG22  THR  26          HG22      THR  26  -7.412  13.054 -15.736
  183   HG23  THR  26          HG23      THR  26  -5.881  12.265 -16.110
  184    H    THR  27           H        THR  27  -6.842  12.017 -13.117
  185    HA   THR  27           HA       THR  27  -8.987  13.582 -11.915
  186    HB   THR  27           HB       THR  27 -10.588  11.799 -12.983
  187    HG1  THR  27           HG1      THR  27  -8.506  10.942 -14.076
  188   HG21  THR  27          HG21      THR  27  -9.513  14.154 -14.535
  189   HG22  THR  27          HG22      THR  27 -10.797  14.199 -13.325
  190   HG23  THR  27          HG23      THR  27 -11.046  13.340 -14.845
  191    H    ALA  28           H        ALA  28  -9.851  12.680 -10.142
  192    HA   ALA  28           HA       ALA  28  -9.633   9.836  -9.660
  193    HB1  ALA  28           HB1      ALA  28  -7.479  10.735  -8.827
  194    HB2  ALA  28           HB2      ALA  28  -8.471   9.999  -7.566
  195    HB3  ALA  28           HB3      ALA  28  -8.381  11.757  -7.706
  196    H    THR  29           H        THR  29 -10.990   9.152  -7.916
  197    HA   THR  29           HA       THR  29 -13.199  11.010  -7.503
  198    HB   THR  29           HB       THR  29 -13.180   8.125  -6.663
  199    HG1  THR  29           HG1      THR  29 -13.626   9.204  -9.279
  200   HG21  THR  29          HG21      THR  29 -15.367   9.983  -7.600
  201   HG22  THR  29          HG22      THR  29 -15.046   9.525  -5.927
  202   HG23  THR  29          HG23      THR  29 -15.582   8.309  -7.086
  203    H    ASP  30           H        ASP  30 -13.314  12.127  -5.693
  204    HA   ASP  30           HA       ASP  30 -11.773  11.605  -3.365
  205    HB2  ASP  30           HB3      ASP  30 -12.510  13.871  -3.839
  206    HB3  ASP  30           HB2      ASP  30 -14.200  13.365  -3.827
  207    H    ILE  31           H        ILE  31 -12.722  11.185  -1.212
  208    HA   ILE  31           HA       ILE  31 -13.985   8.693  -1.172
  209    HB   ILE  31           HB       ILE  31 -12.506   9.493   0.615
  210   HG12  ILE  31          HG13      ILE  31 -15.281   8.880   1.659
  211   HG13  ILE  31          HG12      ILE  31 -14.137   7.677   1.071
  212   HG21  ILE  31          HG21      ILE  31 -14.776  11.331   1.364
  213   HG22  ILE  31          HG22      ILE  31 -13.222  11.818   0.691
  214   HG23  ILE  31          HG23      ILE  31 -13.295  11.084   2.291
  215   HD11  ILE  31          HD11      ILE  31 -14.133   7.748   3.481
  216   HD12  ILE  31          HD12      ILE  31 -13.765   9.472   3.453
  217   HD13  ILE  31          HD13      ILE  31 -12.582   8.308   2.857
  218    H    LYS  32           H        LYS  32 -15.321  11.899  -1.181
  219    HA   LYS  32           HA       LYS  32 -17.923  11.070  -0.234
  220    HB2  LYS  32           HB3      LYS  32 -17.005  13.652  -1.504
  221    HB3  LYS  32           HB2      LYS  32 -18.573  13.391  -0.748
  222    HG2  LYS  32           HG3      LYS  32 -17.516  13.051   1.401
  223    HG3  LYS  32           HG2      LYS  32 -15.921  13.186   0.661
  224    HD2  LYS  32           HD3      LYS  32 -16.450  15.475  -0.013
  225    HD3  LYS  32           HD2      LYS  32 -18.014  15.349   0.785
  226    HE2  LYS  32           HE3      LYS  32 -15.331  15.071   2.122
  227    HE3  LYS  32           HE2      LYS  32 -16.340  16.515   2.163
  228    HZ1  LYS  32           HZ1      LYS  32 -18.061  15.206   3.272
  229    HZ2  LYS  32           HZ2      LYS  32 -16.625  15.229   4.166
  230    HZ3  LYS  32           HZ3      LYS  32 -17.047  13.853   3.277
  231    H    GLY  33           H        GLY  33 -16.307  10.623  -3.062
  232    HA2  GLY  33           HA3      GLY  33 -17.207   9.526  -4.935
  233    HA3  GLY  33           HA2      GLY  33 -18.808  10.088  -4.469
  234    H    LYS  34           H        LYS  34 -16.157  12.305  -4.565
  235    HA   LYS  34           HA       LYS  34 -17.438  13.673  -6.812
  236    HB2  LYS  34           HB3      LYS  34 -15.296  14.666  -4.928
  237    HB3  LYS  34           HB2      LYS  34 -16.170  15.633  -6.106
  238    HG2  LYS  34           HG3      LYS  34 -17.395  14.273  -3.718
  239    HG3  LYS  34           HG2      LYS  34 -16.969  15.976  -3.821
  240    HD2  LYS  34           HD3      LYS  34 -18.522  16.199  -5.736
  241    HD3  LYS  34           HD2      LYS  34 -19.012  14.522  -5.491
  242    HE2  LYS  34           HE3      LYS  34 -19.842  15.044  -3.286
  243    HE3  LYS  34           HE2      LYS  34 -19.229  16.688  -3.412
  244    HZ1  LYS  34           HZ1      LYS  34 -21.359  15.503  -5.107
  245    HZ2  LYS  34           HZ2      LYS  34 -20.773  17.084  -5.229
  246    HZ3  LYS  34           HZ3      LYS  34 -21.600  16.595  -3.839
  247    H    GLU  35           H        GLU  35 -16.588  13.376  -8.778
  248    HA   GLU  35           HA       GLU  35 -13.911  12.356  -9.114
  249    HB2  GLU  35           HB3      GLU  35 -15.873  11.792 -10.612
  250    HB3  GLU  35           HB2      GLU  35 -15.771  13.431 -11.238
  251    HG2  GLU  35           HG3      GLU  35 -14.660  11.970 -12.756
  252    HG3  GLU  35           HG2      GLU  35 -13.445  12.957 -11.952
  253    H    VAL  36           H        VAL  36 -12.196  13.638  -8.977
  254    HA   VAL  36           HA       VAL  36 -12.557  16.485  -9.631
  255    HB   VAL  36           HB       VAL  36 -10.934  17.012  -7.831
  256   HG11  VAL  36          HG11      VAL  36 -13.316  17.208  -7.402
  257   HG12  VAL  36          HG12      VAL  36 -12.472  16.652  -5.959
  258   HG13  VAL  36          HG13      VAL  36 -13.387  15.507  -6.941
  259   HG21  VAL  36          HG21      VAL  36 -11.279  14.115  -7.079
  260   HG22  VAL  36          HG22      VAL  36 -10.420  15.336  -6.141
  261   HG23  VAL  36          HG23      VAL  36  -9.806  14.846  -7.720
  262    H    THR  37           H        THR  37 -10.663  17.633 -10.245
  263    HA   THR  37           HA       THR  37  -8.946  16.042 -11.942
  264    HB   THR  37           HB       THR  37  -9.036  19.036 -11.574
  265    HG1  THR  37           HG1      THR  37 -10.883  17.502 -12.586
  266   HG21  THR  37          HG21      THR  37  -7.933  19.103 -13.756
  267   HG22  THR  37          HG22      THR  37  -7.887  17.341 -13.792
  268   HG23  THR  37          HG23      THR  37  -6.957  18.224 -12.581
  269    H    VAL  38           H        VAL  38  -7.056  15.341 -11.296
  270    HA   VAL  38           HA       VAL  38  -5.981  16.281  -8.769
  271    HB   VAL  38           HB       VAL  38  -5.048  13.989 -10.504
  272   HG11  VAL  38          HG11      VAL  38  -3.334  14.758  -8.979
  273   HG12  VAL  38          HG12      VAL  38  -3.970  13.199  -8.446
  274   HG13  VAL  38          HG13      VAL  38  -4.471  14.681  -7.631
  275   HG21  VAL  38          HG21      VAL  38  -7.354  13.664  -9.778
  276   HG22  VAL  38          HG22      VAL  38  -6.875  13.961  -8.107
  277   HG23  VAL  38          HG23      VAL  38  -6.266  12.543  -8.962
  278    H    LEU  39           H        LEU  39  -4.051  17.274  -8.518
  279    HA   LEU  39           HA       LEU  39  -2.770  18.295 -10.948
  280    HB2  LEU  39           HB3      LEU  39  -2.412  19.200  -8.083
  281    HB3  LEU  39           HB2      LEU  39  -1.878  20.042  -9.527
  282    HG   LEU  39           HG       LEU  39  -4.765  19.582  -8.779
  283   HD11  LEU  39          HD11      LEU  39  -3.065  22.059  -8.551
  284   HD12  LEU  39          HD12      LEU  39  -3.687  21.093  -7.213
  285   HD13  LEU  39          HD13      LEU  39  -4.803  21.970  -8.258
  286   HD21  LEU  39          HD21      LEU  39  -3.515  21.262 -10.946
  287   HD22  LEU  39          HD22      LEU  39  -5.233  21.200 -10.549
  288   HD23  LEU  39          HD23      LEU  39  -4.421  19.767 -11.180
  289    H    ALA  40           H        ALA  40  -0.654  17.860 -11.395
  290    HA   ALA  40           HA       ALA  40   0.589  15.613 -10.178
  291    HB1  ALA  40           HB1      ALA  40   1.757  17.672 -12.054
  292    HB2  ALA  40           HB2      ALA  40   0.929  16.191 -12.536
  293    HB3  ALA  40           HB3      ALA  40   2.463  16.101 -11.671
  294    H    GLU  41           H        GLU  41   0.749  19.025  -9.749
  295    HA   GLU  41           HA       GLU  41   2.687  18.680  -7.567
  296    HB2  GLU  41           HB3      GLU  41   2.536  21.019  -9.484
  297    HB3  GLU  41           HB2      GLU  41   3.670  20.845  -8.152
  298    HG2  GLU  41           HG3      GLU  41   4.786  19.051  -9.223
  299    HG3  GLU  41           HG2      GLU  41   3.529  18.918 -10.450
  300    H    VAL  42           H        VAL  42   2.193  19.820  -5.704
  301    HA   VAL  42           HA       VAL  42  -0.530  20.828  -5.638
  302    HB   VAL  42           HB       VAL  42  -0.340  20.802  -3.193
  303   HG11  VAL  42          HG11      VAL  42  -1.044  18.781  -4.358
  304   HG12  VAL  42          HG12      VAL  42  -0.153  18.396  -2.887
  305   HG13  VAL  42          HG13      VAL  42   0.633  18.248  -4.458
  306   HG21  VAL  42          HG21      VAL  42   2.463  19.787  -3.630
  307   HG22  VAL  42          HG22      VAL  42   1.624  19.880  -2.082
  308   HG23  VAL  42          HG23      VAL  42   2.022  21.358  -2.961
  309    H    ASN  43           H        ASN  43  -0.896  22.850  -5.990
  310    HA   ASN  43           HA       ASN  43   1.106  24.869  -5.256
  311    HB2  ASN  43           HB3      ASN  43  -1.289  24.983  -7.112
  312    HB3  ASN  43           HB2      ASN  43  -0.338  26.396  -6.670
  313   HD21  ASN  43          HD21      ASN  43  -0.391  23.425  -8.480
  314   HD22  ASN  43          HD22      ASN  43   1.017  23.748  -9.424
  315    H    ILE  44           H        ILE  44   0.762  25.283  -3.132
  316    HA   ILE  44           HA       ILE  44  -1.934  25.525  -2.096
  317    HB   ILE  44           HB       ILE  44   0.686  26.101  -0.691
  318   HG12  ILE  44          HG13      ILE  44  -1.026  23.605  -0.592
  319   HG13  ILE  44          HG12      ILE  44   0.474  23.749  -1.502
  320   HG21  ILE  44          HG21      ILE  44  -0.611  25.883   1.364
  321   HG22  ILE  44          HG22      ILE  44  -2.076  25.609   0.422
  322   HG23  ILE  44          HG23      ILE  44  -1.263  27.171   0.349
  323   HD11  ILE  44          HD11      ILE  44   0.852  22.595   0.587
  324   HD12  ILE  44          HD12      ILE  44   0.179  23.953   1.487
  325   HD13  ILE  44          HD13      ILE  44   1.687  24.149   0.594
  326    H    ASN  45           H        ASN  45   0.711  27.763  -1.384
  327    HA   ASN  45           HA       ASN  45  -0.883  29.929  -2.587
  328    HB2  ASN  45           HB3      ASN  45   0.781  30.042  -0.057
  329    HB3  ASN  45           HB2      ASN  45   0.101  31.453  -0.854
  330   HD21  ASN  45          HD21      ASN  45  -2.407  30.127  -1.549
  331   HD22  ASN  45          HD22      ASN  45  -3.290  29.981  -0.072
  332    H    ASN  46           H        ASN  46   2.374  29.521  -1.230
  333    HA   ASN  46           HA       ASN  46   3.482  30.303  -3.841
  334    HB2  ASN  46           HB3      ASN  46   4.322  31.321  -1.116
  335    HB3  ASN  46           HB2      ASN  46   5.286  31.535  -2.571
  336   HD21  ASN  46          HD21      ASN  46   3.018  31.991  -4.316
  337   HD22  ASN  46          HD22      ASN  46   2.405  33.559  -3.927
  338    H    SER  47           H        SER  47   3.088  27.693  -2.765
  339    HA   SER  47           HA       SER  47   5.859  26.777  -2.651
  340    HB2  SER  47           HB3      SER  47   3.704  25.798  -0.752
  341    HB3  SER  47           HB2      SER  47   5.382  25.256  -0.800
  342    HG   SER  47           HG       SER  47   5.983  27.427  -0.266
  343    H    VAL  48           H        VAL  48   6.154  25.233  -4.117
  344    HA   VAL  48           HA       VAL  48   3.811  23.690  -5.024
  345    HB   VAL  48           HB       VAL  48   6.248  24.412  -6.660
  346   HG11  VAL  48          HG11      VAL  48   4.935  23.597  -8.555
  347   HG12  VAL  48          HG12      VAL  48   3.635  23.139  -7.455
  348   HG13  VAL  48          HG13      VAL  48   5.199  22.333  -7.355
  349   HG21  VAL  48          HG21      VAL  48   3.479  25.599  -6.736
  350   HG22  VAL  48          HG22      VAL  48   4.784  25.959  -7.865
  351   HG23  VAL  48          HG23      VAL  48   4.941  26.403  -6.165
  352    H    PHE  49           H        PHE  49   3.925  21.614  -4.469
  353    HA   PHE  49           HA       PHE  49   6.589  20.355  -4.323
  354    HB2  PHE  49           HB3      PHE  49   4.162  19.687  -2.634
  355    HB3  PHE  49           HB2      PHE  49   5.710  18.852  -2.574
  356    HD1  PHE  49           HD1      PHE  49   3.788  21.670  -1.433
  357    HD2  PHE  49           HD2      PHE  49   7.723  20.079  -1.754
  358    HE1  PHE  49           HE1      PHE  49   4.561  23.245   0.293
  359    HE2  PHE  49           HE2      PHE  49   8.502  21.653  -0.033
  360    HZ   PHE  49           HZ       PHE  49   6.921  23.237   0.992
  361    H    ARG  50           H        ARG  50   6.888  18.505  -5.431
  362    HA   ARG  50           HA       ARG  50   4.787  17.553  -7.185
  363    HB2  ARG  50           HB3      ARG  50   7.552  16.406  -6.714
  364    HB3  ARG  50           HB2      ARG  50   6.477  16.013  -8.044
  365    HG2  ARG  50           HG3      ARG  50   6.655  18.365  -8.806
  366    HG3  ARG  50           HG2      ARG  50   7.845  18.644  -7.535
  367    HD2  ARG  50           HD3      ARG  50   8.073  16.660  -9.793
  368    HD3  ARG  50           HD2      ARG  50   8.937  18.191  -9.666
  369    HE   ARG  50           HE       ARG  50   9.683  16.940  -7.411
  370   HH11  ARG  50          HH11      ARG  50   9.590  15.894 -10.747
  371   HH12  ARG  50          HH12      ARG  50  10.902  14.776 -10.569
  372   HH21  ARG  50          HH21      ARG  50  11.422  15.481  -7.170
  373   HH22  ARG  50          HH22      ARG  50  11.962  14.552  -8.532
  374    H    GLN  51           H        GLN  51   3.229  16.306  -6.303
  375    HA   GLN  51           HA       GLN  51   3.806  14.982  -3.808
  376    HB2  GLN  51           HB3      GLN  51   1.388  14.549  -3.690
  377    HB3  GLN  51           HB2      GLN  51   1.762  16.243  -3.936
  378    HG2  GLN  51           HG3      GLN  51   1.132  16.056  -6.277
  379    HG3  GLN  51           HG2      GLN  51   0.819  14.330  -6.064
  380   HE21  GLN  51          HE21      GLN  51  -1.033  16.415  -6.905
  381   HE22  GLN  51          HE22      GLN  51  -2.321  16.413  -5.744
  382    H    TYR  52           H        TYR  52   2.472  13.878  -6.943
  383    HA   TYR  52           HA       TYR  52   2.418  11.842  -7.942
  384    HB2  TYR  52           HB3      TYR  52   4.735  11.277  -6.080
  385    HB3  TYR  52           HB2      TYR  52   4.191  10.165  -7.329
  386    HD1  TYR  52           HD1      TYR  52   6.241  13.010  -6.590
  387    HD2  TYR  52           HD2      TYR  52   4.264  10.956  -9.747
  388    HE1  TYR  52           HE1      TYR  52   7.702  14.117  -8.220
  389    HE2  TYR  52           HE2      TYR  52   5.720  12.067 -11.387
  390    HH   TYR  52           HH       TYR  52   7.086  14.139 -11.536
  391    H    PHE  53           H        PHE  53   1.811   9.583  -7.655
  392    HA   PHE  53           HA       PHE  53   0.822   8.930  -4.959
  393    HB2  PHE  53           HB3      PHE  53  -0.731   8.486  -7.521
  394    HB3  PHE  53           HB2      PHE  53  -1.278   8.125  -5.882
  395    HD1  PHE  53           HD1      PHE  53  -1.575  10.034  -4.277
  396    HD2  PHE  53           HD2      PHE  53  -1.040  10.592  -8.454
  397    HE1  PHE  53           HE1      PHE  53  -2.476  12.308  -4.082
  398    HE2  PHE  53           HE2      PHE  53  -1.939  12.871  -8.271
  399    HZ   PHE  53           HZ       PHE  53  -2.656  13.731  -6.082
  400    H    PHE  54           H        PHE  54   1.294   6.914  -4.328
  401    HA   PHE  54           HA       PHE  54   2.652   5.161  -6.179
  402    HB2  PHE  54           HB3      PHE  54   2.910   3.693  -4.121
  403    HB3  PHE  54           HB2      PHE  54   3.668   5.277  -4.029
  404    HD1  PHE  54           HD1      PHE  54   1.337   3.008  -2.521
  405    HD2  PHE  54           HD2      PHE  54   2.481   7.101  -2.746
  406    HE1  PHE  54           HE1      PHE  54   0.146   3.454  -0.416
  407    HE2  PHE  54           HE2      PHE  54   1.291   7.554  -0.646
  408    HZ   PHE  54           HZ       PHE  54   0.122   5.730   0.523
  409    H    GLU  55           H        GLU  55   1.189   4.371  -7.600
  410    HA   GLU  55           HA       GLU  55  -1.189   3.053  -6.499
  411    HB2  GLU  55           HB3      GLU  55  -0.583   3.785  -9.376
  412    HB3  GLU  55           HB2      GLU  55  -2.079   3.064  -8.792
  413    HG2  GLU  55           HG3      GLU  55  -2.167   5.168  -7.249
  414    HG3  GLU  55           HG2      GLU  55  -1.049   5.848  -8.434
  415    H    THR  56           H        THR  56  -0.976   1.028  -6.083
  416    HA   THR  56           HA       THR  56   0.917  -0.613  -7.602
  417    HB   THR  56           HB       THR  56  -0.530  -1.339  -5.049
  418    HG1  THR  56           HG1      THR  56   0.842  -0.063  -4.081
  419   HG21  THR  56          HG21      THR  56   1.264  -3.004  -4.826
  420   HG22  THR  56          HG22      THR  56   1.936  -2.485  -6.373
  421   HG23  THR  56          HG23      THR  56   0.345  -3.242  -6.311
  422    H    LYS  57           H        LYS  57  -0.002  -1.475  -9.330
  423    HA   LYS  57           HA       LYS  57  -2.816  -2.320  -9.191
  424    HB2  LYS  57           HB3      LYS  57  -1.037  -1.781 -11.584
  425    HB3  LYS  57           HB2      LYS  57  -2.729  -2.257 -11.666
  426    HG2  LYS  57           HG3      LYS  57  -3.359  -0.189 -10.511
  427    HG3  LYS  57           HG2      LYS  57  -1.664   0.292 -10.461
  428    HD2  LYS  57           HD3      LYS  57  -2.699   1.413 -12.301
  429    HD3  LYS  57           HD2      LYS  57  -1.637   0.167 -12.953
  430    HE2  LYS  57           HE3      LYS  57  -3.580  -1.310 -13.227
  431    HE3  LYS  57           HE2      LYS  57  -4.623  -0.027 -12.623
  432    HZ1  LYS  57           HZ1      LYS  57  -2.982   0.072 -15.093
  433    HZ2  LYS  57           HZ2      LYS  57  -3.913   1.349 -14.498
  434    HZ3  LYS  57           HZ3      LYS  57  -4.665  -0.073 -15.013
  435    H    CYS  58           H        CYS  58  -3.359  -4.271 -10.463
  436    HA   CYS  58           HA       CYS  58  -1.469  -6.395  -9.873
  437    HB2  CYS  58           HB3      CYS  58  -4.268  -6.531 -11.027
  438    HB3  CYS  58           HB2      CYS  58  -3.309  -7.911 -10.510
  439    H    ARG  59           H        ARG  59  -0.009  -7.008 -11.306
  440    HA   ARG  59           HA       ARG  59  -0.076  -6.268 -14.057
  441    HB2  ARG  59           HB3      ARG  59   1.615  -8.264 -12.545
  442    HB3  ARG  59           HB2      ARG  59   1.844  -7.900 -14.246
  443    HG2  ARG  59           HG3      ARG  59   2.341  -5.580 -13.687
  444    HG3  ARG  59           HG2      ARG  59   2.095  -5.940 -11.978
  445    HD2  ARG  59           HD3      ARG  59   4.483  -5.929 -12.640
  446    HD3  ARG  59           HD2      ARG  59   3.946  -7.471 -11.979
  447    HE   ARG  59           HE       ARG  59   3.818  -7.288 -14.856
  448   HH11  ARG  59          HH11      ARG  59   5.824  -8.134 -12.111
  449   HH12  ARG  59          HH12      ARG  59   6.833  -9.211 -13.025
  450   HH21  ARG  59          HH21      ARG  59   5.138  -8.709 -16.050
  451   HH22  ARG  59          HH22      ARG  59   6.438  -9.545 -15.262
  452    H    ALA  60           H        ALA  60  -1.051  -9.022 -12.204
  453    HA   ALA  60           HA       ALA  60  -2.528 -10.048 -14.500
  454    HB1  ALA  60           HB1      ALA  60  -0.441 -11.340 -14.486
  455    HB2  ALA  60           HB2      ALA  60  -1.814 -12.354 -14.041
  456    HB3  ALA  60           HB3      ALA  60  -0.711 -11.767 -12.797
  457    H    SER  61           H        SER  61  -4.526 -10.733 -13.904
  458    HA   SER  61           HA       SER  61  -5.330 -10.391 -11.166
  459    HB2  SER  61           HB3      SER  61  -7.575 -11.148 -12.096
  460    HB3  SER  61           HB2      SER  61  -6.899  -9.686 -12.812
  461    HG   SER  61           HG       SER  61  -7.623 -11.898 -14.043
  462    H    ASN  62           H        ASN  62  -4.328 -12.929 -13.200
  463    HA   ASN  62           HA       ASN  62  -4.431 -14.802 -10.982
  464    HB2  ASN  62           HB3      ASN  62  -5.846 -15.186 -13.597
  465    HB3  ASN  62           HB2      ASN  62  -5.120 -16.582 -12.810
  466   HD21  ASN  62          HD21      ASN  62  -5.627 -15.799 -10.129
  467   HD22  ASN  62          HD22      ASN  62  -7.331 -15.925  -9.865
  468    HA   PRO  63           HA       PRO  63  -0.292 -14.698 -12.956
  469    HB2  PRO  63           HB3      PRO  63   0.830 -16.201 -10.896
  470    HB3  PRO  63           HB2      PRO  63   0.784 -14.433 -10.964
  471    HG2  PRO  63           HG3      PRO  63  -1.015 -16.330  -9.522
  472    HG3  PRO  63           HG2      PRO  63  -0.401 -14.754  -8.999
  473    HD2  PRO  63           HD3      PRO  63  -2.921 -15.036  -9.868
  474    HD3  PRO  63           HD2      PRO  63  -1.973 -13.578 -10.271
  475    H    VAL  64           H        VAL  64  -1.985 -17.445 -11.533
  476    HA   VAL  64           HA       VAL  64  -0.950 -19.093 -13.738
  477    HB   VAL  64           HB       VAL  64  -1.304 -21.092 -12.293
  478   HG11  VAL  64          HG11      VAL  64   0.634 -19.048 -11.221
  479   HG12  VAL  64          HG12      VAL  64   0.925 -20.169 -12.553
  480   HG13  VAL  64          HG13      VAL  64   0.703 -20.783 -10.915
  481   HG21  VAL  64          HG21      VAL  64  -2.903 -20.178 -10.722
  482   HG22  VAL  64          HG22      VAL  64  -1.695 -19.045 -10.118
  483   HG23  VAL  64          HG23      VAL  64  -1.485 -20.777  -9.862
  484    H    GLU  65           H        GLU  65  -2.450 -20.679 -14.556
  485    HA   GLU  65           HA       GLU  65  -5.081 -19.558 -14.810
  486    HB2  GLU  65           HB3      GLU  65  -3.874 -22.069 -15.979
  487    HB3  GLU  65           HB2      GLU  65  -5.429 -21.388 -16.438
  488    HG2  GLU  65           HG3      GLU  65  -4.424 -19.486 -17.396
  489    HG3  GLU  65           HG2      GLU  65  -2.864 -19.849 -16.666
  490    H    SER  66           H        SER  66  -5.387 -19.887 -12.434
  491    HA   SER  66           HA       SER  66  -7.318 -21.833 -11.930
  492    HB2  SER  66           HB3      SER  66  -6.131 -23.299 -10.327
  493    HB3  SER  66           HB2      SER  66  -5.447 -23.433 -11.947
  494    HG   SER  66           HG       SER  66  -4.335 -22.439  -9.616
  495    H    GLY  67           H        GLY  67  -4.832 -19.702 -10.680
  496    HA2  GLY  67           HA3      GLY  67  -6.500 -18.039  -9.253
  497    HA3  GLY  67           HA2      GLY  67  -6.000 -19.289  -8.117
  498    H    CYS  68           H        CYS  68  -4.193 -18.915  -7.019
  499    HA   CYS  68           HA       CYS  68  -2.234 -17.036  -8.164
  500    HB2  CYS  68           HB3      CYS  68  -2.972 -17.510  -5.266
  501    HB3  CYS  68           HB2      CYS  68  -1.586 -16.544  -5.781
  502    H    ARG  69           H        ARG  69   0.027 -17.428  -7.405
  503    HA   ARG  69           HA       ARG  69   0.709 -20.127  -8.001
  504    HB2  ARG  69           HB3      ARG  69   2.385 -17.774  -7.103
  505    HB3  ARG  69           HB2      ARG  69   3.064 -19.347  -7.504
  506    HG2  ARG  69           HG3      ARG  69   2.240 -19.152  -9.776
  507    HG3  ARG  69           HG2      ARG  69   1.477 -17.611  -9.387
  508    HD2  ARG  69           HD3      ARG  69   4.438 -18.176  -9.230
  509    HD3  ARG  69           HD2      ARG  69   3.636 -17.347 -10.565
  510    HE   ARG  69           HE       ARG  69   3.741 -16.306  -7.802
  511   HH11  ARG  69          HH11      ARG  69   3.715 -15.815 -11.272
  512   HH12  ARG  69          HH12      ARG  69   3.908 -14.087 -11.158
  513   HH21  ARG  69          HH21      ARG  69   4.032 -14.047  -7.651
  514   HH22  ARG  69          HH22      ARG  69   4.131 -13.093  -9.111
  515    H    GLY  70           H        GLY  70   1.177 -21.787  -6.705
  516    HA2  GLY  70           HA3      GLY  70   1.998 -22.838  -4.767
  517    HA3  GLY  70           HA2      GLY  70   1.890 -21.305  -3.915
  518    H    ILE  71           H        ILE  71  -0.880 -20.904  -4.899
  519    HA   ILE  71           HA       ILE  71  -2.196 -22.019  -2.643
  520    HB   ILE  71           HB       ILE  71  -3.326 -20.612  -5.065
  521   HG12  ILE  71          HG13      ILE  71  -1.779 -19.230  -3.750
  522   HG13  ILE  71          HG12      ILE  71  -3.433 -18.647  -3.609
  523   HG21  ILE  71          HG21      ILE  71  -4.640 -21.254  -2.430
  524   HG22  ILE  71          HG22      ILE  71  -5.044 -21.945  -4.002
  525   HG23  ILE  71          HG23      ILE  71  -5.326 -20.232  -3.692
  526   HD11  ILE  71          HD11      ILE  71  -2.279 -18.574  -1.476
  527   HD12  ILE  71          HD12      ILE  71  -1.970 -20.306  -1.570
  528   HD13  ILE  71          HD13      ILE  71  -3.624 -19.713  -1.425
  529    H    ASP  72           H        ASP  72  -3.363 -23.825  -2.434
  530    HA   ASP  72           HA       ASP  72  -3.622 -25.746  -4.516
  531    HB2  ASP  72           HB3      ASP  72  -3.620 -26.344  -2.095
  532    HB3  ASP  72           HB2      ASP  72  -5.184 -25.554  -1.922
  533    H    SER  73           H        SER  73  -4.696 -24.988  -6.270
  534    HA   SER  73           HA       SER  73  -6.946 -23.229  -5.995
  535    HB2  SER  73           HB3      SER  73  -5.844 -24.518  -8.501
  536    HB3  SER  73           HB2      SER  73  -6.897 -23.103  -8.412
  537    HG   SER  73           HG       SER  73  -4.638 -22.835  -6.899
  538    H    LYS  74           H        LYS  74  -6.852 -26.354  -5.420
  539    HA   LYS  74           HA       LYS  74  -9.240 -27.124  -6.890
  540    HB2  LYS  74           HB3      LYS  74  -7.583 -28.636  -4.859
  541    HB3  LYS  74           HB2      LYS  74  -8.948 -29.302  -5.741
  542    HG2  LYS  74           HG3      LYS  74  -7.739 -28.928  -7.852
  543    HG3  LYS  74           HG2      LYS  74  -6.360 -28.329  -6.929
  544    HD2  LYS  74           HD3      LYS  74  -7.552 -31.082  -6.677
  545    HD3  LYS  74           HD2      LYS  74  -6.108 -30.687  -7.606
  546    HE2  LYS  74           HE3      LYS  74  -5.075 -29.840  -5.505
  547    HE3  LYS  74           HE2      LYS  74  -6.492 -30.420  -4.631
  548    HZ1  LYS  74           HZ1      LYS  74  -5.996 -32.657  -5.343
  549    HZ2  LYS  74           HZ2      LYS  74  -4.650 -32.000  -4.561
  550    HZ3  LYS  74           HZ3      LYS  74  -4.671 -32.118  -6.247
  551    H    HIS  75           H        HIS  75  -8.176 -26.419  -3.611
  552    HA   HIS  75           HA       HIS  75 -10.952 -26.570  -2.669
  553    HB2  HIS  75           HB3      HIS  75  -8.356 -26.284  -1.128
  554    HB3  HIS  75           HB2      HIS  75  -9.957 -26.381  -0.398
  555    HD1  HIS  75           HD1      HIS  75  -7.395 -28.455  -2.198
  556    HD2  HIS  75           HD2      HIS  75 -11.032 -28.942  -0.231
  557    HE1  HIS  75           HE1      HIS  75  -7.681 -30.943  -1.895
  558    HE2  HIS  75           HE2      HIS  75  -9.793 -31.187  -0.537
  559    H    TRP  76           H        TRP  76  -8.370 -24.360  -3.348
  560    HA   TRP  76           HA       TRP  76 -10.016 -22.151  -2.316
  561    HB2  TRP  76           HB3      TRP  76  -7.008 -22.369  -2.533
  562    HB3  TRP  76           HB2      TRP  76  -7.855 -20.870  -2.167
  563    HD1  TRP  76           HD1      TRP  76  -6.473 -23.946  -0.564
  564    HE1  TRP  76           HE1      TRP  76  -6.959 -23.905   1.964
  565    HE3  TRP  76           HE3      TRP  76  -9.839 -20.095  -0.440
  566    HZ2  TRP  76           HZ2      TRP  76  -8.548 -22.434   3.768
  567    HZ3  TRP  76           HZ3      TRP  76 -10.790 -19.431   1.728
  568    HH2  TRP  76           HH2      TRP  76 -10.160 -20.579   3.788
  569    H    ASN  77           H        ASN  77 -10.869 -20.940  -3.821
  570    HA   ASN  77           HA       ASN  77  -9.597 -20.686  -6.441
  571    HB2  ASN  77           HB3      ASN  77 -12.060 -20.999  -6.358
  572    HB3  ASN  77           HB2      ASN  77 -12.205 -19.522  -5.418
  573   HD21  ASN  77          HD21      ASN  77 -11.484 -20.867  -8.548
  574   HD22  ASN  77          HD22      ASN  77 -11.654 -19.391  -9.436
  575    H    SER  78           H        SER  78  -8.602 -18.814  -7.100
  576    HA   SER  78           HA       SER  78  -8.395 -16.696  -5.075
  577    HB2  SER  78           HB3      SER  78  -5.989 -17.639  -6.610
  578    HB3  SER  78           HB2      SER  78  -6.054 -16.749  -5.089
  579    HG   SER  78           HG       SER  78  -7.157 -18.793  -4.324
  580    H    TYR  79           H        TYR  79  -8.019 -14.640  -5.840
  581    HA   TYR  79           HA       TYR  79  -7.066 -14.223  -8.500
  582    HB2  TYR  79           HB3      TYR  79  -8.911 -12.811  -9.294
  583    HB3  TYR  79           HB2      TYR  79  -9.451 -14.462  -9.012
  584    HD1  TYR  79           HD1      TYR  79  -9.679 -10.980  -7.865
  585    HD2  TYR  79           HD2      TYR  79 -11.077 -14.961  -7.293
  586    HE1  TYR  79           HE1      TYR  79 -11.549 -10.126  -6.516
  587    HE2  TYR  79           HE2      TYR  79 -12.945 -14.112  -5.935
  588    HH   TYR  79           HH       TYR  79 -13.571 -12.188  -4.651
  589    H    CYS  80           H        CYS  80  -6.415 -12.060  -8.876
  590    HA   CYS  80           HA       CYS  80  -5.559 -10.826  -6.393
  591    HB2  CYS  80           HB3      CYS  80  -4.829 -10.100  -9.240
  592    HB3  CYS  80           HB2      CYS  80  -3.993  -9.590  -7.771
  593    H    THR  81           H        THR  81  -6.716  -9.307  -5.485
  594    HA   THR  81           HA       THR  81  -8.442  -7.595  -7.137
  595    HB   THR  81           HB       THR  81  -8.500  -7.904  -4.125
  596    HG1  THR  81           HG1      THR  81  -9.133  -9.729  -5.908
  597   HG21  THR  81          HG21      THR  81  -9.586  -5.890  -5.015
  598   HG22  THR  81          HG22      THR  81 -10.766  -7.012  -4.336
  599   HG23  THR  81          HG23      THR  81 -10.568  -6.892  -6.084
  600    H    THR  82           H        THR  82  -7.874  -5.513  -7.408
  601    HA   THR  82           HA       THR  82  -5.575  -4.474  -5.997
  602    HB   THR  82           HB       THR  82  -7.277  -2.930  -7.942
  603    HG1  THR  82           HG1      THR  82  -5.782  -5.196  -8.391
  604   HG21  THR  82          HG21      THR  82  -5.151  -1.842  -8.455
  605   HG22  THR  82          HG22      THR  82  -4.323  -2.899  -7.311
  606   HG23  THR  82          HG23      THR  82  -5.510  -1.729  -6.732
  607    H    THR  83           H        THR  83  -5.773  -3.474  -4.096
  608    HA   THR  83           HA       THR  83  -8.395  -2.735  -3.148
  609    HB   THR  83           HB       THR  83  -7.102  -2.141  -1.035
  610    HG1  THR  83           HG1      THR  83  -4.983  -2.445  -1.007
  611   HG21  THR  83          HG21      THR  83  -6.872  -4.953  -2.120
  612   HG22  THR  83          HG22      THR  83  -8.267  -4.273  -1.281
  613   HG23  THR  83          HG23      THR  83  -6.744  -4.498  -0.422
  614    H    HIS  84           H        HIS  84  -9.179  -0.735  -2.866
  615    HA   HIS  84           HA       HIS  84  -7.522   1.469  -3.872
  616    HB2  HIS  84           HB3      HIS  84  -9.687   2.661  -4.262
  617    HB3  HIS  84           HB2      HIS  84  -9.537   1.172  -5.188
  618    HD1  HIS  84           HD1      HIS  84 -11.348  -0.540  -4.907
  619    HD2  HIS  84           HD2      HIS  84 -11.531   2.448  -2.018
  620    HE1  HIS  84           HE1      HIS  84 -13.510  -0.914  -3.686
  621    HE2  HIS  84           HE2      HIS  84 -13.562   0.850  -1.888
  622    H    THR  85           H        THR  85  -7.104   3.221  -2.637
  623    HA   THR  85           HA       THR  85  -8.498   3.440  -0.053
  624    HB   THR  85           HB       THR  85  -6.207   2.403   0.240
  625    HG1  THR  85           HG1      THR  85  -6.313   3.347   2.130
  626   HG21  THR  85          HG21      THR  85  -4.252   3.846   0.022
  627   HG22  THR  85          HG22      THR  85  -5.263   5.144  -0.613
  628   HG23  THR  85          HG23      THR  85  -5.056   3.655  -1.537
  629    H    PHE  86           H        PHE  86  -8.165   5.678   0.898
  630    HA   PHE  86           HA       PHE  86  -8.344   7.586  -1.331
  631    HB2  PHE  86           HB3      PHE  86  -9.617   7.750   1.418
  632    HB3  PHE  86           HB2      PHE  86  -9.796   8.941   0.128
  633    HD1  PHE  86           HD1      PHE  86 -10.986   8.317  -1.964
  634    HD2  PHE  86           HD2      PHE  86 -10.933   5.790   1.460
  635    HE1  PHE  86           HE1      PHE  86 -12.919   7.084  -2.852
  636    HE2  PHE  86           HE2      PHE  86 -12.865   4.549   0.580
  637    HZ   PHE  86           HZ       PHE  86 -13.861   5.193  -1.579
  638    H    VAL  87           H        VAL  87  -6.716   8.947  -1.510
  639    HA   VAL  87           HA       VAL  87  -5.024   9.380   0.856
  640    HB   VAL  87           HB       VAL  87  -3.207   9.932  -0.757
  641   HG11  VAL  87          HG11      VAL  87  -3.325   7.731   0.232
  642   HG12  VAL  87          HG12      VAL  87  -2.788   7.609  -1.443
  643   HG13  VAL  87          HG13      VAL  87  -4.451   7.203  -1.017
  644   HG21  VAL  87          HG21      VAL  87  -5.156   8.902  -2.813
  645   HG22  VAL  87          HG22      VAL  87  -3.455   9.262  -3.096
  646   HG23  VAL  87          HG23      VAL  87  -4.570  10.562  -2.675
  647    H    LYS  88           H        LYS  88  -4.505  11.334   1.514
  648    HA   LYS  88           HA       LYS  88  -6.020  13.596   0.777
  649    HB2  LYS  88           HB3      LYS  88  -4.369  14.791   2.304
  650    HB3  LYS  88           HB2      LYS  88  -5.286  13.473   3.022
  651    HG2  LYS  88           HG3      LYS  88  -3.169  12.063   2.336
  652    HG3  LYS  88           HG2      LYS  88  -2.387  13.639   2.379
  653    HD2  LYS  88           HD3      LYS  88  -3.002  13.974   4.644
  654    HD3  LYS  88           HD2      LYS  88  -4.064  12.567   4.631
  655    HE2  LYS  88           HE3      LYS  88  -2.173  11.798   5.737
  656    HE3  LYS  88           HE2      LYS  88  -1.933  11.232   4.087
  657    HZ1  LYS  88           HZ1      LYS  88  -0.684  13.614   5.343
  658    HZ2  LYS  88           HZ2      LYS  88  -0.509  13.194   3.711
  659    HZ3  LYS  88           HZ3      LYS  88   0.091  12.173   4.916
  660    H    ALA  89           H        ALA  89  -5.820  14.422  -1.170
  661    HA   ALA  89           HA       ALA  89  -3.152  15.292  -2.064
  662    HB1  ALA  89           HB1      ALA  89  -5.311  14.247  -3.888
  663    HB2  ALA  89           HB2      ALA  89  -3.947  13.289  -3.321
  664    HB3  ALA  89           HB3      ALA  89  -3.667  14.709  -4.329
  665    H    LEU  90           H        LEU  90  -3.117  17.262  -3.223
  666    HA   LEU  90           HA       LEU  90  -5.396  18.989  -2.822
  667    HB2  LEU  90           HB3      LEU  90  -3.029  19.801  -2.629
  668    HB3  LEU  90           HB2      LEU  90  -2.848  19.534  -4.358
  669    HG   LEU  90           HG       LEU  90  -4.784  21.166  -4.671
  670   HD11  LEU  90          HD11      LEU  90  -5.094  22.783  -2.841
  671   HD12  LEU  90          HD12      LEU  90  -4.120  21.753  -1.792
  672   HD13  LEU  90          HD13      LEU  90  -5.658  21.166  -2.424
  673   HD21  LEU  90          HD21      LEU  90  -2.491  21.755  -5.187
  674   HD22  LEU  90          HD22      LEU  90  -2.188  22.148  -3.495
  675   HD23  LEU  90          HD23      LEU  90  -3.318  23.120  -4.437
  676    H    THR  91           H        THR  91  -7.075  18.812  -4.134
  677    HA   THR  91           HA       THR  91  -6.583  18.306  -6.995
  678    HB   THR  91           HB       THR  91  -8.667  16.928  -7.020
  679    HG1  THR  91           HG1      THR  91  -8.665  17.706  -4.372
  680   HG21  THR  91          HG21      THR  91  -7.683  14.925  -5.993
  681   HG22  THR  91          HG22      THR  91  -6.496  15.936  -5.169
  682   HG23  THR  91          HG23      THR  91  -6.491  15.826  -6.927
  683    H    THR  92           H        THR  92  -8.247  19.122  -8.419
  684    HA   THR  92           HA       THR  92  -9.865  21.219  -7.140
  685    HB   THR  92           HB       THR  92  -8.108  22.252  -8.469
  686    HG1  THR  92           HG1      THR  92  -9.451  23.542  -9.750
  687   HG21  THR  92          HG21      THR  92  -7.727  20.383 -10.047
  688   HG22  THR  92          HG22      THR  92  -7.899  21.940 -10.855
  689   HG23  THR  92          HG23      THR  92  -9.240  20.795 -10.855
  690    H    ASP  93           H        ASP  93 -11.971  20.965  -7.307
  691    HA   ASP  93           HA       ASP  93 -13.086  18.826  -8.849
  692    HB2  ASP  93           HB3      ASP  93 -15.211  19.449  -7.885
  693    HB3  ASP  93           HB2      ASP  93 -13.988  19.549  -6.623
  694    H    GLU  94           H        GLU  94 -12.436  22.122  -9.390
  695    HA   GLU  94           HA       GLU  94 -13.211  21.941 -12.115
  696    HB2  GLU  94           HB3      GLU  94 -15.260  22.749 -10.407
  697    HB3  GLU  94           HB2      GLU  94 -14.628  24.256 -11.056
  698    HG2  GLU  94           HG3      GLU  94 -15.593  21.909 -12.668
  699    HG3  GLU  94           HG2      GLU  94 -16.482  23.396 -12.373
  700    H    LYS  95           H        LYS  95 -13.119  24.692  -9.849
  701    HA   LYS  95           HA       LYS  95 -10.552  25.498 -11.025
  702    HB2  LYS  95           HB3      LYS  95 -12.947  27.311 -10.666
  703    HB3  LYS  95           HB2      LYS  95 -11.341  27.845 -11.134
  704    HG2  LYS  95           HG3      LYS  95 -11.497  26.482 -13.167
  705    HG3  LYS  95           HG2      LYS  95 -13.125  25.995 -12.698
  706    HD2  LYS  95           HD3      LYS  95 -13.847  28.323 -12.773
  707    HD3  LYS  95           HD2      LYS  95 -12.219  28.820 -13.240
  708    HE2  LYS  95           HE3      LYS  95 -14.026  26.984 -14.805
  709    HE3  LYS  95           HE2      LYS  95 -13.715  28.678 -15.176
  710    HZ1  LYS  95           HZ1      LYS  95 -11.380  28.128 -15.507
  711    HZ2  LYS  95           HZ2      LYS  95 -12.365  27.226 -16.542
  712    HZ3  LYS  95           HZ3      LYS  95 -11.696  26.503 -15.168
  713    H    GLN  96           H        GLN  96 -11.425  24.316  -8.439
  714    HA   GLN  96           HA       GLN  96 -10.170  26.319  -6.706
  715    HB2  GLN  96           HB3      GLN  96 -12.704  24.787  -6.152
  716    HB3  GLN  96           HB2      GLN  96 -11.717  25.434  -4.853
  717    HG2  GLN  96           HG3      GLN  96 -12.906  27.083  -7.071
  718    HG3  GLN  96           HG2      GLN  96 -13.630  26.869  -5.479
  719   HE21  GLN  96          HE21      GLN  96 -11.082  28.369  -7.296
  720   HE22  GLN  96          HE22      GLN  96 -10.540  29.429  -6.040
  721    H    ALA  97           H        ALA  97  -8.266  25.397  -6.313
  722    HA   ALA  97           HA       ALA  97  -7.921  22.565  -6.045
  723    HB1  ALA  97           HB1      ALA  97  -5.607  23.094  -5.480
  724    HB2  ALA  97           HB2      ALA  97  -6.019  24.804  -5.359
  725    HB3  ALA  97           HB3      ALA  97  -6.125  23.980  -6.915
  726    H    ALA  98           H        ALA  98  -8.382  21.414  -4.308
  727    HA   ALA  98           HA       ALA  98  -8.047  22.598  -1.653
  728    HB1  ALA  98           HB1      ALA  98 -10.558  21.197  -2.569
  729    HB2  ALA  98           HB2      ALA  98 -10.399  22.924  -2.243
  730    HB3  ALA  98           HB3      ALA  98 -10.228  21.758  -0.929
  731    H    TRP  99           H        TRP  99  -7.737  21.070   0.007
  732    HA   TRP  99           HA       TRP  99  -6.461  18.653  -0.874
  733    HB2  TRP  99           HB3      TRP  99  -6.976  19.757   1.898
  734    HB3  TRP  99           HB2      TRP  99  -6.043  18.302   1.569
  735    HD1  TRP  99           HD1      TRP  99  -5.819  22.088   1.448
  736    HE1  TRP  99           HE1      TRP  99  -3.390  22.773   0.938
  737    HE3  TRP  99           HE3      TRP  99  -3.900  17.487   0.322
  738    HZ2  TRP  99           HZ2      TRP  99  -0.981  21.524   0.162
  739    HZ3  TRP  99           HZ3      TRP  99  -1.521  17.319  -0.295
  740    HH2  TRP  99           HH2      TRP  99  -0.094  19.298  -0.372
  741    H    ARG 100           H        ARG 100  -7.585  16.942  -1.409
  742    HA   ARG 100           HA       ARG 100  -9.930  16.210   0.212
  743    HB2  ARG 100           HB3      ARG 100  -9.588  15.920  -2.785
  744    HB3  ARG 100           HB2      ARG 100 -10.944  15.280  -1.866
  745    HG2  ARG 100           HG3      ARG 100 -10.221  18.186  -2.198
  746    HG3  ARG 100           HG2      ARG 100 -11.566  17.338  -2.965
  747    HD2  ARG 100           HD3      ARG 100 -12.574  16.924  -0.795
  748    HD3  ARG 100           HD2      ARG 100 -11.205  17.683   0.009
  749    HE   ARG 100           HE       ARG 100 -13.116  19.107  -1.724
  750   HH11  ARG 100          HH11      ARG 100 -10.859  19.059   0.963
  751   HH12  ARG 100          HH12      ARG 100 -11.299  20.644   1.515
  752   HH21  ARG 100          HH21      ARG 100 -13.673  21.198  -0.997
  753   HH22  ARG 100          HH22      ARG 100 -12.882  21.861   0.398
  754    H    PHE 101           H        PHE 101 -10.509  13.785  -0.465
  755    HA   PHE 101           HA       PHE 101  -7.974  12.285  -0.271
  756    HB2  PHE 101           HB3      PHE 101 -10.625  11.746   1.102
  757    HB3  PHE 101           HB2      PHE 101  -9.318  10.574   1.031
  758    HD1  PHE 101           HD1      PHE 101 -10.256  13.914   2.332
  759    HD2  PHE 101           HD2      PHE 101  -7.492  10.678   2.490
  760    HE1  PHE 101           HE1      PHE 101  -9.250  14.876   4.357
  761    HE2  PHE 101           HE2      PHE 101  -6.484  11.638   4.517
  762    HZ   PHE 101           HZ       PHE 101  -7.362  13.739   5.452
  763    H    ILE 102           H        ILE 102  -7.644  11.237  -2.121
  764    HA   ILE 102           HA       ILE 102 -10.024  10.508  -3.701
  765    HB   ILE 102           HB       ILE 102  -8.522  10.649  -5.694
  766   HG12  ILE 102          HG13      ILE 102  -6.612  12.019  -3.794
  767   HG13  ILE 102          HG12      ILE 102  -6.387  10.390  -4.414
  768   HG21  ILE 102          HG21      ILE 102  -8.800  13.177  -4.081
  769   HG22  ILE 102          HG22      ILE 102 -10.042  12.459  -5.109
  770   HG23  ILE 102          HG23      ILE 102  -8.556  13.080  -5.826
  771   HD11  ILE 102          HD11      ILE 102  -6.284  11.283  -6.691
  772   HD12  ILE 102          HD12      ILE 102  -5.038  11.970  -5.645
  773   HD13  ILE 102          HD13      ILE 102  -6.473  12.915  -6.045
  774    H    ARG 103           H        ARG 103 -10.118   8.570  -4.749
  775    HA   ARG 103           HA       ARG 103  -8.784   6.446  -3.377
  776    HB2  ARG 103           HB3      ARG 103 -10.127   4.946  -4.803
  777    HB3  ARG 103           HB2      ARG 103 -11.110   6.175  -4.018
  778    HG2  ARG 103           HG3      ARG 103 -11.271   7.426  -6.066
  779    HG3  ARG 103           HG2      ARG 103 -10.141   6.334  -6.864
  780    HD2  ARG 103           HD3      ARG 103 -11.742   4.486  -6.555
  781    HD3  ARG 103           HD2      ARG 103 -12.877   5.614  -5.808
  782    HE   ARG 103           HE       ARG 103 -12.795   6.822  -8.022
  783   HH11  ARG 103          HH11      ARG 103 -12.210   3.371  -7.780
  784   HH12  ARG 103          HH12      ARG 103 -12.766   3.042  -9.388
  785   HH21  ARG 103          HH21      ARG 103 -13.519   6.387 -10.130
  786   HH22  ARG 103          HH22      ARG 103 -13.490   4.761 -10.735
  787    H    ILE 104           H        ILE 104  -6.876   5.720  -3.811
  788    HA   ILE 104           HA       ILE 104  -6.084   5.396  -6.631
  789    HB   ILE 104           HB       ILE 104  -3.739   5.524  -5.968
  790   HG12  ILE 104          HG13      ILE 104  -4.656   6.308  -3.203
  791   HG13  ILE 104          HG12      ILE 104  -4.168   4.670  -3.617
  792   HG21  ILE 104          HG21      ILE 104  -5.327   7.887  -4.985
  793   HG22  ILE 104          HG22      ILE 104  -4.791   7.593  -6.640
  794   HG23  ILE 104          HG23      ILE 104  -3.606   7.903  -5.373
  795   HD11  ILE 104          HD11      ILE 104  -2.440   7.123  -3.823
  796   HD12  ILE 104          HD12      ILE 104  -1.949   5.472  -4.206
  797   HD13  ILE 104          HD13      ILE 104  -2.369   5.907  -2.550
  798    H    ASP 105           H        ASP 105  -4.732   3.494  -7.007
  799    HA   ASP 105           HA       ASP 105  -5.656   1.221  -5.478
  800    HB2  ASP 105           HB3      ASP 105  -3.762   1.409  -7.844
  801    HB3  ASP 105           HB2      ASP 105  -4.331  -0.102  -7.130
  802    H    THR 106           H        THR 106  -4.657   0.607  -3.661
  803    HA   THR 106           HA       THR 106  -1.978   1.688  -3.195
  804    HB   THR 106           HB       THR 106  -3.563   2.271  -1.478
  805    HG1  THR 106           HG1      THR 106  -1.285   1.073  -0.998
  806   HG21  THR 106          HG21      THR 106  -4.614   0.558  -0.042
  807   HG22  THR 106          HG22      THR 106  -4.014  -0.693  -1.132
  808   HG23  THR 106          HG23      THR 106  -5.184   0.494  -1.709
  809    H    ALA 107           H        ALA 107  -3.634  -1.388  -3.504
  810    HA   ALA 107           HA       ALA 107  -1.092  -2.745  -3.564
  811    HB1  ALA 107           HB1      ALA 107  -3.082  -3.436  -1.408
  812    HB2  ALA 107           HB2      ALA 107  -1.519  -2.656  -1.160
  813    HB3  ALA 107           HB3      ALA 107  -1.593  -4.312  -1.764
  814    H    CYS 108           H        CYS 108  -1.354  -5.072  -4.009
  815    HA   CYS 108           HA       CYS 108  -3.911  -5.719  -5.310
  816    HB2  CYS 108           HB3      CYS 108  -2.252  -5.288  -7.057
  817    HB3  CYS 108           HB2      CYS 108  -1.112  -6.380  -6.272
  818    H    VAL 109           H        VAL 109  -4.832  -7.203  -4.049
  819    HA   VAL 109           HA       VAL 109  -3.059  -8.989  -2.526
  820    HB   VAL 109           HB       VAL 109  -4.842  -9.225  -0.900
  821   HG11  VAL 109          HG11      VAL 109  -3.352  -7.330  -0.622
  822   HG12  VAL 109          HG12      VAL 109  -4.977  -6.914  -0.079
  823   HG13  VAL 109          HG13      VAL 109  -4.394  -6.337  -1.641
  824   HG21  VAL 109          HG21      VAL 109  -6.776  -9.134  -2.386
  825   HG22  VAL 109          HG22      VAL 109  -6.478  -7.422  -2.688
  826   HG23  VAL 109          HG23      VAL 109  -6.942  -7.964  -1.075
  827    H    CYS 110           H        CYS 110  -3.336 -11.179  -2.574
  828    HA   CYS 110           HA       CYS 110  -5.169 -12.245  -4.572
  829    HB2  CYS 110           HB3      CYS 110  -2.924 -13.193  -4.567
  830    HB3  CYS 110           HB2      CYS 110  -3.069 -13.609  -2.866
  831    H    VAL 111           H        VAL 111  -7.187 -12.645  -3.978
  832    HA   VAL 111           HA       VAL 111  -7.721 -13.180  -1.151
  833    HB   VAL 111           HB       VAL 111 -10.085 -12.853  -1.675
  834   HG11  VAL 111          HG11      VAL 111  -8.302 -10.679  -2.761
  835   HG12  VAL 111          HG12      VAL 111  -8.807 -10.894  -1.084
  836   HG13  VAL 111          HG13      VAL 111  -9.995 -10.472  -2.315
  837   HG21  VAL 111          HG21      VAL 111  -9.190 -12.344  -4.507
  838   HG22  VAL 111          HG22      VAL 111 -10.829 -12.172  -3.879
  839   HG23  VAL 111          HG23      VAL 111 -10.073 -13.766  -3.947
  840    H    LEU 112           H        LEU 112  -8.789 -15.005  -0.433
  841    HA   LEU 112           HA       LEU 112  -8.732 -17.263  -2.326
  842    HB2  LEU 112           HB3      LEU 112  -8.340 -17.268   0.675
  843    HB3  LEU 112           HB2      LEU 112  -8.381 -18.700  -0.335
  844    HG   LEU 112           HG       LEU 112  -6.278 -16.529  -0.412
  845   HD11  LEU 112          HD11      LEU 112  -6.081 -17.963   1.533
  846   HD12  LEU 112          HD12      LEU 112  -4.797 -18.325   0.378
  847   HD13  LEU 112          HD13      LEU 112  -6.188 -19.399   0.513
  848   HD21  LEU 112          HD21      LEU 112  -5.116 -18.023  -1.986
  849   HD22  LEU 112          HD22      LEU 112  -6.630 -17.401  -2.639
  850   HD23  LEU 112          HD23      LEU 112  -6.544 -19.056  -2.035
  851    H    SER 113           H        SER 113 -10.496 -18.496  -2.538
  852    HA   SER 113           HA       SER 113 -12.692 -18.155  -0.613
  853    HB2  SER 113           HB3      SER 113 -13.213 -16.863  -2.654
  854    HB3  SER 113           HB2      SER 113 -12.959 -18.306  -3.632
  855    HG   SER 113           HG       SER 113 -15.203 -17.577  -2.735
  856    H    ARG 114           H        ARG 114 -13.948 -20.037  -0.285
  857    HA   ARG 114           HA       ARG 114 -12.528 -22.494  -0.807
  858    HB2  ARG 114           HB3      ARG 114 -15.106 -21.915   0.650
  859    HB3  ARG 114           HB2      ARG 114 -14.470 -23.539   0.439
  860    HG2  ARG 114           HG3      ARG 114 -13.051 -21.288   1.847
  861    HG3  ARG 114           HG2      ARG 114 -13.932 -22.600   2.636
  862    HD2  ARG 114           HD3      ARG 114 -11.529 -22.931   0.839
  863    HD3  ARG 114           HD2      ARG 114 -11.504 -22.991   2.598
  864    HE   ARG 114           HE       ARG 114 -13.348 -24.873   1.514
  865   HH11  ARG 114          HH11      ARG 114  -9.943 -24.314   2.088
  866   HH12  ARG 114          HH12      ARG 114  -9.545 -25.997   2.179
  867   HH21  ARG 114          HH21      ARG 114 -12.831 -27.104   1.620
  868   HH22  ARG 114          HH22      ARG 114 -11.190 -27.587   1.918
  869    H    LYS 115           H        LYS 115 -14.228 -20.730  -2.773
  870    HA   LYS 115           HA       LYS 115 -15.590 -20.951  -4.558
  871    HB2  LYS 115           HB3      LYS 115 -14.990 -22.721  -6.135
  872    HB3  LYS 115           HB2      LYS 115 -13.561 -22.002  -5.426
  873    HG2  LYS 115           HG3      LYS 115 -13.201 -23.909  -4.037
  874    HG3  LYS 115           HG2      LYS 115 -14.751 -24.612  -4.518
  875    HD2  LYS 115           HD3      LYS 115 -12.997 -25.705  -5.740
  876    HD3  LYS 115           HD2      LYS 115 -13.909 -24.692  -6.857
  877    HE2  LYS 115           HE3      LYS 115 -12.169 -22.949  -6.609
  878    HE3  LYS 115           HE2      LYS 115 -11.239 -24.061  -5.608
  879    HZ1  LYS 115           HZ1      LYS 115 -11.330 -25.618  -7.563
  880    HZ2  LYS 115           HZ2      LYS 115 -10.374 -24.238  -7.767
  881    HZ3  LYS 115           HZ3      LYS 115 -11.907 -24.320  -8.481
  882    H    ALA 116           H        ALA 116 -16.840 -21.689  -2.197
  883    HA   ALA 116           HA       ALA 116 -18.769 -23.670  -3.190
  884    HB1  ALA 116           HB1      ALA 116 -19.122 -24.427  -0.892
  885    HB2  ALA 116           HB2      ALA 116 -17.873 -23.318  -0.330
  886    HB3  ALA 116           HB3      ALA 116 -17.447 -24.664  -1.389
  887    H    THR 117           H        THR 117 -20.530 -22.543  -3.706
  888    HA   THR 117           HA       THR 117 -21.160 -20.073  -2.348
  889    HB   THR 117           HB       THR 117 -23.155 -20.078  -3.911
  890    HG1  THR 117           HG1      THR 117 -23.332 -22.259  -4.393
  891   HG21  THR 117          HG21      THR 117 -20.405 -20.299  -5.144
  892   HG22  THR 117          HG22      THR 117 -21.116 -18.845  -4.442
  893   HG23  THR 117          HG23      THR 117 -21.810 -19.552  -5.902
  894    H    ARG 118           H        ARG 118 -23.140 -19.666  -1.263
  895    HA   ARG 118           HA       ARG 118 -24.480 -22.073  -0.238
  896    HB2  ARG 118           HB3      ARG 118 -23.741 -19.598   1.348
  897    HB3  ARG 118           HB2      ARG 118 -24.685 -20.944   1.961
  898    HG2  ARG 118           HG3      ARG 118 -21.797 -21.012   1.104
  899    HG3  ARG 118           HG2      ARG 118 -22.417 -21.101   2.751
  900    HD2  ARG 118           HD3      ARG 118 -22.829 -23.134   0.557
  901    HD3  ARG 118           HD2      ARG 118 -21.793 -23.313   1.972
  902    HE   ARG 118           HE       ARG 118 -23.996 -23.039   3.257
  903   HH11  ARG 118          HH11      ARG 118 -23.697 -24.600   0.131
  904   HH12  ARG 118          HH12      ARG 118 -25.067 -25.635   0.380
  905   HH21  ARG 118          HH21      ARG 118 -25.797 -24.395   3.577
  906   HH22  ARG 118          HH22      ARG 118 -26.276 -25.505   2.330
  907    H1   SER   1           H1       SER   1 -21.130 -27.743  10.844
  908    H2   SER   1           H2       SER   1 -20.030 -26.645  10.187
  909    H3   SER   1           H3       SER   1 -20.657 -27.887   9.226
  910    HA   SER   1           HA       SER   1 -22.858 -26.945   9.410
  911    HB2  SER   1           HB3      SER   1 -22.905 -24.546  10.334
  912    HB3  SER   1           HB2      SER   1 -22.808 -25.856  11.511
  913    HG   SER   1           HG       SER   1 -21.301 -24.020  11.777
  914    H    SER   2           H        SER   2 -23.451 -25.966   7.544
  915    HA   SER   2           HA       SER   2 -21.288 -24.823   5.939
  916    HB2  SER   2           HB3      SER   2 -23.005 -25.122   4.064
  917    HB3  SER   2           HB2      SER   2 -22.385 -26.597   4.811
  918    HG   SER   2           HG       SER   2 -24.549 -26.867   4.771
  919    H    THR   3           H        THR   3 -22.900 -23.445   8.104
  920    HA   THR   3           HA       THR   3 -24.442 -21.456   6.690
  921    HB   THR   3           HB       THR   3 -24.451 -20.439   9.109
  922    HG1  THR   3           HG1      THR   3 -24.032 -21.980  10.702
  923   HG21  THR   3          HG21      THR   3 -26.404 -21.406   8.030
  924   HG22  THR   3          HG22      THR   3 -26.314 -21.933   9.710
  925   HG23  THR   3          HG23      THR   3 -25.836 -23.031   8.415
  926    H    HIS   4           H        HIS   4 -21.851 -21.432   5.760
  927    HA   HIS   4           HA       HIS   4 -21.117 -18.710   6.425
  928    HB2  HIS   4           HB3      HIS   4 -18.721 -19.215   6.699
  929    HB3  HIS   4           HB2      HIS   4 -19.685 -19.987   7.946
  930    HD1  HIS   4           HD1      HIS   4 -19.814 -22.594   7.895
  931    HD2  HIS   4           HD2      HIS   4 -17.301 -20.932   5.032
  932    HE1  HIS   4           HE1      HIS   4 -18.420 -24.495   7.033
  933    HE2  HIS   4           HE2      HIS   4 -17.047 -23.499   5.173
  934    HA   PRO   5           HA       PRO   5 -20.769 -19.156   1.956
  935    HB2  PRO   5           HB3      PRO   5 -21.309 -16.609   1.337
  936    HB3  PRO   5           HB2      PRO   5 -22.588 -17.704   1.881
  937    HG2  PRO   5           HG3      PRO   5 -21.120 -15.590   3.406
  938    HG3  PRO   5           HG2      PRO   5 -22.840 -16.009   3.456
  939    HD2  PRO   5           HD3      PRO   5 -20.958 -16.838   5.309
  940    HD3  PRO   5           HD2      PRO   5 -22.504 -17.655   5.007
  941    H    VAL   6           H        VAL   6 -18.453 -18.997   3.587
  942    HA   VAL   6           HA       VAL   6 -16.271 -18.344   3.631
  943    HB   VAL   6           HB       VAL   6 -16.650 -17.492   0.763
  944   HG11  VAL   6          HG11      VAL   6 -14.293 -18.660   2.235
  945   HG12  VAL   6          HG12      VAL   6 -14.473 -16.989   1.698
  946   HG13  VAL   6          HG13      VAL   6 -14.339 -18.286   0.513
  947   HG21  VAL   6          HG21      VAL   6 -17.696 -19.664   0.991
  948   HG22  VAL   6          HG22      VAL   6 -16.266 -20.293   1.809
  949   HG23  VAL   6          HG23      VAL   6 -16.173 -19.817   0.113
  950    H    PHE   7           H        PHE   7 -17.859 -16.553   4.776
  951    HA   PHE   7           HA       PHE   7 -18.102 -14.418   5.481
  952    HB2  PHE   7           HB3      PHE   7 -15.608 -14.408   5.428
  953    HB3  PHE   7           HB2      PHE   7 -15.673 -13.801   3.780
  954    HD1  PHE   7           HD1      PHE   7 -16.355 -11.510   3.327
  955    HD2  PHE   7           HD2      PHE   7 -16.120 -12.998   7.304
  956    HE1  PHE   7           HE1      PHE   7 -16.420  -9.208   4.186
  957    HE2  PHE   7           HE2      PHE   7 -16.191 -10.698   8.175
  958    HZ   PHE   7           HZ       PHE   7 -16.341  -8.798   6.616
  959    H    HIS   8           H        HIS   8 -16.878 -13.939   2.193
  960    HA   HIS   8           HA       HIS   8 -19.481 -13.036   1.266
  961    HB2  HIS   8           HB3      HIS   8 -18.254 -11.032   2.259
  962    HB3  HIS   8           HB2      HIS   8 -17.055 -11.241   0.992
  963    HD1  HIS   8           HD1      HIS   8 -20.588 -10.130   1.563
  964    HD2  HIS   8           HD2      HIS   8 -17.816 -10.304  -1.531
  965    HE1  HIS   8           HE1      HIS   8 -21.542  -8.715  -0.279
  966    HE2  HIS   8           HE2      HIS   8 -19.869  -8.861  -2.156
  967    H    MET   9           H        MET   9 -18.424 -15.319   0.600
  968    HA   MET   9           HA       MET   9 -17.379 -16.680  -0.868
  969    HB2  MET   9           HB3      MET   9 -17.996 -16.381  -3.199
  970    HB3  MET   9           HB2      MET   9 -19.361 -16.042  -2.151
  971    HG2  MET   9           HG3      MET   9 -18.919 -13.622  -2.441
  972    HG3  MET   9           HG2      MET   9 -17.640 -14.030  -3.579
  973    HE1  MET   9           HE1      MET   9 -21.059 -15.934  -3.158
  974    HE2  MET   9           HE2      MET   9 -22.084 -15.057  -4.292
  975    HE3  MET   9           HE3      MET   9 -21.494 -14.257  -2.837
  976    H    GLY  10           H        GLY  10 -15.591 -15.027   0.314
  977    HA2  GLY  10           HA3      GLY  10 -13.223 -15.231  -0.894
  978    HA3  GLY  10           HA2      GLY  10 -13.885 -13.821  -1.714
  979    H    GLU  11           H        GLU  11 -12.714 -12.178  -0.899
  980    HA   GLU  11           HA       GLU  11 -12.151 -10.501   0.513
  981    HB2  GLU  11           HB3      GLU  11 -14.459 -10.754   1.394
  982    HB3  GLU  11           HB2      GLU  11 -13.853 -11.899   2.589
  983    HG2  GLU  11           HG3      GLU  11 -14.140  -9.721   3.585
  984    HG3  GLU  11           HG2      GLU  11 -12.426 -10.134   3.528
  985    H    PHE  12           H        PHE  12 -12.066 -13.684   2.105
  986    HA   PHE  12           HA       PHE  12  -9.907 -13.157   3.826
  987    HB2  PHE  12           HB3      PHE  12 -10.753 -15.751   2.509
  988    HB3  PHE  12           HB2      PHE  12  -9.532 -15.640   3.775
  989    HD1  PHE  12           HD1      PHE  12 -12.761 -16.559   3.244
  990    HD2  PHE  12           HD2      PHE  12 -10.486 -14.059   5.826
  991    HE1  PHE  12           HE1      PHE  12 -14.516 -16.734   4.956
  992    HE2  PHE  12           HE2      PHE  12 -12.236 -14.233   7.544
  993    HZ   PHE  12           HZ       PHE  12 -14.254 -15.572   7.111
  994    H    SER  13           H        SER  13  -7.685 -13.410   3.576
  995    HA   SER  13           HA       SER  13  -6.791 -13.700   0.792
  996    HB2  SER  13           HB3      SER  13  -6.661 -11.339   1.627
  997    HB3  SER  13           HB2      SER  13  -5.543 -11.881   2.872
  998    HG   SER  13           HG       SER  13  -5.152 -12.106   0.061
  999    H    VAL  14           H        VAL  14  -4.284 -14.084   0.808
 1000    HA   VAL  14           HA       VAL  14  -3.824 -16.594   1.988
 1001    HB   VAL  14           HB       VAL  14  -1.457 -16.289   1.277
 1002   HG11  VAL  14          HG11      VAL  14  -3.512 -15.488  -0.779
 1003   HG12  VAL  14          HG12      VAL  14  -3.122 -17.137  -0.290
 1004   HG13  VAL  14          HG13      VAL  14  -1.915 -16.155  -1.121
 1005   HG21  VAL  14          HG21      VAL  14  -0.823 -14.278   0.032
 1006   HG22  VAL  14          HG22      VAL  14  -1.231 -13.896   1.705
 1007   HG23  VAL  14          HG23      VAL  14  -2.382 -13.548   0.416
 1008    H    CYS  15           H        CYS  15  -3.255 -13.374   3.086
 1009    HA   CYS  15           HA       CYS  15  -2.274 -14.407   5.646
 1010    HB2  CYS  15           HB3      CYS  15  -0.353 -13.535   4.304
 1011    HB3  CYS  15           HB2      CYS  15  -1.158 -11.966   4.232
 1012    H    ASP  16           H        ASP  16  -2.698 -12.912   7.436
 1013    HA   ASP  16           HA       ASP  16  -5.170 -11.428   6.926
 1014    HB2  ASP  16           HB3      ASP  16  -3.941 -12.388   9.524
 1015    HB3  ASP  16           HB2      ASP  16  -5.417 -11.433   9.424
 1016    H    SER  17           H        SER  17  -5.037  -9.347   6.619
 1017    HA   SER  17           HA       SER  17  -2.835  -7.853   7.866
 1018    HB2  SER  17           HB3      SER  17  -3.261  -6.210   5.971
 1019    HB3  SER  17           HB2      SER  17  -2.613  -7.780   5.482
 1020    HG   SER  17           HG       SER  17  -4.291  -7.901   4.239
 1021    H    VAL  18           H        VAL  18  -3.267  -5.844   8.801
 1022    HA   VAL  18           HA       VAL  18  -6.117  -5.215   9.175
 1023    HB   VAL  18           HB       VAL  18  -5.268  -6.128  11.247
 1024   HG11  VAL  18          HG11      VAL  18  -2.901  -5.762  10.956
 1025   HG12  VAL  18          HG12      VAL  18  -3.433  -5.059  12.485
 1026   HG13  VAL  18          HG13      VAL  18  -3.123  -4.018  11.093
 1027   HG21  VAL  18          HG21      VAL  18  -5.582  -3.136  11.385
 1028   HG22  VAL  18          HG22      VAL  18  -5.695  -4.234  12.760
 1029   HG23  VAL  18          HG23      VAL  18  -6.872  -4.337  11.450
 1030    H    SER  19           H        SER  19  -6.619  -3.319   8.287
 1031    HA   SER  19           HA       SER  19  -4.469  -1.356   7.882
 1032    HB2  SER  19           HB3      SER  19  -5.809  -2.239   5.887
 1033    HB3  SER  19           HB2      SER  19  -7.180  -1.335   6.536
 1034    HG   SER  19           HG       SER  19  -4.708  -0.361   5.557
 1035    H    VAL  20           H        VAL  20  -4.401   0.277   9.248
 1036    HA   VAL  20           HA       VAL  20  -6.916   1.139  10.533
 1037    HB   VAL  20           HB       VAL  20  -4.137   1.201  11.713
 1038   HG11  VAL  20          HG11      VAL  20  -6.794   1.935  12.918
 1039   HG12  VAL  20          HG12      VAL  20  -5.467   3.031  12.534
 1040   HG13  VAL  20          HG13      VAL  20  -5.272   1.821  13.802
 1041   HG21  VAL  20          HG21      VAL  20  -6.469  -0.588  12.366
 1042   HG22  VAL  20          HG22      VAL  20  -4.936  -0.534  13.239
 1043   HG23  VAL  20          HG23      VAL  20  -4.977  -1.069  11.559
 1044    H    TRP  21           H        TRP  21  -7.373   3.293  10.507
 1045    HA   TRP  21           HA       TRP  21  -5.517   5.036   9.091
 1046    HB2  TRP  21           HB3      TRP  21  -8.380   5.402  10.002
 1047    HB3  TRP  21           HB2      TRP  21  -7.425   6.706   9.299
 1048    HD1  TRP  21           HD1      TRP  21  -9.034   3.340   8.351
 1049    HE1  TRP  21           HE1      TRP  21  -9.259   3.230   5.789
 1050    HE3  TRP  21           HE3      TRP  21  -6.494   7.615   7.128
 1051    HZ2  TRP  21           HZ2      TRP  21  -8.474   4.753   3.556
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.279   8.213   4.749
 1053    HH2  TRP  21           HH2      TRP  21  -7.250   6.813   3.003
 1054    H    VAL  22           H        VAL  22  -3.910   5.503  10.431
 1055    HA   VAL  22           HA       VAL  22  -4.412   6.043  13.237
 1056    HB   VAL  22           HB       VAL  22  -1.795   5.991  11.724
 1057   HG11  VAL  22          HG11      VAL  22  -0.758   5.760  13.912
 1058   HG12  VAL  22          HG12      VAL  22  -2.337   5.867  14.685
 1059   HG13  VAL  22          HG13      VAL  22  -1.687   7.255  13.812
 1060   HG21  VAL  22          HG21      VAL  22  -3.124   3.830  13.355
 1061   HG22  VAL  22          HG22      VAL  22  -1.499   3.750  12.677
 1062   HG23  VAL  22          HG23      VAL  22  -2.898   3.829  11.606
 1063    H    GLY  23           H        GLY  23  -4.569   8.018  14.074
 1064    HA2  GLY  23           HA3      GLY  23  -3.443  10.272  12.530
 1065    HA3  GLY  23           HA2      GLY  23  -4.824  10.410  13.620
 1066    H    ASP  24           H        ASP  24  -3.190   8.398  15.333
 1067    HA   ASP  24           HA       ASP  24  -2.021  10.502  16.964
 1068    HB2  ASP  24           HB3      ASP  24  -2.508   7.567  17.533
 1069    HB3  ASP  24           HB2      ASP  24  -1.799   8.698  18.686
 1070    H    LYS  25           H        LYS  25  -0.784   9.363  14.454
 1071    HA   LYS  25           HA       LYS  25   1.629   8.093  15.332
 1072    HB2  LYS  25           HB3      LYS  25   0.505   7.960  13.006
 1073    HB3  LYS  25           HB2      LYS  25   1.253   9.520  12.707
 1074    HG2  LYS  25           HG3      LYS  25   3.450   8.575  13.036
 1075    HG3  LYS  25           HG2      LYS  25   2.741   7.009  13.442
 1076    HD2  LYS  25           HD3      LYS  25   1.665   7.064  11.148
 1077    HD3  LYS  25           HD2      LYS  25   2.709   8.441  10.796
 1078    HE2  LYS  25           HE3      LYS  25   3.763   6.447   9.953
 1079    HE3  LYS  25           HE2      LYS  25   4.675   7.024  11.349
 1080    HZ1  LYS  25           HZ1      LYS  25   2.674   4.820  11.384
 1081    HZ2  LYS  25           HZ2      LYS  25   3.574   5.366  12.715
 1082    HZ3  LYS  25           HZ3      LYS  25   4.359   4.628  11.414
 1083    H    THR  26           H        THR  26   3.125   9.189  16.465
 1084    HA   THR  26           HA       THR  26   3.136  12.107  16.252
 1085    HB   THR  26           HB       THR  26   2.836  11.213  18.499
 1086    HG1  THR  26           HG1      THR  26   5.078  12.730  17.814
 1087   HG21  THR  26          HG21      THR  26   4.684  10.031  19.632
 1088   HG22  THR  26          HG22      THR  26   5.539   9.937  18.093
 1089   HG23  THR  26          HG23      THR  26   4.003   9.099  18.300
 1090    H    THR  27           H        THR  27   4.987   9.407  15.326
 1091    HA   THR  27           HA       THR  27   7.135  11.167  14.448
 1092    HB   THR  27           HB       THR  27   8.738   9.220  15.172
 1093    HG1  THR  27           HG1      THR  27   6.637   8.187  16.085
 1094   HG21  THR  27          HG21      THR  27   7.648  11.244  17.132
 1095   HG22  THR  27          HG22      THR  27   8.940  11.515  15.960
 1096   HG23  THR  27          HG23      THR  27   9.182  10.387  17.296
 1097    H    ALA  28           H        ALA  28   8.013  10.615  12.543
 1098    HA   ALA  28           HA       ALA  28   7.793   7.910  11.541
 1099    HB1  ALA  28           HB1      ALA  28   5.649   8.951  10.874
 1100    HB2  ALA  28           HB2      ALA  28   6.648   8.457   9.508
 1101    HB3  ALA  28           HB3      ALA  28   6.559  10.159   9.966
 1102    H    THR  29           H        THR  29   9.162   7.552   9.712
 1103    HA   THR  29           HA       THR  29  11.372   9.452   9.661
 1104    HB   THR  29           HB       THR  29  11.366   6.770   8.305
 1105    HG1  THR  29           HG1      THR  29  11.803   7.351  11.075
 1106   HG21  THR  29          HG21      THR  29  13.543   8.426   9.582
 1107   HG22  THR  29          HG22      THR  29  13.233   8.285   7.852
 1108   HG23  THR  29          HG23      THR  29  13.765   6.877   8.770
 1109    H    ASP  30           H        ASP  30  11.499  10.881   8.090
 1110    HA   ASP  30           HA       ASP  30   9.977  10.801   5.695
 1111    HB2  ASP  30           HB3      ASP  30  10.715  12.936   6.592
 1112    HB3  ASP  30           HB2      ASP  30  12.404  12.439   6.488
 1113    H    ILE  31           H        ILE  31  10.940  10.787   3.508
 1114    HA   ILE  31           HA       ILE  31  12.201   8.343   3.016
 1115    HB   ILE  31           HB       ILE  31  10.735   9.462   1.398
 1116   HG12  ILE  31          HG13      ILE  31  13.517   9.047   0.280
 1117   HG13  ILE  31          HG12      ILE  31  12.366   7.760   0.620
 1118   HG21  ILE  31          HG21      ILE  31  13.010  11.405   1.018
 1119   HG22  ILE  31          HG22      ILE  31  11.452  11.762   1.760
 1120   HG23  ILE  31          HG23      ILE  31  11.539  11.336   0.050
 1121   HD11  ILE  31          HD11      ILE  31  12.386   8.281  -1.735
 1122   HD12  ILE  31          HD12      ILE  31  12.019   9.970  -1.388
 1123   HD13  ILE  31          HD13      ILE  31  10.831   8.718  -1.030
 1124    H    LYS  32           H        LYS  32  13.538  11.490   3.625
 1125    HA   LYS  32           HA       LYS  32  16.147  10.844   2.566
 1126    HB2  LYS  32           HB3      LYS  32  15.227  13.153   4.284
 1127    HB3  LYS  32           HB2      LYS  32  16.794  13.032   3.491
 1128    HG2  LYS  32           HG3      LYS  32  15.740  13.105   1.321
 1129    HG3  LYS  32           HG2      LYS  32  14.144  13.095   2.067
 1130    HD2  LYS  32           HD3      LYS  32  14.655  15.224   3.156
 1131    HD3  LYS  32           HD2      LYS  32  16.233  15.246   2.368
 1132    HE2  LYS  32           HE3      LYS  32  13.570  15.217   0.966
 1133    HE3  LYS  32           HE2      LYS  32  14.578  16.643   1.201
 1134    HZ1  LYS  32           HZ1      LYS  32  16.320  15.552  -0.100
 1135    HZ2  LYS  32           HZ2      LYS  32  14.899  15.743  -0.998
 1136    HZ3  LYS  32           HZ3      LYS  32  15.302  14.228  -0.366
 1137    H    GLY  33           H        GLY  33  14.515   9.871   5.244
 1138    HA2  GLY  33           HA3      GLY  33  15.406   8.455   6.889
 1139    HA3  GLY  33           HA2      GLY  33  17.007   9.099   6.547
 1140    H    LYS  34           H        LYS  34  14.354  11.261   7.030
 1141    HA   LYS  34           HA       LYS  34  15.619  12.191   9.503
 1142    HB2  LYS  34           HB3      LYS  34  13.491  13.520   7.821
 1143    HB3  LYS  34           HB2      LYS  34  14.359  14.249   9.161
 1144    HG2  LYS  34           HG3      LYS  34  15.594  13.352   6.569
 1145    HG3  LYS  34           HG2      LYS  34  15.171  15.008   6.984
 1146    HD2  LYS  34           HD3      LYS  34  16.715  14.869   8.915
 1147    HD3  LYS  34           HD2      LYS  34  17.202  13.265   8.367
 1148    HE2  LYS  34           HE3      LYS  34  18.048  14.182   6.301
 1149    HE3  LYS  34           HE2      LYS  34  17.431  15.775   6.724
 1150    HZ1  LYS  34           HZ1      LYS  34  19.553  14.305   8.186
 1151    HZ2  LYS  34           HZ2      LYS  34  18.966  15.838   8.582
 1152    HZ3  LYS  34           HZ3      LYS  34  19.801  15.604   7.134
 1153    H    GLU  35           H        GLU  35  14.757  11.523  11.369
 1154    HA   GLU  35           HA       GLU  35  12.075  10.479  11.499
 1155    HB2  GLU  35           HB3      GLU  35  14.027   9.647  12.880
 1156    HB3  GLU  35           HB2      GLU  35  13.920  11.141  13.794
 1157    HG2  GLU  35           HG3      GLU  35  12.802   9.428  15.013
 1158    HG3  GLU  35           HG2      GLU  35  11.590  10.546  14.396
 1159    H    VAL  36           H        VAL  36  10.366  11.770  11.588
 1160    HA   VAL  36           HA       VAL  36  10.720  14.445  12.758
 1161    HB   VAL  36           HB       VAL  36   9.108  15.297  11.074
 1162   HG11  VAL  36          HG11      VAL  36  11.496  15.563  10.702
 1163   HG12  VAL  36          HG12      VAL  36  10.660  15.285   9.175
 1164   HG13  VAL  36          HG13      VAL  36  11.568  13.978   9.934
 1165   HG21  VAL  36          HG21      VAL  36   9.457  12.582   9.808
 1166   HG22  VAL  36          HG22      VAL  36   8.605  13.954   9.101
 1167   HG23  VAL  36          HG23      VAL  36   7.982  13.188  10.562
 1168    H    THR  37           H        THR  37   8.820  15.460  13.561
 1169    HA   THR  37           HA       THR  37   7.093  13.582  14.928
 1170    HB   THR  37           HB       THR  37   7.187  16.594  15.117
 1171    HG1  THR  37           HG1      THR  37   9.027  14.894  15.834
 1172   HG21  THR  37          HG21      THR  37   6.076  16.259  17.276
 1173   HG22  THR  37          HG22      THR  37   6.023  14.521  16.981
 1174   HG23  THR  37          HG23      THR  37   5.102  15.620  15.954
 1175    H    VAL  38           H        VAL  38   5.209  13.013  14.148
 1176    HA   VAL  38           HA       VAL  38   4.150  14.404  11.831
 1177    HB   VAL  38           HB       VAL  38   3.207  11.836  13.110
 1178   HG11  VAL  38          HG11      VAL  38   1.504  12.874  11.743
 1179   HG12  VAL  38          HG12      VAL  38   2.142  11.440  10.935
 1180   HG13  VAL  38          HG13      VAL  38   2.648  13.045  10.410
 1181   HG21  VAL  38          HG21      VAL  38   5.517  11.646  12.353
 1182   HG22  VAL  38          HG22      VAL  38   5.050  12.245  10.762
 1183   HG23  VAL  38          HG23      VAL  38   4.433  10.695  11.336
 1184    H    LEU  39           H        LEU  39   2.221  15.432  11.754
 1185    HA   LEU  39           HA       LEU  39   0.926  15.987  14.325
 1186    HB2  LEU  39           HB3      LEU  39   0.582  17.407  11.677
 1187    HB3  LEU  39           HB2      LEU  39   0.040  17.965  13.249
 1188    HG   LEU  39           HG       LEU  39   2.931  17.652  12.443
 1189   HD11  LEU  39          HD11      LEU  39   1.232  20.128  12.672
 1190   HD12  LEU  39          HD12      LEU  39   1.859  19.427  11.179
 1191   HD13  LEU  39          HD13      LEU  39   2.971  20.094  12.376
 1192   HD21  LEU  39          HD21      LEU  39   1.670  18.904  14.877
 1193   HD22  LEU  39          HD22      LEU  39   3.390  18.911  14.484
 1194   HD23  LEU  39          HD23      LEU  39   2.572  17.389  14.836
 1195    H    ALA  40           H        ALA  40  -1.196  15.482  14.675
 1196    HA   ALA  40           HA       ALA  40  -2.429  13.499  13.058
 1197    HB1  ALA  40           HB1      ALA  40  -3.613  15.175  15.269
 1198    HB2  ALA  40           HB2      ALA  40  -2.790  13.632  15.476
 1199    HB3  ALA  40           HB3      ALA  40  -4.316  13.704  14.596
 1200    H    GLU  41           H        GLU  41  -2.603  16.931  13.265
 1201    HA   GLU  41           HA       GLU  41  -4.520  16.993  11.040
 1202    HB2  GLU  41           HB3      GLU  41  -4.374  18.940  13.354
 1203    HB3  GLU  41           HB2      GLU  41  -5.501  19.014  12.006
 1204    HG2  GLU  41           HG3      GLU  41  -6.624  17.053  12.726
 1205    HG3  GLU  41           HG2      GLU  41  -5.376  16.706  13.923
 1206    H    VAL  42           H        VAL  42  -4.010  18.456   9.421
 1207    HA   VAL  42           HA       VAL  42  -1.283  19.457   9.563
 1208    HB   VAL  42           HB       VAL  42  -1.456  19.884   7.154
 1209   HG11  VAL  42          HG11      VAL  42  -0.762  17.681   7.931
 1210   HG12  VAL  42          HG12      VAL  42  -1.644  17.577   6.407
 1211   HG13  VAL  42          HG13      VAL  42  -2.441  17.144   7.919
 1212   HG21  VAL  42          HG21      VAL  42  -4.262  18.807   7.377
 1213   HG22  VAL  42          HG22      VAL  42  -3.414  19.185   5.878
 1214   HG23  VAL  42          HG23      VAL  42  -3.820  20.476   7.011
 1215    H    ASN  43           H        ASN  43  -0.913  21.382  10.278
 1216    HA   ASN  43           HA       ASN  43  -2.916  23.502   9.926
 1217    HB2  ASN  43           HB3      ASN  43  -0.526  23.272  11.781
 1218    HB3  ASN  43           HB2      ASN  43  -1.475  24.744  11.603
 1219   HD21  ASN  43          HD21      ASN  43  -1.441  21.483  12.829
 1220   HD22  ASN  43          HD22      ASN  43  -2.859  21.633  13.805
 1221    H    ILE  44           H        ILE  44  -2.558  24.295   7.910
 1222    HA   ILE  44           HA       ILE  44   0.144  24.726   6.958
 1223    HB   ILE  44           HB       ILE  44  -2.465  25.554   5.665
 1224   HG12  ILE  44          HG13      ILE  44  -0.753  23.116   5.120
 1225   HG13  ILE  44          HG12      ILE  44  -2.261  23.094   6.031
 1226   HG21  ILE  44          HG21      ILE  44  -1.156  25.721   3.615
 1227   HG22  ILE  44          HG22      ILE  44   0.302  25.272   4.497
 1228   HG23  ILE  44          HG23      ILE  44  -0.512  26.796   4.855
 1229   HD11  ILE  44          HD11      ILE  44  -2.622  22.344   3.761
 1230   HD12  ILE  44          HD12      ILE  44  -1.942  23.844   3.132
 1231   HD13  ILE  44          HD13      ILE  44  -3.456  23.874   4.035
 1232    H    ASN  45           H        ASN  45  -2.494  27.059   6.652
 1233    HA   ASN  45           HA       ASN  45  -0.913  28.963   8.246
 1234    HB2  ASN  45           HB3      ASN  45  -2.558  29.541   5.768
 1235    HB3  ASN  45           HB2      ASN  45  -1.883  30.778   6.815
 1236   HD21  ASN  45          HD21      ASN  45   0.627  29.369   7.272
 1237   HD22  ASN  45          HD22      ASN  45   1.518  29.492   5.797
 1238    H    ASN  46           H        ASN  46  -4.159  28.821   6.812
 1239    HA   ASN  46           HA       ASN  46  -5.284  29.107   9.516
 1240    HB2  ASN  46           HB3      ASN  46  -6.112  30.613   7.025
 1241    HB3  ASN  46           HB2      ASN  46  -7.077  30.557   8.494
 1242   HD21  ASN  46          HD21      ASN  46  -4.819  30.679  10.300
 1243   HD22  ASN  46          HD22      ASN  46  -4.211  32.294  10.211
 1244    H    SER  47           H        SER  47  -4.883  26.743   7.975
 1245    HA   SER  47           HA       SER  47  -7.654  25.864   7.679
 1246    HB2  SER  47           HB3      SER  47  -5.484  25.249   5.649
 1247    HB3  SER  47           HB2      SER  47  -7.159  24.707   5.583
 1248    HG   SER  47           HG       SER  47  -7.756  26.949   5.467
 1249    H    VAL  48           H        VAL  48  -7.964  24.065   8.827
 1250    HA   VAL  48           HA       VAL  48  -5.620  22.390   9.454
 1251    HB   VAL  48           HB       VAL  48  -8.067  22.797  11.182
 1252   HG11  VAL  48          HG11      VAL  48  -6.765  21.646  12.902
 1253   HG12  VAL  48          HG12      VAL  48  -5.458  21.400  11.745
 1254   HG13  VAL  48          HG13      VAL  48  -7.021  20.625  11.488
 1255   HG21  VAL  48          HG21      VAL  48  -5.300  23.949  11.497
 1256   HG22  VAL  48          HG22      VAL  48  -6.617  24.094  12.663
 1257   HG23  VAL  48          HG23      VAL  48  -6.758  24.844  11.074
 1258    H    PHE  49           H        PHE  49  -5.730  20.442   8.542
 1259    HA   PHE  49           HA       PHE  49  -8.395  19.241   8.139
 1260    HB2  PHE  49           HB3      PHE  49  -5.955  18.897   6.371
 1261    HB3  PHE  49           HB2      PHE  49  -7.502  18.088   6.146
 1262    HD1  PHE  49           HD1      PHE  49  -5.573  21.065   5.554
 1263    HD2  PHE  49           HD2      PHE  49  -9.511  19.448   5.558
 1264    HE1  PHE  49           HE1      PHE  49  -6.337  22.932   4.141
 1265    HE2  PHE  49           HE2      PHE  49 -10.282  21.310   4.148
 1266    HZ   PHE  49           HZ       PHE  49  -8.694  23.055   3.437
 1267    H    ARG  50           H        ARG  50  -8.698  17.221   8.893
 1268    HA   ARG  50           HA       ARG  50  -6.606  15.958  10.443
 1269    HB2  ARG  50           HB3      ARG  50  -9.367  14.920   9.752
 1270    HB3  ARG  50           HB2      ARG  50  -8.301  14.289  10.995
 1271    HG2  ARG  50           HG3      ARG  50  -8.487  16.458  12.179
 1272    HG3  ARG  50           HG2      ARG  50  -9.667  16.971  10.973
 1273    HD2  ARG  50           HD3      ARG  50  -9.912  14.601  12.817
 1274    HD3  ARG  50           HD2      ARG  50 -10.776  16.130  12.969
 1275    HE   ARG  50           HE       ARG  50 -11.506  15.318  10.517
 1276   HH11  ARG  50          HH11      ARG  50 -11.430  13.668  13.601
 1277   HH12  ARG  50          HH12      ARG  50 -12.759  12.620  13.221
 1278   HH21  ARG  50          HH21      ARG  50 -13.247  13.933  10.002
 1279   HH22  ARG  50          HH22      ARG  50 -13.799  12.775  11.171
 1280    H    GLN  51           H        GLN  51  -5.042  14.897   9.355
 1281    HA   GLN  51           HA       GLN  51  -5.604  14.055   6.658
 1282    HB2  GLN  51           HB3      GLN  51  -3.188  13.646   6.477
 1283    HB3  GLN  51           HB2      GLN  51  -3.562  15.267   7.027
 1284    HG2  GLN  51           HG3      GLN  51  -2.945  14.653   9.296
 1285    HG3  GLN  51           HG2      GLN  51  -2.635  12.995   8.771
 1286   HE21  GLN  51          HE21      GLN  51  -0.785  14.889   9.992
 1287   HE22  GLN  51          HE22      GLN  51   0.510  15.094   8.858
 1288    H    TYR  52           H        TYR  52  -4.290  12.391   9.542
 1289    HA   TYR  52           HA       TYR  52  -4.242  10.204  10.147
 1290    HB2  TYR  52           HB3      TYR  52  -6.547   9.995   8.200
 1291    HB3  TYR  52           HB2      TYR  52  -6.012   8.673   9.228
 1292    HD1  TYR  52           HD1      TYR  52  -8.059  11.606   9.009
 1293    HD2  TYR  52           HD2      TYR  52  -6.098   9.007  11.748
 1294    HE1  TYR  52           HE1      TYR  52  -9.530  12.398  10.809
 1295    HE2  TYR  52           HE2      TYR  52  -7.562   9.800  13.556
 1296    HH   TYR  52           HH       TYR  52  -8.938  11.800  14.077
 1297    H    PHE  53           H        PHE  53  -3.636   8.038   9.449
 1298    HA   PHE  53           HA       PHE  53  -2.627   7.890   6.687
 1299    HB2  PHE  53           HB3      PHE  53  -1.092   6.979   9.136
 1300    HB3  PHE  53           HB2      PHE  53  -0.533   6.928   7.461
 1301    HD1  PHE  53           HD1      PHE  53  -0.228   9.102   6.239
 1302    HD2  PHE  53           HD2      PHE  53  -0.793   8.878  10.442
 1303    HE1  PHE  53           HE1      PHE  53   0.676  11.371   6.472
 1304    HE2  PHE  53           HE2      PHE  53   0.112  11.149  10.690
 1305    HZ   PHE  53           HZ       PHE  53   0.844  12.400   8.701
 1306    H    PHE  54           H        PHE  54  -3.098   6.025   5.695
 1307    HA   PHE  54           HA       PHE  54  -4.467   3.962   7.181
 1308    HB2  PHE  54           HB3      PHE  54  -4.709   2.902   4.885
 1309    HB3  PHE  54           HB2      PHE  54  -5.467   4.473   5.083
 1310    HD1  PHE  54           HD1      PHE  54  -3.128   2.520   3.197
 1311    HD2  PHE  54           HD2      PHE  54  -4.270   6.506   4.167
 1312    HE1  PHE  54           HE1      PHE  54  -1.924   3.346   1.218
 1313    HE2  PHE  54           HE2      PHE  54  -3.064   7.336   2.195
 1314    HZ   PHE  54           HZ       PHE  54  -1.891   5.757   0.717
 1315    H    GLU  55           H        GLU  55  -3.011   2.920   8.442
 1316    HA   GLU  55           HA       GLU  55  -0.625   1.830   7.131
 1317    HB2  GLU  55           HB3      GLU  55  -1.252   2.016  10.091
 1318    HB3  GLU  55           HB2      GLU  55   0.249   1.418   9.393
 1319    HG2  GLU  55           HG3      GLU  55   0.345   3.771   8.270
 1320    HG3  GLU  55           HG2      GLU  55  -0.787   4.219   9.547
 1321    H    THR  56           H        THR  56  -0.834  -0.085   6.344
 1322    HA   THR  56           HA       THR  56  -2.736  -1.974   7.524
 1323    HB   THR  56           HB       THR  56  -1.272  -2.219   4.891
 1324    HG1  THR  56           HG1      THR  56  -2.637  -0.780   4.171
 1325   HG21  THR  56          HG21      THR  56  -3.065  -3.813   4.352
 1326   HG22  THR  56          HG22      THR  56  -3.746  -3.588   5.963
 1327   HG23  THR  56          HG23      THR  56  -2.155  -4.324   5.775
 1328    H    LYS  57           H        LYS  57  -1.829  -3.143   9.067
 1329    HA   LYS  57           HA       LYS  57   0.985  -3.948   8.794
 1330    HB2  LYS  57           HB3      LYS  57  -0.808  -3.863  11.236
 1331    HB3  LYS  57           HB2      LYS  57   0.885  -4.346  11.237
 1332    HG2  LYS  57           HG3      LYS  57   1.519  -2.101  10.488
 1333    HG3  LYS  57           HG2      LYS  57  -0.177  -1.617  10.519
 1334    HD2  LYS  57           HD3      LYS  57   0.849  -0.856  12.540
 1335    HD3  LYS  57           HD2      LYS  57  -0.216  -2.201  12.945
 1336    HE2  LYS  57           HE3      LYS  57   1.728  -3.703  12.951
 1337    HE3  LYS  57           HE2      LYS  57   2.774  -2.330  12.602
 1338    HZ1  LYS  57           HZ1      LYS  57   1.112  -2.678  15.035
 1339    HZ2  LYS  57           HZ2      LYS  57   2.066  -1.323  14.694
 1340    HZ3  LYS  57           HZ3      LYS  57   2.796  -2.827  14.946
 1341    H    CYS  58           H        CYS  58   1.521  -6.104   9.696
 1342    HA   CYS  58           HA       CYS  58  -0.364  -8.078   8.702
 1343    HB2  CYS  58           HB3      CYS  58   2.427  -8.434   9.830
 1344    HB3  CYS  58           HB2      CYS  58   1.470  -9.692   9.063
 1345    H    ARG  59           H        ARG  59  -1.836  -8.950   9.986
 1346    HA   ARG  59           HA       ARG  59  -1.784  -8.726  12.829
 1347    HB2  ARG  59           HB3      ARG  59  -3.466 -10.410  10.965
 1348    HB3  ARG  59           HB2      ARG  59  -3.707 -10.362  12.703
 1349    HG2  ARG  59           HG3      ARG  59  -4.196  -7.976  12.571
 1350    HG3  ARG  59           HG2      ARG  59  -3.943  -8.021  10.828
 1351    HD2  ARG  59           HD3      ARG  59  -6.335  -8.123  11.475
 1352    HD3  ARG  59           HD2      ARG  59  -5.800  -9.517  10.540
 1353    HE   ARG  59           HE       ARG  59  -5.683  -9.873  13.406
 1354   HH11  ARG  59          HH11      ARG  59  -7.673 -10.180  10.542
 1355   HH12  ARG  59          HH12      ARG  59  -8.692 -11.407  11.221
 1356   HH21  ARG  59          HH21      ARG  59  -7.015 -11.492  14.305
 1357   HH22  ARG  59          HH22      ARG  59  -8.306 -12.163  13.360
 1358    H    ALA  60           H        ALA  60  -0.795 -11.090  10.505
 1359    HA   ALA  60           HA       ALA  60   0.663 -12.520  12.582
 1360    HB1  ALA  60           HB1      ALA  60  -1.418 -13.787  12.326
 1361    HB2  ALA  60           HB2      ALA  60  -0.044 -14.704  11.704
 1362    HB3  ALA  60           HB3      ALA  60  -1.145 -13.897  10.587
 1363    H    SER  61           H        SER  61   2.669 -13.092  11.885
 1364    HA   SER  61           HA       SER  61   3.490 -12.252   9.261
 1365    HB2  SER  61           HB3      SER  61   5.730 -13.172  10.050
 1366    HB3  SER  61           HB2      SER  61   5.053 -11.860  11.014
 1367    HG   SER  61           HG       SER  61   5.759 -14.271  11.824
 1368    H    ASN  62           H        ASN  62   2.476 -15.124  10.789
 1369    HA   ASN  62           HA       ASN  62   2.594 -16.551   8.259
 1370    HB2  ASN  62           HB3      ASN  62   3.991 -17.414  10.768
 1371    HB3  ASN  62           HB2      ASN  62   3.271 -18.639   9.734
 1372   HD21  ASN  62          HD21      ASN  62   3.801 -17.373   7.246
 1373   HD22  ASN  62          HD22      ASN  62   5.509 -17.452   6.981
 1374    HA   PRO  63           HA       PRO  63  -1.560 -16.803  10.191
 1375    HB2  PRO  63           HB3      PRO  63  -2.670 -17.898   7.882
 1376    HB3  PRO  63           HB2      PRO  63  -2.622 -16.173   8.275
 1377    HG2  PRO  63           HG3      PRO  63  -0.816 -17.777   6.520
 1378    HG3  PRO  63           HG2      PRO  63  -1.423 -16.129   6.294
 1379    HD2  PRO  63           HD3      PRO  63   1.090 -16.570   7.113
 1380    HD3  PRO  63           HD2      PRO  63   0.141 -15.213   7.771
 1381    H    VAL  64           H        VAL  64   0.144 -19.247   8.306
 1382    HA   VAL  64           HA       VAL  64  -0.910 -21.273  10.159
 1383    HB   VAL  64           HB       VAL  64  -0.543 -22.969   8.372
 1384   HG11  VAL  64          HG11      VAL  64  -2.475 -20.762   7.683
 1385   HG12  VAL  64          HG12      VAL  64  -2.775 -22.111   8.780
 1386   HG13  VAL  64          HG13      VAL  64  -2.539 -22.410   7.059
 1387   HG21  VAL  64          HG21      VAL  64   1.067 -21.783   7.007
 1388   HG22  VAL  64          HG22      VAL  64  -0.137 -20.556   6.613
 1389   HG23  VAL  64          HG23      VAL  64  -0.345 -22.211   6.043
 1390    H    GLU  65           H        GLU  65   0.589 -22.993  10.669
 1391    HA   GLU  65           HA       GLU  65   3.216 -21.928  11.147
 1392    HB2  GLU  65           HB3      GLU  65   2.010 -24.612  11.834
 1393    HB3  GLU  65           HB2      GLU  65   3.558 -24.023  12.418
 1394    HG2  GLU  65           HG3      GLU  65   2.538 -22.330  13.700
 1395    HG3  GLU  65           HG2      GLU  65   0.980 -22.568  12.908
 1396    H    SER  66           H        SER  66   3.541 -21.817   8.756
 1397    HA   SER  66           HA       SER  66   5.472 -23.638   7.911
 1398    HB2  SER  66           HB3      SER  66   4.297 -24.784   6.061
 1399    HB3  SER  66           HB2      SER  66   3.597 -25.214   7.622
 1400    HG   SER  66           HG       SER  66   2.510 -23.800   5.505
 1401    H    GLY  67           H        GLY  67   2.995 -21.310   7.061
 1402    HA2  GLY  67           HA3      GLY  67   4.672 -19.414   5.978
 1403    HA3  GLY  67           HA2      GLY  67   4.180 -20.431   4.626
 1404    H    CYS  68           H        CYS  68   2.382 -19.855   3.602
 1405    HA   CYS  68           HA       CYS  68   0.413 -18.222   5.061
 1406    HB2  CYS  68           HB3      CYS  68   1.169 -18.151   2.130
 1407    HB3  CYS  68           HB2      CYS  68  -0.219 -17.295   2.807
 1408    H    ARG  69           H        ARG  69  -1.841 -18.463   4.231
 1409    HA   ARG  69           HA       ARG  69  -2.526 -21.225   4.316
 1410    HB2  ARG  69           HB3      ARG  69  -4.199 -18.748   3.857
 1411    HB3  ARG  69           HB2      ARG  69  -4.878 -20.368   3.956
 1412    HG2  ARG  69           HG3      ARG  69  -4.070 -20.595   6.229
 1413    HG3  ARG  69           HG2      ARG  69  -3.301 -19.012   6.139
 1414    HD2  ARG  69           HD3      ARG  69  -6.262 -19.531   5.862
 1415    HD3  ARG  69           HD2      ARG  69  -5.466 -18.964   7.330
 1416    HE   ARG  69           HE       ARG  69  -5.555 -17.434   4.805
 1417   HH11  ARG  69          HH11      ARG  69  -5.566 -17.585   8.308
 1418   HH12  ARG  69          HH12      ARG  69  -5.757 -15.867   8.504
 1419   HH21  ARG  69          HH21      ARG  69  -5.848 -15.182   5.067
 1420   HH22  ARG  69          HH22      ARG  69  -5.961 -14.514   6.674
 1421    H    GLY  70           H        GLY  70  -2.972 -22.621   2.727
 1422    HA2  GLY  70           HA3      GLY  70  -3.791 -23.296   0.624
 1423    HA3  GLY  70           HA2      GLY  70  -3.689 -21.629   0.074
 1424    H    ILE  71           H        ILE  71  -0.918 -21.423   1.135
 1425    HA   ILE  71           HA       ILE  71   0.416 -22.102  -1.280
 1426    HB   ILE  71           HB       ILE  71   1.529 -21.166   1.368
 1427   HG12  ILE  71          HG13      ILE  71  -0.010 -19.563   0.321
 1428   HG13  ILE  71          HG12      ILE  71   1.646 -18.969   0.296
 1429   HG21  ILE  71          HG21      ILE  71   2.857 -21.311  -1.335
 1430   HG22  ILE  71          HG22      ILE  71   3.253 -22.283   0.085
 1431   HG23  ILE  71          HG23      ILE  71   3.535 -20.540   0.101
 1432   HD11  ILE  71          HD11      ILE  71   0.502 -18.505  -1.792
 1433   HD12  ILE  71          HD12      ILE  71   0.194 -20.222  -2.021
 1434   HD13  ILE  71          HD13      ILE  71   1.849 -19.613  -2.045
 1435    H    ASP  72           H        ASP  72   1.573 -23.847  -1.811
 1436    HA   ASP  72           HA       ASP  72   1.820 -26.114  -0.114
 1437    HB2  ASP  72           HB3      ASP  72   1.826 -26.258  -2.602
 1438    HB3  ASP  72           HB2      ASP  72   3.389 -25.444  -2.623
 1439    H    SER  73           H        SER  73   2.891 -25.700   1.760
 1440    HA   SER  73           HA       SER  73   5.141 -23.918   1.819
 1441    HB2  SER  73           HB3      SER  73   4.029 -25.645   4.039
 1442    HB3  SER  73           HB2      SER  73   5.082 -24.240   4.218
 1443    HG   SER  73           HG       SER  73   2.845 -23.682   2.766
 1444    H    LYS  74           H        LYS  74   5.052 -26.879   0.672
 1445    HA   LYS  74           HA       LYS  74   7.431 -27.909   1.993
 1446    HB2  LYS  74           HB3      LYS  74   5.788 -29.018  -0.289
 1447    HB3  LYS  74           HB2      LYS  74   7.145 -29.838   0.463
 1448    HG2  LYS  74           HG3      LYS  74   5.926 -29.856   2.599
 1449    HG3  LYS  74           HG2      LYS  74   4.552 -29.095   1.794
 1450    HD2  LYS  74           HD3      LYS  74   5.746 -31.754   1.045
 1451    HD3  LYS  74           HD2      LYS  74   4.298 -31.536   2.020
 1452    HE2  LYS  74           HE3      LYS  74   3.274 -30.322   0.111
 1453    HE3  LYS  74           HE2      LYS  74   4.699 -30.718  -0.849
 1454    HZ1  LYS  74           HZ1      LYS  74   4.216 -33.049  -0.580
 1455    HZ2  LYS  74           HZ2      LYS  74   2.866 -32.266  -1.227
 1456    HZ3  LYS  74           HZ3      LYS  74   2.886 -32.706   0.407
 1457    H    HIS  75           H        HIS  75   6.382 -26.610  -1.106
 1458    HA   HIS  75           HA       HIS  75   9.165 -26.583  -2.041
 1459    HB2  HIS  75           HB3      HIS  75   6.583 -26.019  -3.524
 1460    HB3  HIS  75           HB2      HIS  75   8.188 -25.981  -4.245
 1461    HD1  HIS  75           HD1      HIS  75   5.614 -28.343  -2.881
 1462    HD2  HIS  75           HD2      HIS  75   9.273 -28.472  -4.860
 1463    HE1  HIS  75           HE1      HIS  75   5.905 -30.733  -3.623
 1464    HE2  HIS  75           HE2      HIS  75   8.035 -30.737  -4.967
 1465    H    TRP  76           H        TRP  76   6.586 -24.536  -0.972
 1466    HA   TRP  76           HA       TRP  76   8.235 -22.176  -1.579
 1467    HB2  TRP  76           HB3      TRP  76   5.225 -22.431  -1.424
 1468    HB3  TRP  76           HB2      TRP  76   6.073 -20.890  -1.503
 1469    HD1  TRP  76           HD1      TRP  76   4.702 -23.616  -3.655
 1470    HE1  TRP  76           HE1      TRP  76   5.209 -23.109  -6.127
 1471    HE3  TRP  76           HE3      TRP  76   8.067 -19.809  -3.040
 1472    HZ2  TRP  76           HZ2      TRP  76   6.805 -21.330  -7.613
 1473    HZ3  TRP  76           HZ3      TRP  76   9.032 -18.758  -5.041
 1474    HH2  TRP  76           HH2      TRP  76   8.416 -19.507  -7.281
 1475    H    ASN  77           H        ASN  77   9.078 -21.266   0.130
 1476    HA   ASN  77           HA       ASN  77   7.789 -21.500   2.742
 1477    HB2  ASN  77           HB3      ASN  77  10.252 -21.797   2.618
 1478    HB3  ASN  77           HB2      ASN  77  10.404 -20.171   1.967
 1479   HD21  ASN  77          HD21      ASN  77   9.664 -22.067   4.798
 1480   HD22  ASN  77          HD22      ASN  77   9.845 -20.777   5.940
 1481    H    SER  78           H        SER  78   6.795 -19.778   3.732
 1482    HA   SER  78           HA       SER  78   6.595 -17.322   2.132
 1483    HB2  SER  78           HB3      SER  78   4.177 -18.529   3.447
 1484    HB3  SER  78           HB2      SER  78   4.254 -17.376   2.115
 1485    HG   SER  78           HG       SER  78   5.361 -19.248   0.996
 1486    H    TYR  79           H        TYR  79   6.218 -15.443   3.261
 1487    HA   TYR  79           HA       TYR  79   5.242 -15.525   5.945
 1488    HB2  TYR  79           HB3      TYR  79   7.081 -14.285   6.998
 1489    HB3  TYR  79           HB2      TYR  79   7.622 -15.855   6.421
 1490    HD1  TYR  79           HD1      TYR  79   7.858 -12.221   5.937
 1491    HD2  TYR  79           HD2      TYR  79   9.261 -16.028   4.649
 1492    HE1  TYR  79           HE1      TYR  79   9.737 -11.135   4.782
 1493    HE2  TYR  79           HE2      TYR  79  11.138 -14.947   3.486
 1494    HH   TYR  79           HH       TYR  79  11.767 -12.814   2.587
 1495    H    CYS  80           H        CYS  80   4.590 -13.465   6.711
 1496    HA   CYS  80           HA       CYS  80   3.749 -11.797   4.490
 1497    HB2  CYS  80           HB3      CYS  80   3.001 -11.604   7.418
 1498    HB3  CYS  80           HB2      CYS  80   2.173 -10.832   6.061
 1499    H    THR  81           H        THR  81   4.914 -10.137   3.885
 1500    HA   THR  81           HA       THR  81   6.624  -8.759   5.838
 1501    HB   THR  81           HB       THR  81   6.702  -8.508   2.824
 1502    HG1  THR  81           HG1      THR  81   7.329 -10.632   4.245
 1503   HG21  THR  81          HG21      THR  81   7.785  -6.694   4.072
 1504   HG22  THR  81          HG22      THR  81   8.970  -7.676   3.210
 1505   HG23  THR  81          HG23      THR  81   8.757  -7.877   4.949
 1506    H    THR  82           H        THR  82   6.051  -6.764   6.485
 1507    HA   THR  82           HA       THR  82   3.762  -5.480   5.275
 1508    HB   THR  82           HB       THR  82   5.451  -4.325   7.482
 1509    HG1  THR  82           HG1      THR  82   3.957  -6.634   7.491
 1510   HG21  THR  82          HG21      THR  82   3.324  -3.350   8.176
 1511   HG22  THR  82          HG22      THR  82   2.504  -4.178   6.852
 1512   HG23  THR  82          HG23      THR  82   3.692  -2.921   6.505
 1513    H    THR  83           H        THR  83   3.975  -4.149   3.592
 1514    HA   THR  83           HA       THR  83   6.604  -3.251   2.816
 1515    HB   THR  83           HB       THR  83   5.325  -2.275   0.840
 1516    HG1  THR  83           HG1      THR  83   3.208  -2.566   0.739
 1517   HG21  THR  83          HG21      THR  83   5.084  -5.236   1.387
 1518   HG22  THR  83          HG22      THR  83   6.486  -4.415   0.699
 1519   HG23  THR  83          HG23      THR  83   4.970  -4.474  -0.200
 1520    H    HIS  84           H        HIS  84   7.393  -1.234   2.918
 1521    HA   HIS  84           HA       HIS  84   5.726   0.753   4.296
 1522    HB2  HIS  84           HB3      HIS  84   7.887   1.850   4.909
 1523    HB3  HIS  84           HB2      HIS  84   7.733   0.218   5.545
 1524    HD1  HIS  84           HD1      HIS  84   9.547  -1.415   4.963
 1525    HD2  HIS  84           HD2      HIS  84   9.743   2.050   2.672
 1526    HE1  HIS  84           HE1      HIS  84  11.714  -1.560   3.703
 1527    HE2  HIS  84           HE2      HIS  84  11.771   0.501   2.256
 1528    H    THR  85           H        THR  85   5.321   2.704   3.406
 1529    HA   THR  85           HA       THR  85   6.727   3.390   0.913
 1530    HB   THR  85           HB       THR  85   4.435   2.429   0.422
 1531    HG1  THR  85           HG1      THR  85   4.511   3.715  -1.260
 1532   HG21  THR  85          HG21      THR  85   2.478   3.811   0.888
 1533   HG22  THR  85          HG22      THR  85   3.485   4.969   1.757
 1534   HG23  THR  85          HG23      THR  85   3.272   3.337   2.389
 1535    H    PHE  86           H        PHE  86   6.407   5.767   0.391
 1536    HA   PHE  86           HA       PHE  86   6.562   7.235   2.932
 1537    HB2  PHE  86           HB3      PHE  86   7.851   7.901   0.269
 1538    HB3  PHE  86           HB2      PHE  86   8.022   8.833   1.758
 1539    HD1  PHE  86           HD1      PHE  86   9.197   7.829   3.706
 1540    HD2  PHE  86           HD2      PHE  86   9.170   5.980  -0.126
 1541    HE1  PHE  86           HE1      PHE  86  11.125   6.449   4.365
 1542    HE2  PHE  86           HE2      PHE  86  11.096   4.595   0.524
 1543    HZ   PHE  86           HZ       PHE  86  12.077   4.826   2.770
 1544    H    VAL  87           H        VAL  87   4.934   8.539   3.346
 1545    HA   VAL  87           HA       VAL  87   3.255   9.404   1.092
 1546    HB   VAL  87           HB       VAL  87   1.425   9.647   2.768
 1547   HG11  VAL  87          HG11      VAL  87   1.553   7.668   1.390
 1548   HG12  VAL  87          HG12      VAL  87   1.005   7.240   3.010
 1549   HG13  VAL  87          HG13      VAL  87   2.671   6.917   2.528
 1550   HG21  VAL  87          HG21      VAL  87   3.364   8.255   4.611
 1551   HG22  VAL  87          HG22      VAL  87   1.660   8.555   4.944
 1552   HG23  VAL  87          HG23      VAL  87   2.777   9.910   4.780
 1553    H    LYS  88           H        LYS  88   2.742  11.444   0.804
 1554    HA   LYS  88           HA       LYS  88   4.251  13.529   1.957
 1555    HB2  LYS  88           HB3      LYS  88   2.608  14.988   0.665
 1556    HB3  LYS  88           HB2      LYS  88   3.531  13.825  -0.278
 1557    HG2  LYS  88           HG3      LYS  88   1.411  12.313   0.122
 1558    HG3  LYS  88           HG2      LYS  88   0.627  13.870   0.367
 1559    HD2  LYS  88           HD3      LYS  88   1.254  14.617  -1.797
 1560    HD3  LYS  88           HD2      LYS  88   2.317  13.230  -2.035
 1561    HE2  LYS  88           HE3      LYS  88   0.431  12.678  -3.275
 1562    HE3  LYS  88           HE2      LYS  88   0.183  11.819  -1.758
 1563    HZ1  LYS  88           HZ1      LYS  88  -1.060  14.392  -2.561
 1564    HZ2  LYS  88           HZ2      LYS  88  -1.242  13.679  -1.033
 1565    HZ3  LYS  88           HZ3      LYS  88  -1.836  12.896  -2.408
 1566    H    ALA  89           H        ALA  89   4.039  13.978   4.023
 1567    HA   ALA  89           HA       ALA  89   1.363  14.674   5.044
 1568    HB1  ALA  89           HB1      ALA  89   3.511  13.307   6.659
 1569    HB2  ALA  89           HB2      ALA  89   2.149  12.473   5.915
 1570    HB3  ALA  89           HB3      ALA  89   1.864  13.682   7.165
 1571    H    LEU  90           H        LEU  90   1.319  16.398   6.546
 1572    HA   LEU  90           HA       LEU  90   3.602  18.164   6.486
 1573    HB2  LEU  90           HB3      LEU  90   1.237  19.002   6.430
 1574    HB3  LEU  90           HB2      LEU  90   1.042  18.422   8.079
 1575    HG   LEU  90           HG       LEU  90   2.977  19.965   8.699
 1576   HD11  LEU  90          HD11      LEU  90   3.298  21.892   7.200
 1577   HD12  LEU  90          HD12      LEU  90   2.332  21.072   5.975
 1578   HD13  LEU  90          HD13      LEU  90   3.866  20.376   6.498
 1579   HD21  LEU  90          HD21      LEU  90   0.679  20.448   9.301
 1580   HD22  LEU  90          HD22      LEU  90   0.390  21.151   7.709
 1581   HD23  LEU  90          HD23      LEU  90   1.513  21.928   8.825
 1582    H    THR  91           H        THR  91   5.271  17.745   7.749
 1583    HA   THR  91           HA       THR  91   4.764  16.724  10.467
 1584    HB   THR  91           HB       THR  91   6.848  15.367  10.251
 1585    HG1  THR  91           HG1      THR  91   6.861  16.620   7.793
 1586   HG21  THR  91          HG21      THR  91   5.871  13.586   8.867
 1587   HG22  THR  91          HG22      THR  91   4.687  14.730   8.236
 1588   HG23  THR  91          HG23      THR  91   4.674  14.297   9.945
 1589    H    THR  92           H        THR  92   6.420  17.260  12.026
 1590    HA   THR  92           HA       THR  92   8.045  19.557  11.170
 1591    HB   THR  92           HB       THR  92   6.277  20.328  12.653
 1592    HG1  THR  92           HG1      THR  92   7.609  21.354  14.165
 1593   HG21  THR  92          HG21      THR  92   5.886  18.199  13.857
 1594   HG22  THR  92          HG22      THR  92   6.054  19.580  14.940
 1595   HG23  THR  92          HG23      THR  92   7.393  18.453  14.737
 1596    H    ASP  93           H        ASP  93  10.153  19.273  11.298
 1597    HA   ASP  93           HA       ASP  93  11.254  16.883  12.425
 1598    HB2  ASP  93           HB3      ASP  93  13.392  17.683  11.619
 1599    HB3  ASP  93           HB2      ASP  93  12.177  17.994  10.383
 1600    H    GLU  94           H        GLU  94  10.609  20.026  13.554
 1601    HA   GLU  94           HA       GLU  94  11.359  19.346  16.208
 1602    HB2  GLU  94           HB3      GLU  94  13.421  20.450  14.697
 1603    HB3  GLU  94           HB2      GLU  94  12.785  21.812  15.603
 1604    HG2  GLU  94           HG3      GLU  94  13.736  19.210  16.768
 1605    HG3  GLU  94           HG2      GLU  94  14.624  20.727  16.767
 1606    H    LYS  95           H        LYS  95  11.279  22.475  14.498
 1607    HA   LYS  95           HA       LYS  95   8.705  23.046  15.783
 1608    HB2  LYS  95           HB3      LYS  95  11.104  24.888  15.782
 1609    HB3  LYS  95           HB2      LYS  95   9.494  25.330  16.327
 1610    HG2  LYS  95           HG3      LYS  95   9.629  23.620  18.077
 1611    HG3  LYS  95           HG2      LYS  95  11.260  23.218  17.537
 1612    HD2  LYS  95           HD3      LYS  95  11.990  25.489  18.042
 1613    HD3  LYS  95           HD2      LYS  95  10.362  25.898  18.582
 1614    HE2  LYS  95           HE3      LYS  95  12.156  23.804  19.796
 1615    HE3  LYS  95           HE2      LYS  95  11.838  25.401  20.469
 1616    HZ1  LYS  95           HZ1      LYS  95   9.503  24.802  20.678
 1617    HZ2  LYS  95           HZ2      LYS  95  10.477  23.717  21.530
 1618    HZ3  LYS  95           HZ3      LYS  95   9.815  23.267  20.042
 1619    H    GLN  96           H        GLN  96   9.601  22.366  13.025
 1620    HA   GLN  96           HA       GLN  96   8.344  24.650  11.683
 1621    HB2  GLN  96           HB3      GLN  96  10.884  23.245  10.869
 1622    HB3  GLN  96           HB2      GLN  96   9.904  24.124   9.708
 1623    HG2  GLN  96           HG3      GLN  96  11.083  25.330  12.199
 1624    HG3  GLN  96           HG2      GLN  96  11.814  25.415  10.596
 1625   HE21  GLN  96          HE21      GLN  96   9.252  26.545  12.644
 1626   HE22  GLN  96          HE22      GLN  96   8.714  27.822  11.609
 1627    H    ALA  97           H        ALA  97   6.443  23.812  11.122
 1628    HA   ALA  97           HA       ALA  97   6.105  21.081  10.330
 1629    HB1  ALA  97           HB1      ALA  97   3.795  21.709   9.853
 1630    HB2  ALA  97           HB2      ALA  97   4.208  23.412  10.054
 1631    HB3  ALA  97           HB3      ALA  97   4.300  22.313  11.430
 1632    H    ALA  98           H        ALA  98   6.570  20.267   8.409
 1633    HA   ALA  98           HA       ALA  98   6.263  21.924   6.022
 1634    HB1  ALA  98           HB1      ALA  98   8.765  20.372   6.680
 1635    HB2  ALA  98           HB2      ALA  98   8.610  22.128   6.676
 1636    HB3  ALA  98           HB3      ALA  98   8.449  21.225   5.169
 1637    H    TRP  99           H        TRP  99   5.963  20.738   4.103
 1638    HA   TRP  99           HA       TRP  99   4.682  18.195   4.514
 1639    HB2  TRP  99           HB3      TRP  99   5.212  19.791   1.998
 1640    HB3  TRP  99           HB2      TRP  99   4.281  18.302   2.046
 1641    HD1  TRP  99           HD1      TRP  99   4.054  21.997   2.864
 1642    HE1  TRP  99           HE1      TRP  99   1.622  22.579   3.479
 1643    HE3  TRP  99           HE3      TRP  99   2.128  17.273   3.107
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.795  21.211   3.995
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.256  16.995   3.668
 1646    HH2  TRP  99           HH2      TRP  99  -1.683  18.926   4.102
 1647    H    ARG 100           H        ARG 100   5.799  16.414   4.728
 1648    HA   ARG 100           HA       ARG 100   8.157  15.989   3.015
 1649    HB2  ARG 100           HB3      ARG 100   7.792  15.157   5.907
 1650    HB3  ARG 100           HB2      ARG 100   9.153  14.690   4.896
 1651    HG2  ARG 100           HG3      ARG 100   8.433  17.487   5.754
 1652    HG3  ARG 100           HG2      ARG 100   9.770  16.510   6.356
 1653    HD2  ARG 100           HD3      ARG 100  10.792  16.504   4.152
 1654    HD3  ARG 100           HD2      ARG 100   9.428  17.403   3.497
 1655    HE   ARG 100           HE       ARG 100  11.330  18.481   5.476
 1656   HH11  ARG 100          HH11      ARG 100   9.082  18.927   2.820
 1657   HH12  ARG 100          HH12      ARG 100   9.525  20.587   2.568
 1658   HH21  ARG 100          HH21      ARG 100  11.895  20.667   5.148
 1659   HH22  ARG 100          HH22      ARG 100  11.112  21.579   3.897
 1660    H    PHE 101           H        PHE 101   8.733  13.482   3.240
 1661    HA   PHE 101           HA       PHE 101   6.200  12.043   2.757
 1662    HB2  PHE 101           HB3      PHE 101   8.857  11.766   1.323
 1663    HB3  PHE 101           HB2      PHE 101   7.549  10.603   1.169
 1664    HD1  PHE 101           HD1      PHE 101   8.498  14.125   0.514
 1665    HD2  PHE 101           HD2      PHE 101   5.731  10.980  -0.257
 1666    HE1  PHE 101           HE1      PHE 101   7.506  15.446  -1.308
 1667    HE2  PHE 101           HE2      PHE 101   4.737  12.300  -2.078
 1668    HZ   PHE 101           HZ       PHE 101   5.625  14.534  -2.605
 1669    H    ILE 102           H        ILE 102   5.857  10.675   4.377
 1670    HA   ILE 102           HA       ILE 102   8.227   9.665   5.813
 1671    HB   ILE 102           HB       ILE 102   6.712   9.435   7.786
 1672   HG12  ILE 102          HG13      ILE 102   4.813  11.134   6.163
 1673   HG13  ILE 102          HG12      ILE 102   4.585   9.419   6.469
 1674   HG21  ILE 102          HG21      ILE 102   7.003  12.217   6.671
 1675   HG22  ILE 102          HG22      ILE 102   8.235  11.318   7.560
 1676   HG23  ILE 102          HG23      ILE 102   6.743  11.803   8.364
 1677   HD11  ILE 102          HD11      ILE 102   4.467   9.878   8.871
 1678   HD12  ILE 102          HD12      ILE 102   3.229  10.748   7.963
 1679   HD13  ILE 102          HD13      ILE 102   4.663  11.599   8.540
 1680    H    ARG 103           H        ARG 103   8.313   7.567   6.487
 1681    HA   ARG 103           HA       ARG 103   6.992   5.738   4.732
 1682    HB2  ARG 103           HB3      ARG 103   8.323   3.994   5.865
 1683    HB3  ARG 103           HB2      ARG 103   9.313   5.346   5.327
 1684    HG2  ARG 103           HG3      ARG 103   9.457   6.196   7.575
 1685    HG3  ARG 103           HG2      ARG 103   8.325   4.974   8.148
 1686    HD2  ARG 103           HD3      ARG 103   9.929   3.218   7.514
 1687    HD3  ARG 103           HD2      ARG 103  11.068   4.462   6.996
 1688    HE   ARG 103           HE       ARG 103  10.969   5.242   9.394
 1689   HH11  ARG 103          HH11      ARG 103  10.398   1.893   8.515
 1690   HH12  ARG 103          HH12      ARG 103  10.943   1.275  10.039
 1691   HH21  ARG 103          HH21      ARG 103  11.684   4.425  11.388
 1692   HH22  ARG 103          HH22      ARG 103  11.658   2.713  11.677
 1693    H    ILE 104           H        ILE 104   5.076   4.943   5.013
 1694    HA   ILE 104           HA       ILE 104   4.269   4.104   7.721
 1695    HB   ILE 104           HB       ILE 104   1.929   4.353   7.080
 1696   HG12  ILE 104          HG13      ILE 104   2.863   5.634   4.514
 1697   HG13  ILE 104          HG12      ILE 104   2.372   3.949   4.613
 1698   HG21  ILE 104          HG21      ILE 104   3.521   6.856   6.563
 1699   HG22  ILE 104          HG22      ILE 104   2.975   6.260   8.131
 1700   HG23  ILE 104          HG23      ILE 104   1.799   6.802   6.934
 1701   HD11  ILE 104          HD11      ILE 104   0.644   6.320   5.261
 1702   HD12  ILE 104          HD12      ILE 104   0.152   4.629   5.329
 1703   HD13  ILE 104          HD13      ILE 104   0.581   5.361   3.782
 1704    H    ASP 105           H        ASP 105   2.923   2.163   7.739
 1705    HA   ASP 105           HA       ASP 105   3.850   0.210   5.818
 1706    HB2  ASP 105           HB3      ASP 105   1.946  -0.037   8.170
 1707    HB3  ASP 105           HB2      ASP 105   2.514  -1.391   7.189
 1708    H    THR 106           H        THR 106   2.861  -0.053   3.912
 1709    HA   THR 106           HA       THR 106   0.185   1.096   3.636
 1710    HB   THR 106           HB       THR 106   1.779   1.985   2.065
 1711    HG1  THR 106           HG1      THR 106  -0.495   0.901   1.365
 1712   HG21  THR 106          HG21      THR 106   2.842   0.564   0.345
 1713   HG22  THR 106          HG22      THR 106   2.235  -0.865   1.185
 1714   HG23  THR 106          HG23      THR 106   3.401   0.196   1.976
 1715    H    ALA 107           H        ALA 107   1.839  -1.984   3.385
 1716    HA   ALA 107           HA       ALA 107  -0.702  -3.329   3.175
 1717    HB1  ALA 107           HB1      ALA 107   1.302  -3.611   0.942
 1718    HB2  ALA 107           HB2      ALA 107  -0.260  -2.798   0.831
 1719    HB3  ALA 107           HB3      ALA 107  -0.188  -4.537   1.121
 1720    H    CYS 108           H        CYS 108  -0.443  -5.698   3.184
 1721    HA   CYS 108           HA       CYS 108   2.105  -6.575   4.362
 1722    HB2  CYS 108           HB3      CYS 108   0.436  -6.474   6.147
 1723    HB3  CYS 108           HB2      CYS 108  -0.699  -7.400   5.167
 1724    H    VAL 109           H        VAL 109   3.038  -7.799   2.851
 1725    HA   VAL 109           HA       VAL 109   1.276  -9.273   1.015
 1726    HB   VAL 109           HB       VAL 109   3.067  -9.206  -0.616
 1727   HG11  VAL 109          HG11      VAL 109   1.577  -7.294  -0.547
 1728   HG12  VAL 109          HG12      VAL 109   3.206  -6.784  -0.995
 1729   HG13  VAL 109          HG13      VAL 109   2.613  -6.505   0.644
 1730   HG21  VAL 109          HG21      VAL 109   4.990  -9.395   0.876
 1731   HG22  VAL 109          HG22      VAL 109   4.689  -7.766   1.487
 1732   HG23  VAL 109          HG23      VAL 109   5.166  -8.002  -0.194
 1733    H    CYS 110           H        CYS 110   1.556 -11.434   0.655
 1734    HA   CYS 110           HA       CYS 110   3.369 -12.852   2.438
 1735    HB2  CYS 110           HB3      CYS 110   1.127 -13.782   2.245
 1736    HB3  CYS 110           HB2      CYS 110   1.283 -13.878   0.496
 1737    H    VAL 111           H        VAL 111   5.392 -13.141   1.794
 1738    HA   VAL 111           HA       VAL 111   5.944 -13.142  -1.081
 1739    HB   VAL 111           HB       VAL 111   8.308 -12.918  -0.491
 1740   HG11  VAL 111          HG11      VAL 111   6.513 -10.983   0.966
 1741   HG12  VAL 111          HG12      VAL 111   7.030 -10.883  -0.717
 1742   HG13  VAL 111          HG13      VAL 111   8.209 -10.697   0.580
 1743   HG21  VAL 111          HG21      VAL 111   7.393 -12.943   2.380
 1744   HG22  VAL 111          HG22      VAL 111   9.037 -12.659   1.808
 1745   HG23  VAL 111          HG23      VAL 111   8.280 -14.236   1.574
 1746    H    LEU 112           H        LEU 112   7.018 -14.805  -2.118
 1747    HA   LEU 112           HA       LEU 112   6.949 -17.373  -0.675
 1748    HB2  LEU 112           HB3      LEU 112   6.576 -16.825  -3.626
 1749    HB3  LEU 112           HB2      LEU 112   6.612 -18.418  -2.900
 1750    HG   LEU 112           HG       LEU 112   4.506 -16.297  -2.436
 1751   HD11  LEU 112          HD11      LEU 112   4.323 -17.349  -4.612
 1752   HD12  LEU 112          HD12      LEU 112   3.032 -17.919  -3.553
 1753   HD13  LEU 112          HD13      LEU 112   4.426 -18.948  -3.874
 1754   HD21  LEU 112          HD21      LEU 112   3.336 -18.053  -1.168
 1755   HD22  LEU 112          HD22      LEU 112   4.847 -17.563  -0.404
 1756   HD23  LEU 112          HD23      LEU 112   4.762 -19.079  -1.302
 1757    H    SER 113           H        SER 113   8.711 -18.629  -0.686
 1758    HA   SER 113           HA       SER 113  10.926 -17.936  -2.493
 1759    HB2  SER 113           HB3      SER 113  11.425 -17.043  -0.243
 1760    HB3  SER 113           HB2      SER 113  11.161 -18.643   0.449
 1761    HG   SER 113           HG       SER 113  13.414 -17.746  -0.306
 1762    H    ARG 114           H        ARG 114  12.180 -19.728  -3.159
 1763    HA   ARG 114           HA       ARG 114  10.755 -22.236  -3.105
 1764    HB2  ARG 114           HB3      ARG 114  13.341 -21.400  -4.416
 1765    HB3  ARG 114           HB2      ARG 114  12.708 -23.033  -4.509
 1766    HG2  ARG 114           HG3      ARG 114  11.293 -20.565  -5.485
 1767    HG3  ARG 114           HG2      ARG 114  12.176 -21.709  -6.497
 1768    HD2  ARG 114           HD3      ARG 114   9.764 -22.362  -4.805
 1769    HD3  ARG 114           HD2      ARG 114   9.750 -22.098  -6.544
 1770    HE   ARG 114           HE       ARG 114  11.582 -24.154  -5.812
 1771   HH11  ARG 114          HH11      ARG 114   8.180 -23.496  -6.299
 1772   HH12  ARG 114          HH12      ARG 114   7.786 -25.136  -6.701
 1773   HH21  ARG 114          HH21      ARG 114  11.071 -26.319  -6.346
 1774   HH22  ARG 114          HH22      ARG 114   9.434 -26.740  -6.737
 1775    H    LYS 115           H        LYS 115  12.448 -20.867  -0.839
 1776    HA   LYS 115           HA       LYS 115  13.799 -21.416   0.885
 1777    HB2  LYS 115           HB3      LYS 115  13.184 -23.447   2.102
 1778    HB3  LYS 115           HB2      LYS 115  11.759 -22.606   1.528
 1779    HG2  LYS 115           HG3      LYS 115  11.410 -24.223  -0.191
 1780    HG3  LYS 115           HG2      LYS 115  12.957 -25.003   0.160
 1781    HD2  LYS 115           HD3      LYS 115  11.198 -26.303   1.149
 1782    HD3  LYS 115           HD2      LYS 115  12.097 -25.513   2.440
 1783    HE2  LYS 115           HE3      LYS 115  10.354 -23.754   2.502
 1784    HE3  LYS 115           HE2      LYS 115   9.435 -24.668   1.309
 1785    HZ1  LYS 115           HZ1      LYS 115   9.519 -26.555   2.946
 1786    HZ2  LYS 115           HZ2      LYS 115   8.557 -25.239   3.395
 1787    HZ3  LYS 115           HZ3      LYS 115  10.088 -25.446   4.091
 1788    H    ALA 116           H        ALA 116  15.055 -21.714  -1.569
 1789    HA   ALA 116           HA       ALA 116  16.984 -23.841  -0.943
 1790    HB1  ALA 116           HB1      ALA 116  17.352 -24.160  -3.339
 1791    HB2  ALA 116           HB2      ALA 116  16.107 -22.964  -3.696
 1792    HB3  ALA 116           HB3      ALA 116  15.673 -24.480  -2.907
 1793    H    THR 117           H        THR 117  18.739 -22.829  -0.217
 1794    HA   THR 117           HA       THR 117  19.374 -20.152  -1.092
 1795    HB   THR 117           HB       THR 117  21.359 -20.445   0.451
 1796    HG1  THR 117           HG1      THR 117  21.582 -22.647   0.550
 1797   HG21  THR 117          HG21      THR 117  18.606 -20.901   1.607
 1798   HG22  THR 117          HG22      THR 117  19.318 -19.339   1.200
 1799   HG23  THR 117          HG23      THR 117  20.005 -20.311   2.501
 1800    H    ARG 118           H        ARG 118  21.362 -19.555  -2.066
 1801    HA   ARG 118           HA       ARG 118  22.706 -21.728  -3.516
 1802    HB2  ARG 118           HB3      ARG 118  21.974 -19.006  -4.626
 1803    HB3  ARG 118           HB2      ARG 118  22.924 -20.215  -5.466
 1804    HG2  ARG 118           HG3      ARG 118  20.031 -20.441  -4.661
 1805    HG3  ARG 118           HG2      ARG 118  20.664 -20.227  -6.292
 1806    HD2  ARG 118           HD3      ARG 118  21.072 -22.625  -4.503
 1807    HD3  ARG 118           HD2      ARG 118  20.039 -22.544  -5.929
 1808    HE   ARG 118           HE       ARG 118  22.242 -22.046  -7.134
 1809   HH11  ARG 118          HH11      ARG 118  21.933 -24.153  -4.349
 1810   HH12  ARG 118          HH12      ARG 118  23.314 -25.116  -4.761
 1811   HH21  ARG 118          HH21      ARG 118  24.056 -23.324  -7.690
 1812   HH22  ARG 118          HH22      ARG 118  24.527 -24.638  -6.660
  Start of MODEL    2
    1    H1   SER   1           H1       SER   1  19.534   4.325   4.155
    2    H2   SER   1           H2       SER   1  20.924   4.372   3.201
    3    H3   SER   1           H3       SER   1  21.027   3.904   4.821
    4    HA   SER   1           HA       SER   1  19.711   1.954   4.375
    5    HB2  SER   1           HB3      SER   1  19.384   1.428   1.882
    6    HB3  SER   1           HB2      SER   1  18.320   2.640   2.589
    7    HG   SER   1           HG       SER   1  19.040   3.584   0.770
    8    H    SER   2           H        SER   2  21.035   0.243   4.526
    9    HA   SER   2           HA       SER   2  23.472   0.196   2.904
   10    HB2  SER   2           HB3      SER   2  24.740  -0.564   4.972
   11    HB3  SER   2           HB2      SER   2  24.274   1.136   4.943
   12    HG   SER   2           HG       SER   2  22.819   0.794   6.487
   13    H    THR   3           H        THR   3  22.205  -1.773   5.592
   14    HA   THR   3           HA       THR   3  22.704  -4.151   3.992
   15    HB   THR   3           HB       THR   3  21.923  -5.237   6.264
   16    HG1  THR   3           HG1      THR   3  23.091  -3.192   7.609
   17   HG21  THR   3          HG21      THR   3  24.153  -5.453   5.318
   18   HG22  THR   3          HG22      THR   3  24.252  -5.136   7.049
   19   HG23  THR   3          HG23      THR   3  24.574  -3.843   5.896
   20    H    HIS   4           H        HIS   4  21.223  -5.463   3.189
   21    HA   HIS   4           HA       HIS   4  18.553  -5.593   4.202
   22    HB2  HIS   4           HB3      HIS   4  17.462  -5.073   1.997
   23    HB3  HIS   4           HB2      HIS   4  18.174  -3.678   2.793
   24    HD1  HIS   4           HD1      HIS   4  20.436  -2.765   1.726
   25    HD2  HIS   4           HD2      HIS   4  18.392  -5.589  -0.534
   26    HE1  HIS   4           HE1      HIS   4  21.404  -2.610  -0.586
   27    HE2  HIS   4           HE2      HIS   4  20.218  -4.393  -1.915
   28    HA   PRO   5           HA       PRO   5  20.271  -9.565   2.824
   29    HB2  PRO   5           HB3      PRO   5  18.546 -11.094   4.292
   30    HB3  PRO   5           HB2      PRO   5  20.018 -10.374   4.957
   31    HG2  PRO   5           HG3      PRO   5  17.186  -9.413   5.128
   32    HG3  PRO   5           HG2      PRO   5  18.428  -9.455   6.394
   33    HD2  PRO   5           HD3      PRO   5  17.803  -7.189   5.078
   34    HD3  PRO   5           HD2      PRO   5  19.463  -7.529   5.609
   35    H    VAL   6           H        VAL   6  19.572  -9.446   0.684
   36    HA   VAL   6           HA       VAL   6  18.281  -9.815  -1.159
   37    HB   VAL   6           HB       VAL   6  16.825 -11.869   0.507
   38   HG11  VAL   6          HG11      VAL   6  16.670 -13.077  -1.637
   39   HG12  VAL   6          HG12      VAL   6  17.456 -11.715  -2.438
   40   HG13  VAL   6          HG13      VAL   6  15.874 -11.504  -1.686
   41   HG21  VAL   6          HG21      VAL   6  18.559 -13.478  -0.175
   42   HG22  VAL   6          HG22      VAL   6  19.194 -12.207   0.868
   43   HG23  VAL   6          HG23      VAL   6  19.493 -12.154  -0.869
   44    H    PHE   7           H        PHE   7  17.538  -7.639   0.008
   45    HA   PHE   7           HA       PHE   7  15.914  -6.098   0.340
   46    HB2  PHE   7           HB3      PHE   7  14.076  -8.237  -0.751
   47    HB3  PHE   7           HB2      PHE   7  13.582  -6.589  -0.403
   48    HD1  PHE   7           HD1      PHE   7  14.609  -8.752  -2.918
   49    HD2  PHE   7           HD2      PHE   7  15.130  -4.752  -1.561
   50    HE1  PHE   7           HE1      PHE   7  15.278  -8.077  -5.184
   51    HE2  PHE   7           HE2      PHE   7  15.800  -4.067  -3.827
   52    HZ   PHE   7           HZ       PHE   7  15.874  -5.726  -5.643
   53    H    HIS   8           H        HIS   8  14.204  -9.110   1.101
   54    HA   HIS   8           HA       HIS   8  14.338  -8.607   3.941
   55    HB2  HIS   8           HB3      HIS   8  12.359  -7.251   2.948
   56    HB3  HIS   8           HB2      HIS   8  11.591  -8.813   2.714
   57    HD1  HIS   8           HD1      HIS   8  11.674  -6.142   5.018
   58    HD2  HIS   8           HD2      HIS   8  11.540 -10.279   5.389
   59    HE1  HIS   8           HE1      HIS   8  10.803  -6.584   7.334
   60    HE2  HIS   8           HE2      HIS   8  10.551  -9.088   7.460
   61    H    MET   9           H        MET   9  15.543 -10.574   2.864
   62    HA   MET   9           HA       MET   9  15.879 -12.803   2.956
   63    HB2  MET   9           HB3      MET   9  13.097 -12.919   4.129
   64    HB3  MET   9           HB2      MET   9  14.141 -14.318   3.938
   65    HG2  MET   9           HG3      MET   9  15.805 -13.254   5.408
   66    HG3  MET   9           HG2      MET   9  14.715 -11.889   5.626
   67    HE1  MET   9           HE1      MET   9  13.743 -16.174   7.045
   68    HE2  MET   9           HE2      MET   9  15.222 -15.740   6.189
   69    HE3  MET   9           HE3      MET   9  13.671 -15.681   5.353
   70    H    GLY  10           H        GLY  10  12.601 -12.059   1.787
   71    HA2  GLY  10           HA3      GLY  10  13.219 -12.839  -0.858
   72    HA3  GLY  10           HA2      GLY  10  12.393 -14.159  -0.046
   73    H    GLU  11           H        GLU  11  12.107 -10.758  -0.970
   74    HA   GLU  11           HA       GLU  11   9.284 -10.721  -0.359
   75    HB2  GLU  11           HB3      GLU  11  11.047  -8.676  -1.728
   76    HB3  GLU  11           HB2      GLU  11   9.341  -8.432  -1.369
   77    HG2  GLU  11           HG3      GLU  11   9.889  -8.771   1.048
   78    HG3  GLU  11           HG2      GLU  11  11.595  -8.786   0.598
   79    H    PHE  12           H        PHE  12   9.451 -12.763  -1.950
   80    HA   PHE  12           HA       PHE  12   8.966 -11.959  -4.700
   81    HB2  PHE  12           HB3      PHE  12   8.892 -14.675  -3.361
   82    HB3  PHE  12           HB2      PHE  12   8.578 -14.408  -5.073
   83    HD1  PHE  12           HD1      PHE  12  11.163 -14.260  -2.440
   84    HD2  PHE  12           HD2      PHE  12  10.338 -14.057  -6.611
   85    HE1  PHE  12           HE1      PHE  12  13.568 -14.428  -2.924
   86    HE2  PHE  12           HE2      PHE  12  12.742 -14.223  -7.097
   87    HZ   PHE  12           HZ       PHE  12  14.360 -14.410  -5.253
   88    H    SER  13           H        SER  13   7.126 -10.773  -4.674
   89    HA   SER  13           HA       SER  13   4.811 -11.274  -3.203
   90    HB2  SER  13           HB3      SER  13   5.243  -9.124  -4.312
   91    HB3  SER  13           HB2      SER  13   5.095  -9.894  -5.888
   92    HG   SER  13           HG       SER  13   3.030  -9.640  -5.750
   93    H    VAL  14           H        VAL  14   3.246 -12.714  -3.380
   94    HA   VAL  14           HA       VAL  14   3.281 -14.865  -5.157
   95    HB   VAL  14           HB       VAL  14   0.925 -15.294  -4.422
   96   HG11  VAL  14          HG11      VAL  14   2.952 -14.703  -2.277
   97   HG12  VAL  14          HG12      VAL  14   2.735 -16.220  -3.153
   98   HG13  VAL  14          HG13      VAL  14   1.488 -15.655  -2.041
   99   HG21  VAL  14          HG21      VAL  14  -0.048 -13.898  -2.672
  100   HG22  VAL  14          HG22      VAL  14   0.190 -12.975  -4.155
  101   HG23  VAL  14          HG23      VAL  14   1.304 -12.775  -2.802
  102    H    CYS  15           H        CYS  15   1.761 -11.734  -5.403
  103    HA   CYS  15           HA       CYS  15   0.603 -12.539  -7.982
  104    HB2  CYS  15           HB3      CYS  15  -1.091 -11.798  -6.381
  105    HB3  CYS  15           HB2      CYS  15  -0.221 -10.281  -6.140
  106    H    ASP  16           H        ASP  16   1.083 -11.403  -9.788
  107    HA   ASP  16           HA       ASP  16   3.351  -9.588  -9.606
  108    HB2  ASP  16           HB3      ASP  16   3.211 -11.451 -11.338
  109    HB3  ASP  16           HB2      ASP  16   1.948 -10.505 -12.126
  110    H    SER  17           H        SER  17   3.060  -7.490  -9.448
  111    HA   SER  17           HA       SER  17   0.668  -6.292 -10.651
  112    HB2  SER  17           HB3      SER  17   0.713  -4.744  -8.581
  113    HB3  SER  17           HB2      SER  17   0.076  -6.379  -8.368
  114    HG   SER  17           HG       SER  17   1.919  -6.975  -7.348
  115    H    VAL  18           H        VAL  18   0.858  -3.931 -10.921
  116    HA   VAL  18           HA       VAL  18   3.646  -3.177 -11.471
  117    HB   VAL  18           HB       VAL  18   2.416  -3.159 -13.507
  118   HG11  VAL  18          HG11      VAL  18   0.162  -3.188 -12.660
  119   HG12  VAL  18          HG12      VAL  18   0.342  -1.872 -13.822
  120   HG13  VAL  18          HG13      VAL  18   0.321  -1.525 -12.092
  121   HG21  VAL  18          HG21      VAL  18   2.485  -0.807 -14.181
  122   HG22  VAL  18          HG22      VAL  18   3.901  -1.264 -13.235
  123   HG23  VAL  18          HG23      VAL  18   2.602  -0.333 -12.487
  124    H    SER  19           H        SER  19   4.479  -1.850 -10.031
  125    HA   SER  19           HA       SER  19   2.690  -0.081  -8.505
  126    HB2  SER  19           HB3      SER  19   3.856  -1.880  -7.189
  127    HB3  SER  19           HB2      SER  19   5.398  -1.151  -7.653
  128    HG   SER  19           HG       SER  19   3.336  -0.063  -6.039
  129    H    VAL  20           H        VAL  20   2.792   1.880  -9.360
  130    HA   VAL  20           HA       VAL  20   5.435   2.965 -10.075
  131    HB   VAL  20           HB       VAL  20   2.857   3.331 -11.610
  132   HG11  VAL  20          HG11      VAL  20   4.209   4.605 -13.213
  133   HG12  VAL  20          HG12      VAL  20   5.589   4.493 -12.119
  134   HG13  VAL  20          HG13      VAL  20   4.145   5.379 -11.629
  135   HG21  VAL  20          HG21      VAL  20   3.967   2.148 -13.409
  136   HG22  VAL  20          HG22      VAL  20   3.933   1.151 -11.953
  137   HG23  VAL  20          HG23      VAL  20   5.420   1.974 -12.424
  138    H    TRP  21           H        TRP  21   5.825   5.033  -9.456
  139    HA   TRP  21           HA       TRP  21   3.815   6.421  -7.894
  140    HB2  TRP  21           HB3      TRP  21   6.701   7.031  -8.571
  141    HB3  TRP  21           HB2      TRP  21   5.670   8.174  -7.716
  142    HD1  TRP  21           HD1      TRP  21   7.413   4.785  -7.249
  143    HE1  TRP  21           HE1      TRP  21   7.505   4.253  -4.732
  144    HE3  TRP  21           HE3      TRP  21   4.512   8.620  -5.495
  145    HZ2  TRP  21           HZ2      TRP  21   6.486   5.316  -2.326
  146    HZ3  TRP  21           HZ3      TRP  21   4.120   8.788  -3.070
  147    HH2  TRP  21           HH2      TRP  21   5.086   7.170  -1.522
  148    H    VAL  22           H        VAL  22   2.249   7.113  -9.196
  149    HA   VAL  22           HA       VAL  22   2.871   8.153 -11.843
  150    HB   VAL  22           HB       VAL  22   0.212   7.582 -10.525
  151   HG11  VAL  22          HG11      VAL  22  -0.736   7.754 -12.774
  152   HG12  VAL  22          HG12      VAL  22   0.839   8.243 -13.397
  153   HG13  VAL  22          HG13      VAL  22  -0.017   9.278 -12.254
  154   HG21  VAL  22          HG21      VAL  22   1.506   5.563 -10.870
  155   HG22  VAL  22          HG22      VAL  22   1.787   6.009 -12.553
  156   HG23  VAL  22          HG23      VAL  22   0.157   5.623 -12.003
  157    H    GLY  23           H        GLY  23   3.189  10.251 -12.127
  158    HA2  GLY  23           HA3      GLY  23   1.848  12.144 -10.303
  159    HA3  GLY  23           HA2      GLY  23   3.318  12.488 -11.215
  160    H    ASP  24           H        ASP  24   0.972  10.740 -12.929
  161    HA   ASP  24           HA       ASP  24   0.047  13.203 -14.250
  162    HB2  ASP  24           HB3      ASP  24   0.750  10.548 -15.522
  163    HB3  ASP  24           HB2      ASP  24  -0.057  11.865 -16.369
  164    H    LYS  25           H        LYS  25  -1.108  11.360 -12.120
  165    HA   LYS  25           HA       LYS  25  -3.420  10.210 -13.389
  166    HB2  LYS  25           HB3      LYS  25  -2.384   9.302 -11.283
  167    HB3  LYS  25           HB2      LYS  25  -2.960  10.735 -10.444
  168    HG2  LYS  25           HG3      LYS  25  -5.239  10.135 -10.835
  169    HG3  LYS  25           HG2      LYS  25  -4.758   8.799 -11.883
  170    HD2  LYS  25           HD3      LYS  25  -3.617   7.761  -9.926
  171    HD3  LYS  25           HD2      LYS  25  -4.277   9.049  -8.918
  172    HE2  LYS  25           HE3      LYS  25  -6.534   8.362  -9.439
  173    HE3  LYS  25           HE2      LYS  25  -5.940   7.147 -10.573
  174    HZ1  LYS  25           HZ1      LYS  25  -5.590   7.163  -7.630
  175    HZ2  LYS  25           HZ2      LYS  25  -4.821   6.061  -8.658
  176    HZ3  LYS  25           HZ3      LYS  25  -6.513   6.079  -8.539
  177    H    THR  26           H        THR  26  -4.795  11.612 -14.304
  178    HA   THR  26           HA       THR  26  -5.086  14.263 -13.132
  179    HB   THR  26           HB       THR  26  -4.562  14.147 -15.518
  180    HG1  THR  26           HG1      THR  26  -6.744  15.413 -14.460
  181   HG21  THR  26          HG21      THR  26  -6.242  13.348 -17.124
  182   HG22  THR  26          HG22      THR  26  -7.236  12.774 -15.784
  183   HG23  THR  26          HG23      THR  26  -5.657  12.050 -16.084
  184    H    THR  27           H        THR  27  -6.801  11.336 -13.149
  185    HA   THR  27           HA       THR  27  -9.142  12.764 -12.110
  186    HB   THR  27           HB       THR  27 -10.541  10.855 -13.131
  187    HG1  THR  27           HG1      THR  27  -8.585  10.823 -15.159
  188   HG21  THR  27          HG21      THR  27 -10.765  13.161 -13.831
  189   HG22  THR  27          HG22      THR  27 -10.808  12.106 -15.243
  190   HG23  THR  27          HG23      THR  27  -9.344  13.015 -14.866
  191    H    ALA  28           H        ALA  28  -9.895  12.016 -10.237
  192    HA   ALA  28           HA       ALA  28  -9.423   9.235  -9.498
  193    HB1  ALA  28           HB1      ALA  28  -8.428   9.758  -7.364
  194    HB2  ALA  28           HB2      ALA  28  -8.531  11.486  -7.705
  195    HB3  ALA  28           HB3      ALA  28  -7.453  10.462  -8.656
  196    H    THR  29           H        THR  29 -10.707   8.560  -7.671
  197    HA   THR  29           HA       THR  29 -13.213  10.063  -7.608
  198    HB   THR  29           HB       THR  29 -12.700   7.243  -6.661
  199    HG1  THR  29           HG1      THR  29 -12.574   8.076  -9.106
  200   HG21  THR  29          HG21      THR  29 -15.256   8.698  -7.348
  201   HG22  THR  29          HG22      THR  29 -14.714   8.269  -5.726
  202   HG23  THR  29          HG23      THR  29 -15.131   7.003  -6.881
  203    H    ASP  30           H        ASP  30 -13.717  11.244  -5.918
  204    HA   ASP  30           HA       ASP  30 -12.328  11.255  -3.446
  205    HB2  ASP  30           HB3      ASP  30 -13.594  13.213  -4.289
  206    HB3  ASP  30           HB2      ASP  30 -15.098  12.306  -4.135
  207    H    ILE  31           H        ILE  31 -13.282  10.729  -1.360
  208    HA   ILE  31           HA       ILE  31 -13.979   8.034  -1.189
  209    HB   ILE  31           HB       ILE  31 -12.828   9.299   0.586
  210   HG12  ILE  31          HG13      ILE  31 -15.413   8.062   1.561
  211   HG13  ILE  31          HG12      ILE  31 -13.971   7.160   1.112
  212   HG21  ILE  31          HG21      ILE  31 -14.078  11.370   0.481
  213   HG22  ILE  31          HG22      ILE  31 -14.110  10.722   2.120
  214   HG23  ILE  31          HG23      ILE  31 -15.524  10.555   1.080
  215   HD11  ILE  31          HD11      ILE  31 -12.732   8.262   2.907
  216   HD12  ILE  31          HD12      ILE  31 -14.139   7.385   3.512
  217   HD13  ILE  31          HD13      ILE  31 -14.190   9.141   3.362
  218    H    LYS  32           H        LYS  32 -15.982  10.775  -1.701
  219    HA   LYS  32           HA       LYS  32 -18.400   9.489  -0.740
  220    HB2  LYS  32           HB3      LYS  32 -18.077  12.058  -2.291
  221    HB3  LYS  32           HB2      LYS  32 -19.511  11.537  -1.410
  222    HG2  LYS  32           HG3      LYS  32 -18.363  11.731   0.682
  223    HG3  LYS  32           HG2      LYS  32 -16.838  12.066  -0.137
  224    HD2  LYS  32           HD3      LYS  32 -18.112  14.056  -1.173
  225    HD3  LYS  32           HD2      LYS  32 -19.254  13.806   0.152
  226    HE2  LYS  32           HE3      LYS  32 -17.682  15.415   0.901
  227    HE3  LYS  32           HE2      LYS  32 -17.289  13.899   1.712
  228    HZ1  LYS  32           HZ1      LYS  32 -15.872  15.183  -0.542
  229    HZ2  LYS  32           HZ2      LYS  32 -15.635  13.555  -0.158
  230    HZ3  LYS  32           HZ3      LYS  32 -15.259  14.755   0.975
  231    H    GLY  33           H        GLY  33 -16.554   9.406  -3.548
  232    HA2  GLY  33           HA3      GLY  33 -17.113   7.871  -5.293
  233    HA3  GLY  33           HA2      GLY  33 -18.816   8.196  -4.991
  234    H    LYS  34           H        LYS  34 -16.742  10.928  -5.083
  235    HA   LYS  34           HA       LYS  34 -17.922  11.708  -7.648
  236    HB2  LYS  34           HB3      LYS  34 -16.444  13.375  -5.606
  237    HB3  LYS  34           HB2      LYS  34 -17.259  13.988  -7.034
  238    HG2  LYS  34           HG3      LYS  34 -18.582  12.620  -4.707
  239    HG3  LYS  34           HG2      LYS  34 -18.565  14.351  -5.015
  240    HD2  LYS  34           HD3      LYS  34 -19.727  13.934  -7.163
  241    HD3  LYS  34           HD2      LYS  34 -19.825  12.227  -6.728
  242    HE2  LYS  34           HE3      LYS  34 -21.909  13.312  -6.186
  243    HE3  LYS  34           HE2      LYS  34 -21.082  12.839  -4.705
  244    HZ1  LYS  34           HZ1      LYS  34 -21.126  15.567  -5.875
  245    HZ2  LYS  34           HZ2      LYS  34 -20.304  15.120  -4.470
  246    HZ3  LYS  34           HZ3      LYS  34 -21.991  15.055  -4.513
  247    H    GLU  35           H        GLU  35 -16.722  11.593  -9.442
  248    HA   GLU  35           HA       GLU  35 -13.866  11.167  -9.242
  249    HB2  GLU  35           HB3      GLU  35 -15.170   9.863 -10.853
  250    HB3  GLU  35           HB2      GLU  35 -15.668  11.344 -11.657
  251    HG2  GLU  35           HG3      GLU  35 -13.451  11.777 -12.403
  252    HG3  GLU  35           HG2      GLU  35 -12.804  10.472 -11.411
  253    H    VAL  36           H        VAL  36 -12.498  12.775  -9.133
  254    HA   VAL  36           HA       VAL  36 -13.286  15.388 -10.235
  255    HB   VAL  36           HB       VAL  36 -11.891  16.409  -8.447
  256   HG11  VAL  36          HG11      VAL  36 -13.479  16.020  -6.617
  257   HG12  VAL  36          HG12      VAL  36 -14.124  14.626  -7.485
  258   HG13  VAL  36          HG13      VAL  36 -14.299  16.247  -8.161
  259   HG21  VAL  36          HG21      VAL  36 -11.806  13.606  -7.335
  260   HG22  VAL  36          HG22      VAL  36 -11.217  15.061  -6.532
  261   HG23  VAL  36          HG23      VAL  36 -10.435  14.491  -8.006
  262    H    THR  37           H        THR  37 -11.498  16.803 -10.806
  263    HA   THR  37           HA       THR  37  -9.463  15.353 -12.269
  264    HB   THR  37           HB       THR  37  -9.921  18.334 -12.161
  265    HG1  THR  37           HG1      THR  37 -10.943  16.527 -14.112
  266   HG21  THR  37          HG21      THR  37  -7.773  17.675 -13.104
  267   HG22  THR  37          HG22      THR  37  -8.834  18.301 -14.367
  268   HG23  THR  37          HG23      THR  37  -8.583  16.563 -14.207
  269    H    VAL  38           H        VAL  38  -7.553  14.958 -11.411
  270    HA   VAL  38           HA       VAL  38  -6.813  16.215  -8.912
  271    HB   VAL  38           HB       VAL  38  -5.387  14.045 -10.456
  272   HG11  VAL  38          HG11      VAL  38  -5.145  14.875  -7.569
  273   HG12  VAL  38          HG12      VAL  38  -3.963  15.199  -8.839
  274   HG13  VAL  38          HG13      VAL  38  -4.297  13.538  -8.345
  275   HG21  VAL  38          HG21      VAL  38  -7.370  13.815  -8.199
  276   HG22  VAL  38          HG22      VAL  38  -6.456  12.483  -8.904
  277   HG23  VAL  38          HG23      VAL  38  -7.644  13.350  -9.877
  278    H    LEU  39           H        LEU  39  -5.200  17.640  -8.617
  279    HA   LEU  39           HA       LEU  39  -3.760  18.614 -10.954
  280    HB2  LEU  39           HB3      LEU  39  -3.742  19.643  -8.109
  281    HB3  LEU  39           HB2      LEU  39  -3.056  20.449  -9.509
  282    HG   LEU  39           HG       LEU  39  -5.996  19.901  -9.096
  283   HD11  LEU  39          HD11      LEU  39  -6.189  22.306  -8.738
  284   HD12  LEU  39          HD12      LEU  39  -4.435  22.465  -8.847
  285   HD13  LEU  39          HD13      LEU  39  -5.158  21.553  -7.520
  286   HD21  LEU  39          HD21      LEU  39  -4.543  21.475 -11.215
  287   HD22  LEU  39          HD22      LEU  39  -6.293  21.410 -11.006
  288   HD23  LEU  39          HD23      LEU  39  -5.404  19.952 -11.444
  289    H    ALA  40           H        ALA  40  -1.668  18.147 -11.317
  290    HA   ALA  40           HA       ALA  40  -0.583  15.946  -9.851
  291    HB1  ALA  40           HB1      ALA  40   0.628  17.510 -12.120
  292    HB2  ALA  40           HB2      ALA  40  -0.427  16.109 -12.292
  293    HB3  ALA  40           HB3      ALA  40   1.156  15.934 -11.536
  294    H    GLU  41           H        GLU  41  -0.381  19.257  -9.371
  295    HA   GLU  41           HA       GLU  41   2.032  18.883  -7.777
  296    HB2  GLU  41           HB3      GLU  41   2.889  21.100  -8.611
  297    HB3  GLU  41           HB2      GLU  41   2.934  19.786  -9.777
  298    HG2  GLU  41           HG3      GLU  41   0.850  20.639 -10.772
  299    HG3  GLU  41           HG2      GLU  41   0.905  22.001  -9.652
  300    H    VAL  42           H        VAL  42   1.359  19.264  -5.807
  301    HA   VAL  42           HA       VAL  42   0.750  21.992  -5.161
  302    HB   VAL  42           HB       VAL  42  -1.521  21.268  -5.335
  303   HG11  VAL  42          HG11      VAL  42  -0.769  18.917  -3.610
  304   HG12  VAL  42          HG12      VAL  42  -1.231  18.873  -5.312
  305   HG13  VAL  42          HG13      VAL  42  -2.413  19.343  -4.088
  306   HG21  VAL  42          HG21      VAL  42  -0.640  21.290  -2.455
  307   HG22  VAL  42          HG22      VAL  42  -2.309  21.470  -2.995
  308   HG23  VAL  42          HG23      VAL  42  -1.105  22.680  -3.437
  309    H    ASN  43           H        ASN  43   2.633  22.164  -4.090
  310    HA   ASN  43           HA       ASN  43   2.890  20.661  -1.607
  311    HB2  ASN  43           HB3      ASN  43   5.038  20.779  -3.733
  312    HB3  ASN  43           HB2      ASN  43   5.351  20.317  -2.064
  313   HD21  ASN  43          HD21      ASN  43   4.165  19.318  -5.123
  314   HD22  ASN  43          HD22      ASN  43   3.808  17.685  -4.684
  315    H    ILE  44           H        ILE  44   2.982  22.191  -0.107
  316    HA   ILE  44           HA       ILE  44   3.895  23.820   1.189
  317    HB   ILE  44           HB       ILE  44   5.997  24.046  -0.974
  318   HG12  ILE  44          HG13      ILE  44   6.100  22.585   1.678
  319   HG13  ILE  44          HG12      ILE  44   5.838  21.805   0.119
  320   HG21  ILE  44          HG21      ILE  44   5.841  26.050   0.434
  321   HG22  ILE  44          HG22      ILE  44   7.349  25.175   0.702
  322   HG23  ILE  44          HG23      ILE  44   6.036  25.048   1.871
  323   HD11  ILE  44          HD11      ILE  44   8.041  22.568  -0.623
  324   HD12  ILE  44          HD12      ILE  44   8.146  21.579   0.832
  325   HD13  ILE  44          HD13      ILE  44   8.301  23.332   0.944
  326    H    ASN  45           H        ASN  45   3.229  25.848   1.499
  327    HA   ASN  45           HA       ASN  45   2.265  27.372  -0.784
  328    HB2  ASN  45           HB3      ASN  45   2.034  27.721   2.201
  329    HB3  ASN  45           HB2      ASN  45   1.623  29.037   1.108
  330   HD21  ASN  45          HD21      ASN  45   1.074  25.632   0.423
  331   HD22  ASN  45          HD22      ASN  45  -0.653  25.716   0.471
  332    H    ASN  46           H        ASN  46   4.654  27.332  -1.412
  333    HA   ASN  46           HA       ASN  46   5.681  29.966  -1.112
  334    HB2  ASN  46           HB3      ASN  46   6.488  29.012   1.038
  335    HB3  ASN  46           HB2      ASN  46   7.343  27.761   0.139
  336   HD21  ASN  46          HD21      ASN  46   9.254  28.255  -0.880
  337   HD22  ASN  46          HD22      ASN  46  10.062  29.772  -0.685
  338    H    SER  47           H        SER  47   6.833  26.650  -1.764
  339    HA   SER  47           HA       SER  47   7.263  27.455  -4.549
  340    HB2  SER  47           HB3      SER  47   9.461  27.470  -3.323
  341    HB3  SER  47           HB2      SER  47   9.224  25.758  -2.974
  342    HG   SER  47           HG       SER  47   9.823  27.035  -5.386
  343    H    VAL  48           H        VAL  48   6.021  26.189  -5.754
  344    HA   VAL  48           HA       VAL  48   5.059  23.682  -4.586
  345    HB   VAL  48           HB       VAL  48   3.920  25.386  -6.803
  346   HG11  VAL  48          HG11      VAL  48   1.981  23.879  -6.741
  347   HG12  VAL  48          HG12      VAL  48   2.849  22.829  -5.624
  348   HG13  VAL  48          HG13      VAL  48   3.449  23.054  -7.264
  349   HG21  VAL  48          HG21      VAL  48   3.639  26.353  -4.594
  350   HG22  VAL  48          HG22      VAL  48   2.954  24.841  -4.000
  351   HG23  VAL  48          HG23      VAL  48   2.091  25.782  -5.216
  352    H    PHE  49           H        PHE  49   6.020  21.902  -5.242
  353    HA   PHE  49           HA       PHE  49   6.762  21.676  -8.077
  354    HB2  PHE  49           HB3      PHE  49   8.259  19.809  -7.377
  355    HB3  PHE  49           HB2      PHE  49   8.707  21.356  -6.670
  356    HD1  PHE  49           HD1      PHE  49   8.224  21.790  -4.262
  357    HD2  PHE  49           HD2      PHE  49   7.657  17.964  -6.044
  358    HE1  PHE  49           HE1      PHE  49   8.228  20.749  -2.028
  359    HE2  PHE  49           HE2      PHE  49   7.651  16.923  -3.817
  360    HZ   PHE  49           HZ       PHE  49   7.937  18.314  -1.807
  361    H    ARG  50           H        ARG  50   6.694  19.185  -8.727
  362    HA   ARG  50           HA       ARG  50   3.883  18.535  -8.465
  363    HB2  ARG  50           HB3      ARG  50   4.251  16.928 -10.254
  364    HB3  ARG  50           HB2      ARG  50   4.936  18.487 -10.687
  365    HG2  ARG  50           HG3      ARG  50   7.163  17.662 -10.131
  366    HG3  ARG  50           HG2      ARG  50   6.472  16.107  -9.672
  367    HD2  ARG  50           HD3      ARG  50   5.709  15.729 -11.926
  368    HD3  ARG  50           HD2      ARG  50   6.241  17.339 -12.411
  369    HE   ARG  50           HE       ARG  50   8.507  16.180 -11.470
  370   HH11  ARG  50          HH11      ARG  50   6.126  15.249 -13.862
  371   HH12  ARG  50          HH12      ARG  50   7.259  14.371 -14.834
  372   HH21  ARG  50          HH21      ARG  50  10.006  15.032 -12.752
  373   HH22  ARG  50          HH22      ARG  50   9.468  14.241 -14.200
  374    H    GLN  51           H        GLN  51   3.173  16.297  -8.139
  375    HA   GLN  51           HA       GLN  51   4.909  14.847  -6.250
  376    HB2  GLN  51           HB3      GLN  51   2.818  14.298  -4.962
  377    HB3  GLN  51           HB2      GLN  51   3.304  15.986  -4.885
  378    HG2  GLN  51           HG3      GLN  51   1.608  16.609  -6.463
  379    HG3  GLN  51           HG2      GLN  51   1.193  14.919  -6.747
  380   HE21  GLN  51          HE21      GLN  51  -0.015  13.813  -5.240
  381   HE22  GLN  51          HE22      GLN  51  -0.858  14.614  -3.955
  382    H    TYR  52           H        TYR  52   4.169  12.569  -5.920
  383    HA   TYR  52           HA       TYR  52   2.908  11.487  -8.352
  384    HB2  TYR  52           HB3      TYR  52   5.149  10.178  -6.790
  385    HB3  TYR  52           HB2      TYR  52   4.415   9.584  -8.274
  386    HD1  TYR  52           HD1      TYR  52   4.627  11.168 -10.350
  387    HD2  TYR  52           HD2      TYR  52   7.090  11.416  -6.892
  388    HE1  TYR  52           HE1      TYR  52   6.333  12.360 -11.654
  389    HE2  TYR  52           HE2      TYR  52   8.800  12.612  -8.190
  390    HH   TYR  52           HH       TYR  52   8.196  13.900 -11.266
  391    H    PHE  53           H        PHE  53   1.648   9.620  -8.069
  392    HA   PHE  53           HA       PHE  53   0.833   9.102  -5.292
  393    HB2  PHE  53           HB3      PHE  53  -0.645   8.549  -7.882
  394    HB3  PHE  53           HB2      PHE  53  -1.262   8.222  -6.263
  395    HD1  PHE  53           HD1      PHE  53  -1.524  10.204  -4.684
  396    HD2  PHE  53           HD2      PHE  53  -0.986  10.620  -8.881
  397    HE1  PHE  53           HE1      PHE  53  -2.456  12.474  -4.569
  398    HE2  PHE  53           HE2      PHE  53  -1.914  12.895  -8.778
  399    HZ   PHE  53           HZ       PHE  53  -2.647  13.826  -6.619
  400    H    PHE  54           H        PHE  54   0.741   7.009  -4.527
  401    HA   PHE  54           HA       PHE  54   2.520   5.143  -5.847
  402    HB2  PHE  54           HB3      PHE  54   2.630   5.582  -3.389
  403    HB3  PHE  54           HB2      PHE  54   1.019   4.900  -3.220
  404    HD1  PHE  54           HD1      PHE  54   0.765   2.641  -2.778
  405    HD2  PHE  54           HD2      PHE  54   4.440   4.050  -4.395
  406    HE1  PHE  54           HE1      PHE  54   1.756   0.417  -2.445
  407    HE2  PHE  54           HE2      PHE  54   5.440   1.827  -4.070
  408    HZ   PHE  54           HZ       PHE  54   4.102   0.006  -3.093
  409    H    GLU  55           H        GLU  55   1.473   4.305  -7.602
  410    HA   GLU  55           HA       GLU  55  -1.191   3.123  -7.178
  411    HB2  GLU  55           HB3      GLU  55   0.205   3.952  -9.735
  412    HB3  GLU  55           HB2      GLU  55  -1.383   3.200  -9.656
  413    HG2  GLU  55           HG3      GLU  55  -1.088   5.621  -8.015
  414    HG3  GLU  55           HG2      GLU  55  -0.940   5.876  -9.753
  415    H    THR  56           H        THR  56  -0.963   1.075  -6.605
  416    HA   THR  56           HA       THR  56   0.863  -0.638  -8.163
  417    HB   THR  56           HB       THR  56  -0.324  -1.211  -5.436
  418    HG1  THR  56           HG1      THR  56   1.188   0.152  -4.829
  419   HG21  THR  56          HG21      THR  56   0.233  -3.225  -6.703
  420   HG22  THR  56          HG22      THR  56   1.363  -3.003  -5.366
  421   HG23  THR  56          HG23      THR  56   1.854  -2.600  -7.010
  422    H    LYS  57           H        LYS  57  -0.351  -1.370  -9.817
  423    HA   LYS  57           HA       LYS  57  -3.130  -2.139  -9.254
  424    HB2  LYS  57           HB3      LYS  57  -2.707  -0.349 -10.944
  425    HB3  LYS  57           HB2      LYS  57  -1.841  -1.526 -11.919
  426    HG2  LYS  57           HG3      LYS  57  -3.836  -2.802 -12.266
  427    HG3  LYS  57           HG2      LYS  57  -4.731  -1.798 -11.125
  428    HD2  LYS  57           HD3      LYS  57  -3.487  -0.783 -13.673
  429    HD3  LYS  57           HD2      LYS  57  -5.179  -1.253 -13.509
  430    HE2  LYS  57           HE3      LYS  57  -5.531   0.460 -11.845
  431    HE3  LYS  57           HE2      LYS  57  -3.823   0.884 -11.878
  432    HZ1  LYS  57           HZ1      LYS  57  -5.724   1.181 -14.133
  433    HZ2  LYS  57           HZ2      LYS  57  -4.082   1.571 -14.180
  434    HZ3  LYS  57           HZ3      LYS  57  -5.125   2.432 -13.170
  435    H    CYS  58           H        CYS  58  -3.887  -4.122  -9.709
  436    HA   CYS  58           HA       CYS  58  -2.022  -6.263 -10.003
  437    HB2  CYS  58           HB3      CYS  58  -5.050  -6.294 -10.050
  438    HB3  CYS  58           HB2      CYS  58  -4.014  -7.705  -9.874
  439    H    ARG  59           H        ARG  59  -1.137  -6.751 -11.886
  440    HA   ARG  59           HA       ARG  59  -2.658  -6.283 -14.351
  441    HB2  ARG  59           HB3      ARG  59  -0.476  -6.366 -15.492
  442    HB3  ARG  59           HB2      ARG  59  -0.512  -5.139 -14.235
  443    HG2  ARG  59           HG3      ARG  59   0.688  -6.641 -12.736
  444    HG3  ARG  59           HG2      ARG  59   0.736  -7.865 -14.004
  445    HD2  ARG  59           HD3      ARG  59   1.951  -5.114 -14.186
  446    HD3  ARG  59           HD2      ARG  59   2.835  -6.587 -13.817
  447    HE   ARG  59           HE       ARG  59   1.365  -6.660 -16.300
  448   HH11  ARG  59          HH11      ARG  59   4.405  -5.909 -14.735
  449   HH12  ARG  59          HH12      ARG  59   5.332  -6.020 -16.196
  450   HH21  ARG  59          HH21      ARG  59   2.582  -6.810 -18.229
  451   HH22  ARG  59          HH22      ARG  59   4.293  -6.527 -18.185
  452    H    ALA  60           H        ALA  60  -2.293  -8.679 -12.297
  453    HA   ALA  60           HA       ALA  60  -2.652 -10.717 -14.346
  454    HB1  ALA  60           HB1      ALA  60  -0.267 -10.845 -13.823
  455    HB2  ALA  60           HB2      ALA  60  -1.111 -12.268 -13.211
  456    HB3  ALA  60           HB3      ALA  60  -0.637 -10.979 -12.105
  457    H    SER  61           H        SER  61  -4.034 -12.382 -13.661
  458    HA   SER  61           HA       SER  61  -4.789 -12.612 -10.892
  459    HB2  SER  61           HB3      SER  61  -6.775 -11.539 -12.908
  460    HB3  SER  61           HB2      SER  61  -7.208 -12.138 -11.309
  461    HG   SER  61           HG       SER  61  -5.184 -10.317 -11.216
  462    H    ASN  62           H        ASN  62  -3.685 -14.462 -12.779
  463    HA   ASN  62           HA       ASN  62  -5.971 -16.303 -12.986
  464    HB2  ASN  62           HB3      ASN  62  -4.609 -17.584 -14.671
  465    HB3  ASN  62           HB2      ASN  62  -5.126 -15.988 -15.195
  466   HD21  ASN  62          HD21      ASN  62  -2.440 -18.000 -14.362
  467   HD22  ASN  62          HD22      ASN  62  -1.206 -16.918 -14.910
  468    HA   PRO  63           HA       PRO  63  -5.231 -18.297  -9.348
  469    HB2  PRO  63           HB3      PRO  63  -4.723 -20.811 -10.839
  470    HB3  PRO  63           HB2      PRO  63  -5.887 -20.470  -9.554
  471    HG2  PRO  63           HG3      PRO  63  -6.332 -20.443 -12.374
  472    HG3  PRO  63           HG2      PRO  63  -7.483 -20.042 -11.094
  473    HD2  PRO  63           HD3      PRO  63  -6.502 -18.236 -12.957
  474    HD3  PRO  63           HD2      PRO  63  -7.170 -17.782 -11.367
  475    H    VAL  64           H        VAL  64  -2.923 -19.889 -11.618
  476    HA   VAL  64           HA       VAL  64  -1.166 -20.103  -9.297
  477    HB   VAL  64           HB       VAL  64   0.112 -21.709 -10.940
  478   HG11  VAL  64          HG11      VAL  64  -2.513 -22.418  -9.632
  479   HG12  VAL  64          HG12      VAL  64  -0.948 -22.332  -8.823
  480   HG13  VAL  64          HG13      VAL  64  -1.233 -23.551 -10.066
  481   HG21  VAL  64          HG21      VAL  64  -1.295 -21.181 -12.896
  482   HG22  VAL  64          HG22      VAL  64  -2.703 -21.792 -12.029
  483   HG23  VAL  64          HG23      VAL  64  -1.385 -22.884 -12.452
  484    H    GLU  65           H        GLU  65  -0.017 -20.189 -12.628
  485    HA   GLU  65           HA       GLU  65   2.458 -19.203 -11.999
  486    HB2  GLU  65           HB3      GLU  65   2.721 -18.773 -14.441
  487    HB3  GLU  65           HB2      GLU  65   2.112 -20.370 -14.042
  488    HG2  GLU  65           HG3      GLU  65  -0.160 -19.631 -14.575
  489    HG3  GLU  65           HG2      GLU  65   0.472 -18.040 -15.004
  490    H    SER  66           H        SER  66  -0.347 -17.301 -13.001
  491    HA   SER  66           HA       SER  66   1.201 -14.897 -12.322
  492    HB2  SER  66           HB3      SER  66  -0.827 -15.049 -14.567
  493    HB3  SER  66           HB2      SER  66   0.190 -13.671 -14.145
  494    HG   SER  66           HG       SER  66   1.939 -15.445 -14.519
  495    H    GLY  67           H        GLY  67  -0.234 -16.172 -10.470
  496    HA2  GLY  67           HA3      GLY  67  -2.441 -14.281 -10.015
  497    HA3  GLY  67           HA2      GLY  67  -2.709 -16.006  -9.767
  498    H    CYS  68           H        CYS  68  -1.592 -17.078  -8.071
  499    HA   CYS  68           HA       CYS  68  -0.150 -15.308  -6.228
  500    HB2  CYS  68           HB3      CYS  68  -2.293 -17.280  -5.406
  501    HB3  CYS  68           HB2      CYS  68  -1.271 -16.367  -4.296
  502    H    ARG  69           H        ARG  69  -0.595 -18.426  -7.636
  503    HA   ARG  69           HA       ARG  69   0.734 -20.259  -7.820
  504    HB2  ARG  69           HB3      ARG  69   2.831 -18.569  -6.432
  505    HB3  ARG  69           HB2      ARG  69   3.127 -20.088  -7.274
  506    HG2  ARG  69           HG3      ARG  69   2.377 -19.043  -9.371
  507    HG3  ARG  69           HG2      ARG  69   2.133 -17.528  -8.504
  508    HD2  ARG  69           HD3      ARG  69   4.525 -17.487  -7.934
  509    HD3  ARG  69           HD2      ARG  69   4.759 -18.974  -8.863
  510    HE   ARG  69           HE       ARG  69   3.503 -17.021 -10.471
  511   HH11  ARG  69          HH11      ARG  69   6.616 -17.766  -9.047
  512   HH12  ARG  69          HH12      ARG  69   7.511 -16.930 -10.273
  513   HH21  ARG  69          HH21      ARG  69   4.672 -15.933 -12.078
  514   HH22  ARG  69          HH22      ARG  69   6.404 -15.872 -11.997
  515    H    GLY  70           H        GLY  70   1.396 -22.106  -6.633
  516    HA2  GLY  70           HA3      GLY  70   1.615 -23.467  -4.766
  517    HA3  GLY  70           HA2      GLY  70   1.578 -22.023  -3.758
  518    H    ILE  71           H        ILE  71  -0.892 -21.004  -4.630
  519    HA   ILE  71           HA       ILE  71  -2.716 -22.201  -2.922
  520    HB   ILE  71           HB       ILE  71  -3.266 -20.513  -5.368
  521   HG12  ILE  71          HG13      ILE  71  -1.805 -19.380  -3.782
  522   HG13  ILE  71          HG12      ILE  71  -3.403 -18.648  -3.748
  523   HG21  ILE  71          HG21      ILE  71  -5.402 -19.968  -4.309
  524   HG22  ILE  71          HG22      ILE  71  -5.046 -21.105  -3.008
  525   HG23  ILE  71          HG23      ILE  71  -5.271 -21.693  -4.656
  526   HD11  ILE  71          HD11      ILE  71  -2.543 -18.840  -1.513
  527   HD12  ILE  71          HD12      ILE  71  -2.260 -20.566  -1.732
  528   HD13  ILE  71          HD13      ILE  71  -3.909 -19.940  -1.706
  529    H    ASP  72           H        ASP  72  -4.143 -23.821  -3.076
  530    HA   ASP  72           HA       ASP  72  -4.076 -25.588  -5.333
  531    HB2  ASP  72           HB3      ASP  72  -4.331 -26.532  -3.110
  532    HB3  ASP  72           HB2      ASP  72  -5.791 -25.587  -2.836
  533    H    SER  73           H        SER  73  -5.193 -25.248  -7.132
  534    HA   SER  73           HA       SER  73  -7.254 -23.248  -7.217
  535    HB2  SER  73           HB3      SER  73  -7.253 -23.831  -9.683
  536    HB3  SER  73           HB2      SER  73  -5.699 -23.291  -9.038
  537    HG   SER  73           HG       SER  73  -6.403 -25.696 -10.121
  538    H    LYS  74           H        LYS  74  -7.287 -26.491  -6.483
  539    HA   LYS  74           HA       LYS  74  -9.737 -27.179  -7.819
  540    HB2  LYS  74           HB3      LYS  74  -8.046 -28.892  -7.323
  541    HB3  LYS  74           HB2      LYS  74  -8.241 -28.591  -5.605
  542    HG2  LYS  74           HG3      LYS  74 -10.484 -29.444  -5.650
  543    HG3  LYS  74           HG2      LYS  74 -10.437 -29.590  -7.408
  544    HD2  LYS  74           HD3      LYS  74 -10.088 -31.758  -6.372
  545    HD3  LYS  74           HD2      LYS  74  -8.626 -31.232  -7.204
  546    HE2  LYS  74           HE3      LYS  74  -7.691 -30.485  -5.072
  547    HE3  LYS  74           HE2      LYS  74  -9.142 -31.030  -4.245
  548    HZ1  LYS  74           HZ1      LYS  74  -8.656 -33.285  -4.963
  549    HZ2  LYS  74           HZ2      LYS  74  -7.367 -32.654  -4.075
  550    HZ3  LYS  74           HZ3      LYS  74  -7.263 -32.756  -5.756
  551    H    HIS  75           H        HIS  75  -8.754 -26.451  -4.490
  552    HA   HIS  75           HA       HIS  75 -11.570 -26.346  -3.692
  553    HB2  HIS  75           HB3      HIS  75  -9.975 -27.604  -2.276
  554    HB3  HIS  75           HB2      HIS  75  -9.062 -26.124  -2.009
  555    HD1  HIS  75           HD1      HIS  75  -9.707 -24.803  -0.005
  556    HD2  HIS  75           HD2      HIS  75 -12.719 -27.407  -1.195
  557    HE1  HIS  75           HE1      HIS  75 -11.485 -24.628   1.762
  558    HE2  HIS  75           HE2      HIS  75 -13.180 -26.382   1.133
  559    H    TRP  76           H        TRP  76  -8.860 -24.264  -4.319
  560    HA   TRP  76           HA       TRP  76 -10.440 -21.977  -3.349
  561    HB2  TRP  76           HB3      TRP  76  -7.436 -22.348  -3.287
  562    HB3  TRP  76           HB2      TRP  76  -8.250 -20.823  -2.944
  563    HD1  TRP  76           HD1      TRP  76  -7.039 -23.910  -1.293
  564    HE1  TRP  76           HE1      TRP  76  -7.820 -23.974   1.162
  565    HE3  TRP  76           HE3      TRP  76 -10.502 -20.148  -1.439
  566    HZ2  TRP  76           HZ2      TRP  76  -9.659 -22.618   2.805
  567    HZ3  TRP  76           HZ3      TRP  76 -11.727 -19.597   0.621
  568    HH2  TRP  76           HH2      TRP  76 -11.312 -20.810   2.698
  569    H    ASN  77           H        ASN  77 -10.241 -20.037  -4.500
  570    HA   ASN  77           HA       ASN  77  -8.792 -20.191  -7.061
  571    HB2  ASN  77           HB3      ASN  77 -11.239 -20.144  -7.444
  572    HB3  ASN  77           HB2      ASN  77 -11.355 -18.673  -6.487
  573   HD21  ASN  77          HD21      ASN  77 -10.281 -20.063  -9.493
  574   HD22  ASN  77          HD22      ASN  77 -10.093 -18.568 -10.345
  575    H    SER  78           H        SER  78  -7.348 -18.572  -7.387
  576    HA   SER  78           HA       SER  78  -7.129 -16.616  -5.223
  577    HB2  SER  78           HB3      SER  78  -4.740 -16.411  -6.324
  578    HB3  SER  78           HB2      SER  78  -5.117 -17.753  -5.240
  579    HG   SER  78           HG       SER  78  -4.161 -18.049  -7.557
  580    H    TYR  79           H        TYR  79  -7.207 -14.499  -5.582
  581    HA   TYR  79           HA       TYR  79  -7.174 -13.512  -8.336
  582    HB2  TYR  79           HB3      TYR  79  -9.521 -13.893  -7.932
  583    HB3  TYR  79           HB2      TYR  79  -9.429 -13.118  -6.353
  584    HD1  TYR  79           HD1      TYR  79 -10.038 -10.892  -6.150
  585    HD2  TYR  79           HD2      TYR  79  -8.937 -12.374  -9.980
  586    HE1  TYR  79           HE1      TYR  79 -10.691  -8.751  -7.157
  587    HE2  TYR  79           HE2      TYR  79  -9.588 -10.233 -11.001
  588    HH   TYR  79           HH       TYR  79 -10.935  -8.318 -10.573
  589    H    CYS  80           H        CYS  80  -6.356 -11.474  -8.531
  590    HA   CYS  80           HA       CYS  80  -5.202 -10.328  -6.109
  591    HB2  CYS  80           HB3      CYS  80  -4.733  -9.650  -9.024
  592    HB3  CYS  80           HB2      CYS  80  -3.834  -8.992  -7.654
  593    H    THR  81           H        THR  81  -6.192  -8.707  -5.117
  594    HA   THR  81           HA       THR  81  -8.119  -7.106  -6.672
  595    HB   THR  81           HB       THR  81  -8.083  -7.488  -3.670
  596    HG1  THR  81           HG1      THR  81  -8.559  -9.407  -5.068
  597   HG21  THR  81          HG21      THR  81 -10.361  -6.602  -3.785
  598   HG22  THR  81          HG22      THR  81 -10.202  -6.396  -5.528
  599   HG23  THR  81          HG23      THR  81  -9.201  -5.444  -4.433
  600    H    THR  82           H        THR  82  -7.778  -4.976  -6.874
  601    HA   THR  82           HA       THR  82  -5.454  -3.791  -5.648
  602    HB   THR  82           HB       THR  82  -6.548  -1.726  -6.941
  603    HG1  THR  82           HG1      THR  82  -8.043  -2.295  -8.331
  604   HG21  THR  82          HG21      THR  82  -4.363  -2.677  -7.420
  605   HG22  THR  82          HG22      THR  82  -5.251  -2.397  -8.918
  606   HG23  THR  82          HG23      THR  82  -5.119  -4.031  -8.262
  607    H    THR  83           H        THR  83  -5.716  -3.343  -3.543
  608    HA   THR  83           HA       THR  83  -8.142  -2.256  -2.466
  609    HB   THR  83           HB       THR  83  -5.413  -2.238  -1.167
  610    HG1  THR  83           HG1      THR  83  -7.363  -4.329  -1.197
  611   HG21  THR  83          HG21      THR  83  -8.201  -2.383  -0.009
  612   HG22  THR  83          HG22      THR  83  -7.174  -0.950  -0.031
  613   HG23  THR  83          HG23      THR  83  -6.696  -2.364   0.911
  614    H    HIS  84           H        HIS  84  -8.670  -0.145  -2.247
  615    HA   HIS  84           HA       HIS  84  -6.726   1.795  -3.302
  616    HB2  HIS  84           HB3      HIS  84  -9.731   2.102  -3.049
  617    HB3  HIS  84           HB2      HIS  84  -8.625   3.239  -3.812
  618    HD1  HIS  84           HD1      HIS  84  -7.940   2.783  -6.227
  619    HD2  HIS  84           HD2      HIS  84 -10.237  -0.256  -4.560
  620    HE1  HIS  84           HE1      HIS  84  -8.594   1.297  -8.141
  621    HE2  HIS  84           HE2      HIS  84  -9.870  -0.604  -7.091
  622    H    THR  85           H        THR  85  -5.992   3.418  -2.056
  623    HA   THR  85           HA       THR  85  -7.263   3.742   0.589
  624    HB   THR  85           HB       THR  85  -4.742   3.138   0.432
  625    HG1  THR  85           HG1      THR  85  -4.596   4.035   2.373
  626   HG21  THR  85          HG21      THR  85  -4.130   4.766  -1.298
  627   HG22  THR  85          HG22      THR  85  -3.232   5.056   0.192
  628   HG23  THR  85          HG23      THR  85  -4.600   6.087  -0.227
  629    H    PHE  86           H        PHE  86  -7.181   6.053   1.411
  630    HA   PHE  86           HA       PHE  86  -7.954   7.790  -0.829
  631    HB2  PHE  86           HB3      PHE  86  -8.958   7.780   2.029
  632    HB3  PHE  86           HB2      PHE  86  -9.397   8.988   0.820
  633    HD1  PHE  86           HD1      PHE  86 -10.048   5.690   2.110
  634    HD2  PHE  86           HD2      PHE  86 -10.637   8.272  -1.221
  635    HE1  PHE  86           HE1      PHE  86 -11.878   4.243   1.314
  636    HE2  PHE  86           HE2      PHE  86 -12.462   6.833  -2.022
  637    HZ   PHE  86           HZ       PHE  86 -13.087   4.819  -0.756
  638    H    VAL  87           H        VAL  87  -6.579   9.322  -1.256
  639    HA   VAL  87           HA       VAL  87  -4.920  10.396   0.924
  640    HB   VAL  87           HB       VAL  87  -3.335  11.126  -0.854
  641   HG11  VAL  87          HG11      VAL  87  -2.899   9.075   0.345
  642   HG12  VAL  87          HG12      VAL  87  -2.436   8.881  -1.346
  643   HG13  VAL  87          HG13      VAL  87  -3.941   8.177  -0.757
  644   HG21  VAL  87          HG21      VAL  87  -4.885  11.224  -2.736
  645   HG22  VAL  87          HG22      VAL  87  -5.080   9.471  -2.676
  646   HG23  VAL  87          HG23      VAL  87  -3.518  10.170  -3.097
  647    H    LYS  88           H        LYS  88  -4.883  12.575   1.266
  648    HA   LYS  88           HA       LYS  88  -7.008  14.072  -0.024
  649    HB2  LYS  88           HB3      LYS  88  -6.555  15.777   1.728
  650    HB3  LYS  88           HB2      LYS  88  -6.965  14.199   2.379
  651    HG2  LYS  88           HG3      LYS  88  -4.343  13.925   2.444
  652    HG3  LYS  88           HG2      LYS  88  -4.400  15.686   2.473
  653    HD2  LYS  88           HD3      LYS  88  -5.958  15.560   4.385
  654    HD3  LYS  88           HD2      LYS  88  -5.769  13.808   4.390
  655    HE2  LYS  88           HE3      LYS  88  -4.307  14.635   6.045
  656    HE3  LYS  88           HE2      LYS  88  -3.295  14.204   4.668
  657    HZ1  LYS  88           HZ1      LYS  88  -2.713  16.356   5.677
  658    HZ2  LYS  88           HZ2      LYS  88  -4.245  16.952   5.266
  659    HZ3  LYS  88           HZ3      LYS  88  -3.157  16.503   4.048
  660    H    ALA  89           H        ALA  89  -6.566  15.004  -1.845
  661    HA   ALA  89           HA       ALA  89  -4.016  16.458  -2.127
  662    HB1  ALA  89           HB1      ALA  89  -5.350  14.799  -4.272
  663    HB2  ALA  89           HB2      ALA  89  -3.892  14.351  -3.386
  664    HB3  ALA  89           HB3      ALA  89  -3.876  15.750  -4.458
  665    H    LEU  90           H        LEU  90  -4.099  18.283  -3.535
  666    HA   LEU  90           HA       LEU  90  -6.608  19.655  -3.484
  667    HB2  LEU  90           HB3      LEU  90  -4.351  20.753  -3.223
  668    HB3  LEU  90           HB2      LEU  90  -4.073  20.446  -4.930
  669    HG   LEU  90           HG       LEU  90  -6.192  21.810  -5.361
  670   HD11  LEU  90          HD11      LEU  90  -5.669  22.610  -2.506
  671   HD12  LEU  90          HD12      LEU  90  -7.101  21.789  -3.124
  672   HD13  LEU  90          HD13      LEU  90  -6.754  23.445  -3.618
  673   HD21  LEU  90          HD21      LEU  90  -3.931  22.625  -5.828
  674   HD22  LEU  90          HD22      LEU  90  -3.796  23.198  -4.165
  675   HD23  LEU  90          HD23      LEU  90  -4.983  23.919  -5.253
  676    H    THR  91           H        THR  91  -8.147  18.957  -4.831
  677    HA   THR  91           HA       THR  91  -7.410  18.516  -7.654
  678    HB   THR  91           HB       THR  91  -9.131  16.804  -7.816
  679    HG1  THR  91           HG1      THR  91  -9.983  17.936  -5.539
  680   HG21  THR  91          HG21      THR  91  -7.438  16.266  -5.373
  681   HG22  THR  91          HG22      THR  91  -6.874  16.111  -7.033
  682   HG23  THR  91          HG23      THR  91  -8.162  15.064  -6.439
  683    H    THR  92           H        THR  92  -9.155  18.983  -9.192
  684    HA   THR  92           HA       THR  92 -10.925  21.077  -8.128
  685    HB   THR  92           HB       THR  92  -9.283  22.038  -9.633
  686    HG1  THR  92           HG1      THR  92 -10.844  23.259 -10.335
  687   HG21  THR  92          HG21      THR  92  -9.109  21.416 -11.969
  688   HG22  THR  92          HG22      THR  92 -10.339  20.174 -11.756
  689   HG23  THR  92          HG23      THR  92  -8.777  20.013 -10.953
  690    H    ASP  93           H        ASP  93 -13.005  20.722  -8.217
  691    HA   ASP  93           HA       ASP  93 -14.126  18.366  -9.323
  692    HB2  ASP  93           HB3      ASP  93 -15.477  20.902  -8.364
  693    HB3  ASP  93           HB2      ASP  93 -16.318  19.406  -8.751
  694    H    GLU  94           H        GLU  94 -13.781  21.657 -10.421
  695    HA   GLU  94           HA       GLU  94 -14.118  20.961 -13.134
  696    HB2  GLU  94           HB3      GLU  94 -16.131  22.333 -13.610
  697    HB3  GLU  94           HB2      GLU  94 -16.485  20.905 -12.654
  698    HG2  GLU  94           HG3      GLU  94 -16.662  22.239 -10.659
  699    HG3  GLU  94           HG2      GLU  94 -16.154  23.676 -11.537
  700    H    LYS  95           H        LYS  95 -14.204  23.510 -10.699
  701    HA   LYS  95           HA       LYS  95 -12.499  25.145 -12.446
  702    HB2  LYS  95           HB3      LYS  95 -14.827  26.111 -10.775
  703    HB3  LYS  95           HB2      LYS  95 -13.683  27.161 -11.596
  704    HG2  LYS  95           HG3      LYS  95 -14.428  26.448 -13.729
  705    HG3  LYS  95           HG2      LYS  95 -15.373  25.133 -13.031
  706    HD2  LYS  95           HD3      LYS  95 -16.853  26.744 -11.967
  707    HD3  LYS  95           HD2      LYS  95 -15.882  28.070 -12.606
  708    HE2  LYS  95           HE3      LYS  95 -17.910  27.685 -13.932
  709    HE3  LYS  95           HE2      LYS  95 -16.440  27.436 -14.868
  710    HZ1  LYS  95           HZ1      LYS  95 -16.704  25.095 -14.720
  711    HZ2  LYS  95           HZ2      LYS  95 -18.193  25.729 -15.208
  712    HZ3  LYS  95           HZ3      LYS  95 -17.971  25.227 -13.604
  713    H    GLN  96           H        GLN  96 -13.838  25.286  -9.150
  714    HA   GLN  96           HA       GLN  96 -11.438  26.431  -8.107
  715    HB2  GLN  96           HB3      GLN  96 -13.908  25.348  -6.745
  716    HB3  GLN  96           HB2      GLN  96 -12.590  26.140  -5.896
  717    HG2  GLN  96           HG3      GLN  96 -14.359  27.360  -8.001
  718    HG3  GLN  96           HG2      GLN  96 -14.404  27.689  -6.270
  719   HE21  GLN  96          HE21      GLN  96 -12.767  28.962  -5.352
  720   HE22  GLN  96          HE22      GLN  96 -11.703  29.922  -6.313
  721    H    ALA  97           H        ALA  97  -9.844  25.519  -6.942
  722    HA   ALA  97           HA       ALA  97  -9.701  22.601  -6.965
  723    HB1  ALA  97           HB1      ALA  97  -7.532  24.600  -6.336
  724    HB2  ALA  97           HB2      ALA  97  -7.829  23.902  -7.927
  725    HB3  ALA  97           HB3      ALA  97  -7.331  22.867  -6.591
  726    H    ALA  98           H        ALA  98  -9.806  21.411  -5.152
  727    HA   ALA  98           HA       ALA  98  -9.483  22.703  -2.551
  728    HB1  ALA  98           HB1      ALA  98 -11.581  21.760  -1.715
  729    HB2  ALA  98           HB2      ALA  98 -11.939  21.122  -3.320
  730    HB3  ALA  98           HB3      ALA  98 -11.874  22.865  -3.058
  731    H    TRP  99           H        TRP  99  -8.974  21.257  -0.877
  732    HA   TRP  99           HA       TRP  99  -7.583  18.903  -1.656
  733    HB2  TRP  99           HB3      TRP  99  -8.379  19.924   1.081
  734    HB3  TRP  99           HB2      TRP  99  -7.328  18.542   0.807
  735    HD1  TRP  99           HD1      TRP  99  -7.374  22.353   0.579
  736    HE1  TRP  99           HE1      TRP  99  -4.950  23.197   0.384
  737    HE3  TRP  99           HE3      TRP  99  -5.002  17.868   0.007
  738    HZ2  TRP  99           HZ2      TRP  99  -2.377  22.106   0.039
  739    HZ3  TRP  99           HZ3      TRP  99  -2.551  17.853  -0.251
  740    HH2  TRP  99           HH2      TRP  99  -1.270  19.929  -0.233
  741    H    ARG 100           H        ARG 100  -8.611  17.154  -2.330
  742    HA   ARG 100           HA       ARG 100 -11.046  16.307  -0.901
  743    HB2  ARG 100           HB3      ARG 100 -10.184  15.572  -3.709
  744    HB3  ARG 100           HB2      ARG 100 -11.685  15.102  -2.931
  745    HG2  ARG 100           HG3      ARG 100 -10.903  17.928  -3.608
  746    HG3  ARG 100           HG2      ARG 100 -11.952  16.904  -4.580
  747    HD2  ARG 100           HD3      ARG 100 -13.442  16.710  -2.556
  748    HD3  ARG 100           HD2      ARG 100 -12.457  17.973  -1.818
  749    HE   ARG 100           HE       ARG 100 -13.547  18.597  -4.430
  750   HH11  ARG 100          HH11      ARG 100 -13.920  18.856  -0.963
  751   HH12  ARG 100          HH12      ARG 100 -15.059  20.160  -1.056
  752   HH21  ARG 100          HH21      ARG 100 -15.029  20.305  -4.572
  753   HH22  ARG 100          HH22      ARG 100 -15.700  20.982  -3.110
  754    H    PHE 101           H        PHE 101 -11.272  14.085  -0.443
  755    HA   PHE 101           HA       PHE 101  -8.740  12.648  -0.201
  756    HB2  PHE 101           HB3      PHE 101 -11.505  12.069   0.909
  757    HB3  PHE 101           HB2      PHE 101 -10.125  10.999   1.118
  758    HD1  PHE 101           HD1      PHE 101 -11.470  14.342   1.956
  759    HD2  PHE 101           HD2      PHE 101  -8.473  11.421   2.738
  760    HE1  PHE 101           HE1      PHE 101 -10.793  15.580   3.969
  761    HE2  PHE 101           HE2      PHE 101  -7.792  12.657   4.752
  762    HZ   PHE 101           HZ       PHE 101  -8.951  14.737   5.370
  763    H    ILE 102           H        ILE 102  -8.191  11.628  -2.017
  764    HA   ILE 102           HA       ILE 102 -10.339  10.410  -3.625
  765    HB   ILE 102           HB       ILE 102  -8.752  10.606  -5.550
  766   HG12  ILE 102          HG13      ILE 102  -7.195  12.411  -3.689
  767   HG13  ILE 102          HG12      ILE 102  -6.685  10.796  -4.163
  768   HG21  ILE 102          HG21      ILE 102 -10.557  12.203  -5.239
  769   HG22  ILE 102          HG22      ILE 102  -9.130  12.996  -5.907
  770   HG23  ILE 102          HG23      ILE 102  -9.525  13.186  -4.199
  771   HD11  ILE 102          HD11      ILE 102  -5.523  12.478  -5.449
  772   HD12  ILE 102          HD12      ILE 102  -7.058  13.156  -5.993
  773   HD13  ILE 102          HD13      ILE 102  -6.582  11.533  -6.497
  774    H    ARG 103           H        ARG 103 -10.073   8.377  -4.443
  775    HA   ARG 103           HA       ARG 103  -8.317   6.722  -2.844
  776    HB2  ARG 103           HB3      ARG 103  -9.579   4.836  -3.737
  777    HB3  ARG 103           HB2      ARG 103 -10.662   6.072  -3.119
  778    HG2  ARG 103           HG3      ARG 103 -11.087   6.836  -5.403
  779    HG3  ARG 103           HG2      ARG 103 -10.003   5.587  -6.016
  780    HD2  ARG 103           HD3      ARG 103 -11.471   3.878  -4.952
  781    HD3  ARG 103           HD2      ARG 103 -12.590   5.173  -4.518
  782    HE   ARG 103           HE       ARG 103 -12.186   5.397  -7.238
  783   HH11  ARG 103          HH11      ARG 103 -13.441   2.988  -5.028
  784   HH12  ARG 103          HH12      ARG 103 -14.502   2.279  -6.203
  785   HH21  ARG 103          HH21      ARG 103 -13.597   4.476  -8.785
  786   HH22  ARG 103          HH22      ARG 103 -14.603   3.133  -8.334
  787    H    ILE 104           H        ILE 104  -6.548   5.728  -3.477
  788    HA   ILE 104           HA       ILE 104  -5.919   5.647  -6.361
  789    HB   ILE 104           HB       ILE 104  -3.534   5.794  -5.790
  790   HG12  ILE 104          HG13      ILE 104  -4.472   6.320  -2.964
  791   HG13  ILE 104          HG12      ILE 104  -3.701   4.836  -3.509
  792   HG21  ILE 104          HG21      ILE 104  -5.191   8.053  -4.681
  793   HG22  ILE 104          HG22      ILE 104  -4.678   7.843  -6.357
  794   HG23  ILE 104          HG23      ILE 104  -3.483   8.159  -5.102
  795   HD11  ILE 104          HD11      ILE 104  -2.465   7.575  -3.461
  796   HD12  ILE 104          HD12      ILE 104  -1.685   6.112  -4.067
  797   HD13  ILE 104          HD13      ILE 104  -2.117   6.241  -2.362
  798    H    ASP 105           H        ASP 105  -4.728   3.812  -7.083
  799    HA   ASP 105           HA       ASP 105  -5.461   1.354  -5.781
  800    HB2  ASP 105           HB3      ASP 105  -3.690   1.931  -8.180
  801    HB3  ASP 105           HB2      ASP 105  -4.053   0.302  -7.609
  802    H    THR 106           H        THR 106  -4.432   0.878  -3.910
  803    HA   THR 106           HA       THR 106  -1.713   1.921  -3.598
  804    HB   THR 106           HB       THR 106  -3.294   0.789  -1.327
  805    HG1  THR 106           HG1      THR 106  -4.110   2.788  -2.988
  806   HG21  THR 106          HG21      THR 106  -1.023   1.622  -0.941
  807   HG22  THR 106          HG22      THR 106  -2.214   2.638  -0.127
  808   HG23  THR 106          HG23      THR 106  -1.471   3.182  -1.631
  809    H    ALA 107           H        ALA 107  -3.578  -1.060  -3.082
  810    HA   ALA 107           HA       ALA 107  -1.031  -2.512  -2.959
  811    HB1  ALA 107           HB1      ALA 107  -1.832  -2.178  -0.670
  812    HB2  ALA 107           HB2      ALA 107  -1.868  -3.881  -1.128
  813    HB3  ALA 107           HB3      ALA 107  -3.362  -2.945  -1.096
  814    H    CYS 108           H        CYS 108  -1.011  -4.457  -3.945
  815    HA   CYS 108           HA       CYS 108  -3.516  -5.374  -5.177
  816    HB2  CYS 108           HB3      CYS 108  -1.674  -4.863  -6.759
  817    HB3  CYS 108           HB2      CYS 108  -0.649  -6.032  -5.928
  818    H    VAL 109           H        VAL 109  -4.422  -6.714  -3.722
  819    HA   VAL 109           HA       VAL 109  -2.644  -8.405  -2.119
  820    HB   VAL 109           HB       VAL 109  -4.526  -8.688  -0.582
  821   HG11  VAL 109          HG11      VAL 109  -4.002  -5.814  -1.327
  822   HG12  VAL 109          HG12      VAL 109  -3.045  -6.808  -0.226
  823   HG13  VAL 109          HG13      VAL 109  -4.697  -6.361   0.200
  824   HG21  VAL 109          HG21      VAL 109  -6.361  -8.595  -2.195
  825   HG22  VAL 109          HG22      VAL 109  -6.050  -6.877  -2.456
  826   HG23  VAL 109          HG23      VAL 109  -6.608  -7.443  -0.882
  827    H    CYS 110           H        CYS 110  -2.838 -10.590  -1.997
  828    HA   CYS 110           HA       CYS 110  -4.371 -11.906  -4.080
  829    HB2  CYS 110           HB3      CYS 110  -2.126 -12.736  -3.719
  830    HB3  CYS 110           HB2      CYS 110  -2.436 -12.971  -2.006
  831    H    VAL 111           H        VAL 111  -6.434 -12.322  -3.719
  832    HA   VAL 111           HA       VAL 111  -7.258 -13.013  -0.980
  833    HB   VAL 111           HB       VAL 111  -9.527 -12.384  -1.593
  834   HG11  VAL 111          HG11      VAL 111  -8.143 -10.621  -0.726
  835   HG12  VAL 111          HG12      VAL 111  -9.188  -9.963  -1.985
  836   HG13  VAL 111          HG13      VAL 111  -7.491 -10.290  -2.331
  837   HG21  VAL 111          HG21      VAL 111 -10.070 -11.393  -3.751
  838   HG22  VAL 111          HG22      VAL 111  -9.480 -13.044  -3.949
  839   HG23  VAL 111          HG23      VAL 111  -8.423 -11.679  -4.310
  840    H    LEU 112           H        LEU 112  -8.479 -14.865  -0.624
  841    HA   LEU 112           HA       LEU 112  -8.455 -16.770  -2.860
  842    HB2  LEU 112           HB3      LEU 112  -8.524 -17.243   0.124
  843    HB3  LEU 112           HB2      LEU 112  -8.705 -18.516  -1.074
  844    HG   LEU 112           HG       LEU 112  -6.251 -16.811  -0.624
  845   HD11  LEU 112          HD11      LEU 112  -6.585 -18.534   1.067
  846   HD12  LEU 112          HD12      LEU 112  -5.218 -18.929   0.026
  847   HD13  LEU 112          HD13      LEU 112  -6.761 -19.753  -0.195
  848   HD21  LEU 112          HD21      LEU 112  -5.202 -18.300  -2.305
  849   HD22  LEU 112          HD22      LEU 112  -6.445 -17.248  -2.975
  850   HD23  LEU 112          HD23      LEU 112  -6.800 -18.950  -2.677
  851    H    SER 113           H        SER 113 -10.256 -17.670  -3.568
  852    HA   SER 113           HA       SER 113 -12.750 -17.132  -2.105
  853    HB2  SER 113           HB3      SER 113 -12.745 -16.061  -4.302
  854    HB3  SER 113           HB2      SER 113 -12.290 -17.578  -5.070
  855    HG   SER 113           HG       SER 113 -14.470 -17.404  -5.312
  856    H    ARG 114           H        ARG 114 -14.042 -18.859  -1.608
  857    HA   ARG 114           HA       ARG 114 -12.788 -21.450  -1.671
  858    HB2  ARG 114           HB3      ARG 114 -14.179 -20.483   0.245
  859    HB3  ARG 114           HB2      ARG 114 -15.593 -20.839  -0.739
  860    HG2  ARG 114           HG3      ARG 114 -14.959 -23.213  -0.767
  861    HG3  ARG 114           HG2      ARG 114 -13.572 -22.841   0.259
  862    HD2  ARG 114           HD3      ARG 114 -15.320 -23.663   1.656
  863    HD3  ARG 114           HD2      ARG 114 -15.163 -21.935   1.949
  864    HE   ARG 114           HE       ARG 114 -17.216 -22.945   0.104
  865   HH11  ARG 114          HH11      ARG 114 -16.334 -21.203   3.008
  866   HH12  ARG 114          HH12      ARG 114 -17.950 -20.659   3.322
  867   HH21  ARG 114          HH21      ARG 114 -19.337 -22.218   0.506
  868   HH22  ARG 114          HH22      ARG 114 -19.657 -21.229   1.897
  869    H    LYS 115           H        LYS 115 -14.180 -19.824  -3.991
  870    HA   LYS 115           HA       LYS 115 -15.051 -20.319  -6.015
  871    HB2  LYS 115           HB3      LYS 115 -14.624 -23.204  -5.186
  872    HB3  LYS 115           HB2      LYS 115 -14.937 -22.647  -6.822
  873    HG2  LYS 115           HG3      LYS 115 -12.838 -21.429  -6.840
  874    HG3  LYS 115           HG2      LYS 115 -12.541 -21.896  -5.162
  875    HD2  LYS 115           HD3      LYS 115 -11.254 -23.320  -6.601
  876    HD3  LYS 115           HD2      LYS 115 -12.543 -24.267  -5.863
  877    HE2  LYS 115           HE3      LYS 115 -13.857 -24.109  -7.888
  878    HE3  LYS 115           HE2      LYS 115 -12.629 -23.086  -8.634
  879    HZ1  LYS 115           HZ1      LYS 115 -12.210 -25.890  -7.749
  880    HZ2  LYS 115           HZ2      LYS 115 -11.069 -24.910  -8.532
  881    HZ3  LYS 115           HZ3      LYS 115 -12.468 -25.403  -9.347
  882    H    ALA 116           H        ALA 116 -16.749 -19.752  -3.928
  883    HA   ALA 116           HA       ALA 116 -19.121 -21.352  -4.630
  884    HB1  ALA 116           HB1      ALA 116 -19.957 -21.098  -2.370
  885    HB2  ALA 116           HB2      ALA 116 -18.535 -20.157  -1.924
  886    HB3  ALA 116           HB3      ALA 116 -18.368 -21.862  -2.341
  887    H    THR 117           H        THR 117 -18.151 -18.267  -3.121
  888    HA   THR 117           HA       THR 117 -20.582 -16.977  -3.935
  889    HB   THR 117           HB       THR 117 -19.429 -14.907  -3.048
  890    HG1  THR 117           HG1      THR 117 -17.349 -15.074  -2.731
  891   HG21  THR 117          HG21      THR 117 -19.607 -15.604  -0.700
  892   HG22  THR 117          HG22      THR 117 -19.628 -17.294  -1.208
  893   HG23  THR 117          HG23      THR 117 -20.951 -16.219  -1.662
  894    H    ARG 118           H        ARG 118 -20.756 -15.212  -5.381
  895    HA   ARG 118           HA       ARG 118 -18.630 -14.431  -7.086
  896    HB2  ARG 118           HB3      ARG 118 -19.858 -15.320  -9.198
  897    HB3  ARG 118           HB2      ARG 118 -18.816 -16.406  -8.304
  898    HG2  ARG 118           HG3      ARG 118 -20.609 -17.758  -8.668
  899    HG3  ARG 118           HG2      ARG 118 -21.045 -17.083  -7.107
  900    HD2  ARG 118           HD3      ARG 118 -22.008 -15.892  -9.698
  901    HD3  ARG 118           HD2      ARG 118 -22.865 -17.200  -8.892
  902    HE   ARG 118           HE       ARG 118 -22.323 -14.814  -7.305
  903   HH11  ARG 118          HH11      ARG 118 -24.604 -16.627  -9.242
  904   HH12  ARG 118          HH12      ARG 118 -25.989 -15.798  -8.616
  905   HH21  ARG 118          HH21      ARG 118 -24.143 -13.719  -6.484
  906   HH22  ARG 118          HH22      ARG 118 -25.730 -14.143  -7.043
  907    H1   SER   1           H1       SER   1 -21.362   5.010  -3.011
  908    H2   SER   1           H2       SER   1 -22.759   4.867  -2.070
  909    H3   SER   1           H3       SER   1 -22.855   4.711  -3.749
  910    HA   SER   1           HA       SER   1 -21.534   2.720  -3.677
  911    HB2  SER   1           HB3      SER   1 -21.217   1.743  -1.308
  912    HB3  SER   1           HB2      SER   1 -20.136   3.047  -1.802
  913    HG   SER   1           HG       SER   1 -20.853   3.633   0.179
  914    H    SER   2           H        SER   2 -22.853   1.057  -4.132
  915    HA   SER   2           HA       SER   2 -25.289   0.717  -2.547
  916    HB2  SER   2           HB3      SER   2 -26.562   0.348  -4.722
  917    HB3  SER   2           HB2      SER   2 -26.108   2.015  -4.366
  918    HG   SER   2           HG       SER   2 -24.628   1.977  -5.939
  919    H    THR   3           H        THR   3 -24.037  -0.723  -5.554
  920    HA   THR   3           HA       THR   3 -24.533  -3.356  -4.424
  921    HB   THR   3           HB       THR   3 -23.751  -3.992  -6.862
  922    HG1  THR   3           HG1      THR   3 -24.920  -1.732  -7.791
  923   HG21  THR   3          HG21      THR   3 -25.980  -4.387  -5.970
  924   HG22  THR   3          HG22      THR   3 -26.081  -3.753  -7.613
  925   HG23  THR   3          HG23      THR   3 -26.405  -2.697  -6.238
  926    H    HIS   4           H        HIS   4 -23.051  -4.783  -3.870
  927    HA   HIS   4           HA       HIS   4 -20.382  -4.728  -4.903
  928    HB2  HIS   4           HB3      HIS   4 -19.283  -4.626  -2.643
  929    HB3  HIS   4           HB2      HIS   4 -19.992  -3.109  -3.172
  930    HD1  HIS   4           HD1      HIS   4 -22.253  -2.395  -1.951
  931    HD2  HIS   4           HD2      HIS   4 -20.211  -5.593  -0.251
  932    HE1  HIS   4           HE1      HIS   4 -23.220  -2.668   0.354
  933    HE2  HIS   4           HE2      HIS   4 -22.034  -4.664   1.331
  934    HA   PRO   5           HA       PRO   5 -22.085  -8.888  -4.283
  935    HB2  PRO   5           HB3      PRO   5 -20.358 -10.113  -6.009
  936    HB3  PRO   5           HB2      PRO   5 -21.833  -9.288  -6.527
  937    HG2  PRO   5           HG3      PRO   5 -19.006  -8.303  -6.526
  938    HG3  PRO   5           HG2      PRO   5 -20.252  -8.113  -7.774
  939    HD2  PRO   5           HD3      PRO   5 -19.625  -6.131  -6.058
  940    HD3  PRO   5           HD2      PRO   5 -21.286  -6.367  -6.643
  941    H    VAL   6           H        VAL   6 -21.382  -9.167  -2.159
  942    HA   VAL   6           HA       VAL   6 -20.093  -9.871  -0.416
  943    HB   VAL   6           HB       VAL   6 -18.633 -11.579  -2.437
  944   HG11  VAL   6          HG11      VAL   6 -18.480 -13.162  -0.558
  945   HG12  VAL   6          HG12      VAL   6 -19.268 -11.976   0.484
  946   HG13  VAL   6          HG13      VAL   6 -17.685 -11.628  -0.214
  947   HG21  VAL   6          HG21      VAL   6 -20.365 -13.288  -2.064
  948   HG22  VAL   6          HG22      VAL   6 -20.999 -11.845  -2.853
  949   HG23  VAL   6          HG23      VAL   6 -21.297 -12.114  -1.137
  950    H    PHE   7           H        PHE   7 -19.350  -7.515  -1.146
  951    HA   PHE   7           HA       PHE   7 -17.729  -5.938  -1.204
  952    HB2  PHE   7           HB3      PHE   7 -15.887  -8.240  -0.537
  953    HB3  PHE   7           HB2      PHE   7 -15.399  -6.553  -0.569
  954    HD1  PHE   7           HD1      PHE   7 -16.428  -9.153   1.496
  955    HD2  PHE   7           HD2      PHE   7 -16.938  -4.969   0.912
  956    HE1  PHE   7           HE1      PHE   7 -17.090  -8.911   3.847
  957    HE2  PHE   7           HE2      PHE   7 -17.602  -4.719   3.267
  958    HZ   PHE   7           HZ       PHE   7 -17.679  -6.689   4.740
  959    H    HIS   8           H        HIS   8 -16.016  -8.757  -2.509
  960    HA   HIS   8           HA       HIS   8 -16.157  -7.745  -5.208
  961    HB2  HIS   8           HB3      HIS   8 -14.177  -6.590  -3.988
  962    HB3  HIS   8           HB2      HIS   8 -13.404  -8.166  -4.049
  963    HD1  HIS   8           HD1      HIS   8 -13.512  -5.115  -5.818
  964    HD2  HIS   8           HD2      HIS   8 -13.361  -9.109  -6.956
  965    HE1  HIS   8           HE1      HIS   8 -12.641  -5.112  -8.173
  966    HE2  HIS   8           HE2      HIS   8 -12.372  -7.544  -8.765
  967    H    MET   9           H        MET   9 -17.360  -9.870  -4.514
  968    HA   MET   9           HA       MET   9 -17.699 -12.042  -5.018
  969    HB2  MET   9           HB3      MET   9 -14.920 -11.940  -6.200
  970    HB3  MET   9           HB2      MET   9 -15.962 -13.350  -6.271
  971    HG2  MET   9           HG3      MET   9 -17.629 -12.034  -7.511
  972    HG3  MET   9           HG2      MET   9 -16.544 -10.649  -7.470
  973    HE1  MET   9           HE1      MET   9 -15.556 -14.588  -9.662
  974    HE2  MET   9           HE2      MET   9 -17.040 -14.328  -8.747
  975    HE3  MET   9           HE3      MET   9 -15.491 -14.416  -7.909
  976    H    GLY  10           H        GLY  10 -14.419 -11.528  -3.741
  977    HA2  GLY  10           HA3      GLY  10 -15.033 -12.781  -1.284
  978    HA3  GLY  10           HA2      GLY  10 -14.208 -13.930  -2.325
  979    H    GLU  11           H        GLU  11 -13.919 -10.759  -0.790
  980    HA   GLU  11           HA       GLU  11 -11.096 -10.607  -1.388
  981    HB2  GLU  11           HB3      GLU  11 -12.860  -8.854   0.337
  982    HB3  GLU  11           HB2      GLU  11 -11.154  -8.544   0.029
  983    HG2  GLU  11           HG3      GLU  11 -11.708  -8.435  -2.410
  984    HG3  GLU  11           HG2      GLU  11 -13.413  -8.526  -1.963
  985    H    PHE  12           H        PHE  12 -11.263 -12.909  -0.203
  986    HA   PHE  12           HA       PHE  12 -10.772 -12.632   2.649
  987    HB2  PHE  12           HB3      PHE  12 -10.695 -15.051   0.824
  988    HB3  PHE  12           HB2      PHE  12 -10.383 -15.108   2.556
  989    HD1  PHE  12           HD1      PHE  12 -12.970 -14.470   0.002
  990    HD2  PHE  12           HD2      PHE  12 -12.136 -15.058   4.133
  991    HE1  PHE  12           HE1      PHE  12 -15.374 -14.729   0.447
  992    HE2  PHE  12           HE2      PHE  12 -14.538 -15.318   4.584
  993    HZ   PHE  12           HZ       PHE  12 -16.161 -15.154   2.741
  994    H    SER  13           H        SER  13  -8.931 -11.469   2.852
  995    HA   SER  13           HA       SER  13  -6.622 -11.675   1.295
  996    HB2  SER  13           HB3      SER  13  -7.047  -9.769   2.785
  997    HB3  SER  13           HB2      SER  13  -6.899 -10.817   4.189
  998    HG   SER  13           HG       SER  13  -4.831 -10.555   4.102
  999    H    VAL  14           H        VAL  14  -5.052 -13.125   1.193
 1000    HA   VAL  14           HA       VAL  14  -5.083 -15.566   2.544
 1001    HB   VAL  14           HB       VAL  14  -2.730 -15.850   1.740
 1002   HG11  VAL  14          HG11      VAL  14  -4.761 -14.875  -0.257
 1003   HG12  VAL  14          HG12      VAL  14  -4.547 -16.527   0.326
 1004   HG13  VAL  14          HG13      VAL  14  -3.298 -15.772  -0.665
 1005   HG21  VAL  14          HG21      VAL  14  -1.760 -14.155   0.279
 1006   HG22  VAL  14          HG22      VAL  14  -1.999 -13.523   1.907
 1007   HG23  VAL  14          HG23      VAL  14  -3.114 -13.078   0.615
 1008    H    CYS  15           H        CYS  15  -3.555 -12.535   3.358
 1009    HA   CYS  15           HA       CYS  15  -2.400 -13.799   5.744
 1010    HB2  CYS  15           HB3      CYS  15  -0.706 -12.777   4.309
 1011    HB3  CYS  15           HB2      CYS  15  -1.576 -11.241   4.353
 1012    H    ASP  16           H        ASP  16  -2.890 -13.029   7.734
 1013    HA   ASP  16           HA       ASP  16  -5.151 -11.204   7.897
 1014    HB2  ASP  16           HB3      ASP  16  -5.000 -13.356   9.253
 1015    HB3  ASP  16           HB2      ASP  16  -3.739 -12.569  10.200
 1016    H    SER  17           H        SER  17  -4.853  -9.110   8.132
 1017    HA   SER  17           HA       SER  17  -2.456  -8.158   9.529
 1018    HB2  SER  17           HB3      SER  17  -2.511  -6.253   7.779
 1019    HB3  SER  17           HB2      SER  17  -1.871  -7.820   7.270
 1020    HG   SER  17           HG       SER  17  -3.722  -8.227   6.169
 1021    H    VAL  18           H        VAL  18  -2.651  -5.885  10.230
 1022    HA   VAL  18           HA       VAL  18  -5.440  -5.255  10.920
 1023    HB   VAL  18           HB       VAL  18  -4.203  -5.613  12.921
 1024   HG11  VAL  18          HG11      VAL  18  -1.952  -5.486  12.076
 1025   HG12  VAL  18          HG12      VAL  18  -2.128  -4.407  13.461
 1026   HG13  VAL  18          HG13      VAL  18  -2.111  -3.747  11.826
 1027   HG21  VAL  18          HG21      VAL  18  -4.264  -3.428  14.022
 1028   HG22  VAL  18          HG22      VAL  18  -5.684  -3.699  13.014
 1029   HG23  VAL  18          HG23      VAL  18  -4.388  -2.647  12.447
 1030    H    SER  19           H        SER  19  -6.283  -3.685   9.755
 1031    HA   SER  19           HA       SER  19  -4.496  -1.662   8.580
 1032    HB2  SER  19           HB3      SER  19  -5.664  -3.191   6.958
 1033    HB3  SER  19           HB2      SER  19  -7.204  -2.553   7.545
 1034    HG   SER  19           HG       SER  19  -5.135  -1.189   6.167
 1035    H    VAL  20           H        VAL  20  -4.593   0.106   9.776
 1036    HA   VAL  20           HA       VAL  20  -7.231   1.044  10.689
 1037    HB   VAL  20           HB       VAL  20  -4.651   1.116  12.259
 1038   HG11  VAL  20          HG11      VAL  20  -5.994   2.073  14.072
 1039   HG12  VAL  20          HG12      VAL  20  -7.381   2.159  12.985
 1040   HG13  VAL  20          HG13      VAL  20  -5.940   3.125  12.658
 1041   HG21  VAL  20          HG21      VAL  20  -5.757  -0.380  13.812
 1042   HG22  VAL  20          HG22      VAL  20  -5.725  -1.091  12.198
 1043   HG23  VAL  20          HG23      VAL  20  -7.211  -0.369  12.815
 1044    H    TRP  21           H        TRP  21  -7.627   3.180  10.443
 1045    HA   TRP  21           HA       TRP  21  -5.618   4.845   9.186
 1046    HB2  TRP  21           HB3      TRP  21  -8.502   5.315   9.968
 1047    HB3  TRP  21           HB2      TRP  21  -7.472   6.595   9.338
 1048    HD1  TRP  21           HD1      TRP  21  -9.220   3.356   8.254
 1049    HE1  TRP  21           HE1      TRP  21  -9.311   3.293   5.684
 1050    HE3  TRP  21           HE3      TRP  21  -6.318   7.448   7.236
 1051    HZ2  TRP  21           HZ2      TRP  21  -8.296   4.784   3.513
 1052    HZ3  TRP  21           HZ3      TRP  21  -5.933   8.062   4.884
 1053    HH2  TRP  21           HH2      TRP  21  -6.898   6.757   3.064
 1054    H    VAL  22           H        VAL  22  -4.050   5.279  10.592
 1055    HA   VAL  22           HA       VAL  22  -4.662   5.809  13.389
 1056    HB   VAL  22           HB       VAL  22  -2.007   5.496  11.979
 1057   HG11  VAL  22          HG11      VAL  22  -1.054   5.249  14.217
 1058   HG12  VAL  22          HG12      VAL  22  -2.627   5.609  14.925
 1059   HG13  VAL  22          HG13      VAL  22  -1.778   6.841  13.992
 1060   HG21  VAL  22          HG21      VAL  22  -3.299   3.448  11.945
 1061   HG22  VAL  22          HG22      VAL  22  -3.577   3.571  13.682
 1062   HG23  VAL  22          HG23      VAL  22  -1.948   3.296  13.068
 1063    H    GLY  23           H        GLY  23  -4.982   7.822  14.056
 1064    HA2  GLY  23           HA3      GLY  23  -3.643  10.013  12.606
 1065    HA3  GLY  23           HA2      GLY  23  -5.109  10.184  13.570
 1066    H    ASP  24           H        ASP  24  -2.768   8.153  14.936
 1067    HA   ASP  24           HA       ASP  24  -1.837  10.335  16.681
 1068    HB2  ASP  24           HB3      ASP  24  -2.534   7.492  17.451
 1069    HB3  ASP  24           HB2      ASP  24  -1.724   8.632  18.521
 1070    H    LYS  25           H        LYS  25  -0.688   8.915  14.246
 1071    HA   LYS  25           HA       LYS  25   1.628   7.554  15.279
 1072    HB2  LYS  25           HB3      LYS  25   0.593   7.047  13.042
 1073    HB3  LYS  25           HB2      LYS  25   1.166   8.610  12.481
 1074    HG2  LYS  25           HG3      LYS  25   3.445   7.954  12.749
 1075    HG3  LYS  25           HG2      LYS  25   2.972   6.448  13.536
 1076    HD2  LYS  25           HD3      LYS  25   1.826   5.781  11.425
 1077    HD3  LYS  25           HD2      LYS  25   2.476   7.235  10.666
 1078    HE2  LYS  25           HE3      LYS  25   4.739   6.472  11.038
 1079    HE3  LYS  25           HE2      LYS  25   4.158   5.069  11.934
 1080    HZ1  LYS  25           HZ1      LYS  25   3.787   5.619   9.043
 1081    HZ2  LYS  25           HZ2      LYS  25   3.020   4.349   9.858
 1082    HZ3  LYS  25           HZ3      LYS  25   4.712   4.384   9.736
 1083    H    THR  26           H        THR  26   3.018   8.756  16.420
 1084    HA   THR  26           HA       THR  26   3.296  11.581  15.764
 1085    HB   THR  26           HB       THR  26   2.767  11.017  18.084
 1086    HG1  THR  26           HG1      THR  26   4.996  12.433  17.307
 1087   HG21  THR  26          HG21      THR  26   4.454   9.937  19.513
 1088   HG22  THR  26          HG22      THR  26   5.448   9.632  18.089
 1089   HG23  THR  26          HG23      THR  26   3.872   8.856  18.248
 1090    H    THR  27           H        THR  27   5.012   8.700  15.253
 1091    HA   THR  27           HA       THR  27   7.347  10.296  14.483
 1092    HB   THR  27           HB       THR  27   8.745   8.227  15.128
 1093    HG1  THR  27           HG1      THR  27   6.827   7.818  17.144
 1094   HG21  THR  27          HG21      THR  27   8.975  10.368  16.239
 1095   HG22  THR  27          HG22      THR  27   9.024   9.069  17.434
 1096   HG23  THR  27          HG23      THR  27   7.559  10.031  17.236
 1097    H    ALA  28           H        ALA  28   8.097   9.907  12.501
 1098    HA   ALA  28           HA       ALA  28   7.618   7.310  11.261
 1099    HB1  ALA  28           HB1      ALA  28   6.621   8.219   9.263
 1100    HB2  ALA  28           HB2      ALA  28   6.726   9.854   9.916
 1101    HB3  ALA  28           HB3      ALA  28   5.648   8.674  10.662
 1102    H    THR  29           H        THR  29   8.903   6.990   9.334
 1103    HA   THR  29           HA       THR  29  11.406   8.480   9.548
 1104    HB   THR  29           HB       THR  29  10.895   5.884   8.096
 1105    HG1  THR  29           HG1      THR  29  10.786   6.264  10.660
 1106   HG21  THR  29          HG21      THR  29  13.448   7.191   9.040
 1107   HG22  THR  29          HG22      THR  29  12.905   7.066   7.367
 1108   HG23  THR  29          HG23      THR  29  13.325   5.610   8.268
 1109    H    ASP  30           H        ASP  30  11.905   9.955   8.108
 1110    HA   ASP  30           HA       ASP  30  10.518  10.423   5.682
 1111    HB2  ASP  30           HB3      ASP  30  11.790  12.186   6.874
 1112    HB3  ASP  30           HB2      ASP  30  13.291  11.321   6.550
 1113    H    ILE  31           H        ILE  31  11.468  10.292   3.533
 1114    HA   ILE  31           HA       ILE  31  12.169   7.678   2.864
 1115    HB   ILE  31           HB       ILE  31  11.009   9.247   1.358
 1116   HG12  ILE  31          HG13      ILE  31  13.593   8.214   0.166
 1117   HG13  ILE  31          HG12      ILE  31  12.152   7.242   0.444
 1118   HG21  ILE  31          HG21      ILE  31  12.259  11.264   1.839
 1119   HG22  ILE  31          HG22      ILE  31  12.289  10.928   0.109
 1120   HG23  ILE  31          HG23      ILE  31  13.704  10.575   1.100
 1121   HD11  ILE  31          HD11      ILE  31  10.909   8.650  -1.114
 1122   HD12  ILE  31          HD12      ILE  31  12.318   7.909  -1.873
 1123   HD13  ILE  31          HD13      ILE  31  12.361   9.607  -1.398
 1124    H    LYS  32           H        LYS  32  14.166  10.277   3.878
 1125    HA   LYS  32           HA       LYS  32  16.582   9.194   2.692
 1126    HB2  LYS  32           HB3      LYS  32  16.264  11.434   4.687
 1127    HB3  LYS  32           HB2      LYS  32  17.694  11.084   3.721
 1128    HG2  LYS  32           HG3      LYS  32  16.539  11.660   1.703
 1129    HG3  LYS  32           HG2      LYS  32  15.018  11.836   2.575
 1130    HD2  LYS  32           HD3      LYS  32  16.281  13.605   3.952
 1131    HD3  LYS  32           HD2      LYS  32  17.434  13.601   2.613
 1132    HE2  LYS  32           HE3      LYS  32  15.861  15.320   2.155
 1133    HE3  LYS  32           HE2      LYS  32  15.486  13.977   1.077
 1134    HZ1  LYS  32           HZ1      LYS  32  14.035  14.829   3.502
 1135    HZ2  LYS  32           HZ2      LYS  32  13.815  13.291   2.847
 1136    HZ3  LYS  32           HZ3      LYS  32  13.439  14.667   1.931
 1137    H    GLY  33           H        GLY  33  14.743   8.584   5.432
 1138    HA2  GLY  33           HA3      GLY  33  15.307   6.752   6.862
 1139    HA3  GLY  33           HA2      GLY  33  17.007   7.130   6.621
 1140    H    LYS  34           H        LYS  34  14.942   9.799   7.222
 1141    HA   LYS  34           HA       LYS  34  16.123  10.091   9.885
 1142    HB2  LYS  34           HB3      LYS  34  14.638  12.107   8.195
 1143    HB3  LYS  34           HB2      LYS  34  15.458  12.443   9.708
 1144    HG2  LYS  34           HG3      LYS  34  16.774  11.535   7.161
 1145    HG3  LYS  34           HG2      LYS  34  16.757  13.178   7.785
 1146    HD2  LYS  34           HD3      LYS  34  17.923  12.368   9.817
 1147    HD3  LYS  34           HD2      LYS  34  18.024  10.773   9.069
 1148    HE2  LYS  34           HE3      LYS  34  20.106  11.943   8.738
 1149    HE3  LYS  34           HE2      LYS  34  19.276  11.762   7.196
 1150    HZ1  LYS  34           HZ1      LYS  34  19.325  14.212   8.866
 1151    HZ2  LYS  34           HZ2      LYS  34  18.501  14.049   7.402
 1152    HZ3  LYS  34           HZ3      LYS  34  20.189  13.973   7.434
 1153    H    GLU  35           H        GLU  35  14.927   9.642  11.627
 1154    HA   GLU  35           HA       GLU  35  12.071   9.262  11.359
 1155    HB2  GLU  35           HB3      GLU  35  13.374   7.681  12.700
 1156    HB3  GLU  35           HB2      GLU  35  13.876   8.987  13.763
 1157    HG2  GLU  35           HG3      GLU  35  11.660   9.281  14.577
 1158    HG3  GLU  35           HG2      GLU  35  11.010   8.185  13.363
 1159    H    VAL  36           H        VAL  36  10.700  10.859  11.552
 1160    HA   VAL  36           HA       VAL  36  11.488  13.223  13.118
 1161    HB   VAL  36           HB       VAL  36  10.092  14.559  11.553
 1162   HG11  VAL  36          HG11      VAL  36  11.675  14.518   9.676
 1163   HG12  VAL  36          HG12      VAL  36  12.324  12.989  10.271
 1164   HG13  VAL  36          HG13      VAL  36  12.499  14.456  11.235
 1165   HG21  VAL  36          HG21      VAL  36  10.001  12.012   9.939
 1166   HG22  VAL  36          HG22      VAL  36   9.410  13.592   9.422
 1167   HG23  VAL  36          HG23      VAL  36   8.633  12.757  10.767
 1168    H    THR  37           H        THR  37   9.696  14.514  13.929
 1169    HA   THR  37           HA       THR  37   7.669  12.814  15.112
 1170    HB   THR  37           HB       THR  37   8.136  15.761  15.566
 1171    HG1  THR  37           HG1      THR  37   9.141  13.622  17.159
 1172   HG21  THR  37          HG21      THR  37   5.986  14.937  16.371
 1173   HG22  THR  37          HG22      THR  37   7.048  15.316  17.727
 1174   HG23  THR  37          HG23      THR  37   6.798  13.639  17.247
 1175    H    VAL  38           H        VAL  38   5.762  12.585  14.202
 1176    HA   VAL  38           HA       VAL  38   5.012  14.282  11.983
 1177    HB   VAL  38           HB       VAL  38   3.591  11.862  13.100
 1178   HG11  VAL  38          HG11      VAL  38   3.343  13.216  10.420
 1179   HG12  VAL  38          HG12      VAL  38   2.163  13.293  11.729
 1180   HG13  VAL  38          HG13      VAL  38   2.496  11.756  10.932
 1181   HG21  VAL  38          HG21      VAL  38   5.568  12.056  10.836
 1182   HG22  VAL  38          HG22      VAL  38   4.655  10.616  11.283
 1183   HG23  VAL  38          HG23      VAL  38   5.845  11.287  12.399
 1184    H    LEU  39           H        LEU  39   3.398  15.740  11.959
 1185    HA   LEU  39           HA       LEU  39   1.962  16.261  14.442
 1186    HB2  LEU  39           HB3      LEU  39   1.940  17.798  11.835
 1187    HB3  LEU  39           HB2      LEU  39   1.256  18.332  13.361
 1188    HG   LEU  39           HG       LEU  39   4.194  17.868  12.849
 1189   HD11  LEU  39          HD11      LEU  39   4.390  20.297  12.941
 1190   HD12  LEU  39          HD12      LEU  39   2.637  20.434  13.085
 1191   HD13  LEU  39          HD13      LEU  39   3.352  19.784  11.610
 1192   HD21  LEU  39          HD21      LEU  39   2.748  19.021  15.225
 1193   HD22  LEU  39          HD22      LEU  39   4.498  18.997  15.005
 1194   HD23  LEU  39          HD23      LEU  39   3.607  17.482  15.166
 1195    H    ALA  40           H        ALA  40  -0.130  15.732  14.719
 1196    HA   ALA  40           HA       ALA  40  -1.217  13.841  12.869
 1197    HB1  ALA  40           HB1      ALA  40  -2.432  14.957  15.387
 1198    HB2  ALA  40           HB2      ALA  40  -1.372  13.551  15.300
 1199    HB3  ALA  40           HB3      ALA  40  -2.952  13.511  14.522
 1200    H    GLU  41           H        GLU  41  -1.422  17.184  13.011
 1201    HA   GLU  41           HA       GLU  41  -3.835  17.111  11.378
 1202    HB2  GLU  41           HB3      GLU  41  -4.688  19.134  12.612
 1203    HB3  GLU  41           HB2      GLU  41  -4.730  17.625  13.514
 1204    HG2  GLU  41           HG3      GLU  41  -2.645  18.278  14.647
 1205    HG3  GLU  41           HG2      GLU  41  -2.693  19.821  13.795
 1206    H    VAL  42           H        VAL  42  -3.169  17.851   9.511
 1207    HA   VAL  42           HA       VAL  42  -2.557  20.650   9.381
 1208    HB   VAL  42           HB       VAL  42  -0.287  19.907   9.414
 1209   HG11  VAL  42          HG11      VAL  42  -1.037  17.915   7.284
 1210   HG12  VAL  42          HG12      VAL  42  -0.574  17.557   8.948
 1211   HG13  VAL  42          HG13      VAL  42   0.606  18.246   7.833
 1212   HG21  VAL  42          HG21      VAL  42  -1.173  20.462   6.591
 1213   HG22  VAL  42          HG22      VAL  42   0.498  20.535   7.149
 1214   HG23  VAL  42          HG23      VAL  42  -0.703  21.643   7.812
 1215    H    ASN  43           H        ASN  43  -4.440  21.020   8.364
 1216    HA   ASN  43           HA       ASN  43  -4.705  20.000   5.649
 1217    HB2  ASN  43           HB3      ASN  43  -6.847  19.718   7.765
 1218    HB3  ASN  43           HB2      ASN  43  -7.165  19.577   6.042
 1219   HD21  ASN  43          HD21      ASN  43  -5.975  18.022   8.857
 1220   HD22  ASN  43          HD22      ASN  43  -5.618  16.499   8.118
 1221    H    ILE  44           H        ILE  44  -4.800  21.780   4.463
 1222    HA   ILE  44           HA       ILE  44  -5.711  23.622   3.490
 1223    HB   ILE  44           HB       ILE  44  -7.814  23.449   5.657
 1224   HG12  ILE  44          HG13      ILE  44  -7.920  22.497   2.781
 1225   HG13  ILE  44          HG12      ILE  44  -7.657  21.444   4.170
 1226   HG21  ILE  44          HG21      ILE  44  -7.662  25.675   4.646
 1227   HG22  ILE  44          HG22      ILE  44  -9.164  24.864   4.211
 1228   HG23  ILE  44          HG23      ILE  44  -7.844  24.960   3.047
 1229   HD11  ILE  44          HD11      ILE  44  -9.858  22.058   5.041
 1230   HD12  ILE  44          HD12      ILE  44  -9.963  21.350   3.429
 1231   HD13  ILE  44          HD13      ILE  44 -10.120  23.095   3.641
 1232    H    ASN  45           H        ASN  45  -5.048  25.673   3.562
 1233    HA   ASN  45           HA       ASN  45  -4.078  26.747   6.081
 1234    HB2  ASN  45           HB3      ASN  45  -3.857  27.647   3.212
 1235    HB3  ASN  45           HB2      ASN  45  -3.442  28.738   4.530
 1236   HD21  ASN  45          HD21      ASN  45  -2.900  25.270   4.590
 1237   HD22  ASN  45          HD22      ASN  45  -1.174  25.350   4.557
 1238    H    ASN  46           H        ASN  46  -6.472  26.590   6.695
 1239    HA   ASN  46           HA       ASN  46  -7.492  29.235   6.891
 1240    HB2  ASN  46           HB3      ASN  46  -8.309  28.695   4.606
 1241    HB3  ASN  46           HB2      ASN  46  -9.159  27.300   5.261
 1242   HD21  ASN  46          HD21      ASN  46 -11.064  27.590   6.351
 1243   HD22  ASN  46          HD22      ASN  46 -11.878  29.113   6.451
 1244    H    SER  47           H        SER  47  -8.655  25.859   6.922
 1245    HA   SER  47           HA       SER  47  -9.072  26.134   9.809
 1246    HB2  SER  47           HB3      SER  47 -11.273  26.379   8.622
 1247    HB3  SER  47           HB2      SER  47 -11.034  24.774   7.938
 1248    HG   SER  47           HG       SER  47 -11.631  25.532  10.561
 1249    H    VAL  48           H        VAL  48  -7.827  24.663  10.758
 1250    HA   VAL  48           HA       VAL  48  -6.871  22.417   9.141
 1251    HB   VAL  48           HB       VAL  48  -5.728  23.680  11.634
 1252   HG11  VAL  48          HG11      VAL  48  -3.789  22.212  11.287
 1253   HG12  VAL  48          HG12      VAL  48  -4.659  21.388   9.993
 1254   HG13  VAL  48          HG13      VAL  48  -5.255  21.303  11.650
 1255   HG21  VAL  48          HG21      VAL  48  -5.452  25.041   9.642
 1256   HG22  VAL  48          HG22      VAL  48  -4.766  23.665   8.776
 1257   HG23  VAL  48          HG23      VAL  48  -3.902  24.365  10.146
 1258    H    PHE  49           H        PHE  49  -7.828  20.543   9.459
 1259    HA   PHE  49           HA       PHE  49  -8.565  19.793  12.205
 1260    HB2  PHE  49           HB3      PHE  49 -10.063  18.087  11.172
 1261    HB3  PHE  49           HB2      PHE  49 -10.513  19.737  10.765
 1262    HD1  PHE  49           HD1      PHE  49 -10.031  20.611   8.480
 1263    HD2  PHE  49           HD2      PHE  49  -9.465  16.520   9.516
 1264    HE1  PHE  49           HE1      PHE  49 -10.043  20.006   6.092
 1265    HE2  PHE  49           HE2      PHE  49  -9.466  15.913   7.134
 1266    HZ   PHE  49           HZ       PHE  49  -9.756  17.655   5.419
 1267    H    ARG  50           H        ARG  50  -8.491  17.228  12.380
 1268    HA   ARG  50           HA       ARG  50  -5.682  16.636  11.989
 1269    HB2  ARG  50           HB3      ARG  50  -6.049  14.727  13.451
 1270    HB3  ARG  50           HB2      ARG  50  -6.731  16.179  14.167
 1271    HG2  ARG  50           HG3      ARG  50  -8.960  15.474  13.470
 1272    HG3  ARG  50           HG2      ARG  50  -8.273  14.026  12.734
 1273    HD2  ARG  50           HD3      ARG  50  -7.507  13.244  14.880
 1274    HD3  ARG  50           HD2      ARG  50  -8.037  14.738  15.652
 1275    HE   ARG  50           HE       ARG  50 -10.304  13.780  14.526
 1276   HH11  ARG  50          HH11      ARG  50  -7.924  12.429  16.698
 1277   HH12  ARG  50          HH12      ARG  50  -9.048  11.360  17.473
 1278   HH21  ARG  50          HH21      ARG  50 -11.800  12.393  15.558
 1279   HH22  ARG  50          HH22      ARG  50 -11.258  11.349  16.834
 1280    H    GLN  51           H        GLN  51  -4.975  14.502  11.253
 1281    HA   GLN  51           HA       GLN  51  -6.712  13.426   9.132
 1282    HB2  GLN  51           HB3      GLN  51  -4.623  13.128   7.765
 1283    HB3  GLN  51           HB2      GLN  51  -5.110  14.801   8.003
 1284    HG2  GLN  51           HG3      GLN  51  -3.412  15.121   9.663
 1285    HG3  GLN  51           HG2      GLN  51  -2.995  13.407   9.631
 1286   HE21  GLN  51          HE21      GLN  51  -1.794  12.602   7.939
 1287   HE22  GLN  51          HE22      GLN  51  -0.958  13.623   6.821
 1288    H    TYR  52           H        TYR  52  -5.988  11.252   8.391
 1289    HA   TYR  52           HA       TYR  52  -4.709   9.734  10.571
 1290    HB2  TYR  52           HB3      TYR  52  -6.952   8.736   8.796
 1291    HB3  TYR  52           HB2      TYR  52  -6.214   7.880  10.144
 1292    HD1  TYR  52           HD1      TYR  52  -6.426   9.047  12.478
 1293    HD2  TYR  52           HD2      TYR  52  -8.892   9.935   9.127
 1294    HE1  TYR  52           HE1      TYR  52  -8.134   9.967  13.984
 1295    HE2  TYR  52           HE2      TYR  52 -10.603  10.862  10.627
 1296    HH   TYR  52           HH       TYR  52 -10.015  11.586  13.861
 1297    H    PHE  53           H        PHE  53  -3.448   7.960   9.945
 1298    HA   PHE  53           HA       PHE  53  -2.640   7.961   7.121
 1299    HB2  PHE  53           HB3      PHE  53  -1.158   6.937   9.560
 1300    HB3  PHE  53           HB2      PHE  53  -0.544   6.916   7.908
 1301    HD1  PHE  53           HD1      PHE  53  -0.281   9.156   6.724
 1302    HD2  PHE  53           HD2      PHE  53  -0.814   8.785  10.925
 1303    HE1  PHE  53           HE1      PHE  53   0.649  11.409   7.031
 1304    HE2  PHE  53           HE2      PHE  53   0.112  11.042  11.244
 1305    HZ   PHE  53           HZ       PHE  53   0.842  12.356   9.295
 1306    H    PHE  54           H        PHE  54  -2.541   6.044   5.985
 1307    HA   PHE  54           HA       PHE  54  -4.324   3.970   6.935
 1308    HB2  PHE  54           HB3      PHE  54  -4.440   4.854   4.602
 1309    HB3  PHE  54           HB2      PHE  54  -2.828   4.216   4.306
 1310    HD1  PHE  54           HD1      PHE  54  -2.573   2.076   3.454
 1311    HD2  PHE  54           HD2      PHE  54  -6.249   3.161   5.308
 1312    HE1  PHE  54           HE1      PHE  54  -3.568  -0.047   2.715
 1313    HE2  PHE  54           HE2      PHE  54  -7.248   1.039   4.576
 1314    HZ   PHE  54           HZ       PHE  54  -5.912  -0.571   3.277
 1315    H    GLU  55           H        GLU  55  -3.282   2.808   8.498
 1316    HA   GLU  55           HA       GLU  55  -0.612   1.736   7.863
 1317    HB2  GLU  55           HB3      GLU  55  -2.004   2.076  10.533
 1318    HB3  GLU  55           HB2      GLU  55  -0.417   1.350  10.313
 1319    HG2  GLU  55           HG3      GLU  55  -0.714   4.037   9.156
 1320    HG3  GLU  55           HG2      GLU  55  -0.854   3.959  10.912
 1321    H    THR  56           H        THR  56  -0.840  -0.170   6.924
 1322    HA   THR  56           HA       THR  56  -2.665  -2.142   8.137
 1323    HB   THR  56           HB       THR  56  -1.484  -2.199   5.349
 1324    HG1  THR  56           HG1      THR  56  -2.993  -0.748   5.008
 1325   HG21  THR  56          HG21      THR  56  -2.035  -4.413   6.219
 1326   HG22  THR  56          HG22      THR  56  -3.168  -3.951   4.949
 1327   HG23  THR  56          HG23      THR  56  -3.654  -3.861   6.642
 1328    H    LYS  57           H        LYS  57  -1.447  -3.169   9.625
 1329    HA   LYS  57           HA       LYS  57   1.332  -3.817   8.922
 1330    HB2  LYS  57           HB3      LYS  57   0.915  -2.373  10.914
 1331    HB3  LYS  57           HB2      LYS  57   0.049  -3.709  11.657
 1332    HG2  LYS  57           HG3      LYS  57   2.042  -5.027  11.757
 1333    HG3  LYS  57           HG2      LYS  57   2.935  -3.832  10.819
 1334    HD2  LYS  57           HD3      LYS  57   1.702  -3.301  13.512
 1335    HD3  LYS  57           HD2      LYS  57   3.391  -3.734  13.262
 1336    HE2  LYS  57           HE3      LYS  57   3.743  -1.741  11.943
 1337    HE3  LYS  57           HE2      LYS  57   2.034  -1.330  12.057
 1338    HZ1  LYS  57           HZ1      LYS  57   3.942  -1.456  14.324
 1339    HZ2  LYS  57           HZ2      LYS  57   2.298  -1.088  14.452
 1340    HZ3  LYS  57           HZ3      LYS  57   3.335  -0.047  13.617
 1341    H    CYS  58           H        CYS  58   2.088  -5.848   8.989
 1342    HA   CYS  58           HA       CYS  58   0.229  -8.012   8.893
 1343    HB2  CYS  58           HB3      CYS  58   3.257  -8.051   8.930
 1344    HB3  CYS  58           HB2      CYS  58   2.218  -9.404   8.500
 1345    H    ARG  59           H        ARG  59  -0.651  -8.844  10.652
 1346    HA   ARG  59           HA       ARG  59   0.875  -8.837  13.160
 1347    HB2  ARG  59           HB3      ARG  59  -1.306  -9.124  14.271
 1348    HB3  ARG  59           HB2      ARG  59  -1.274  -7.688  13.259
 1349    HG2  ARG  59           HG3      ARG  59  -2.479  -8.892  11.514
 1350    HG3  ARG  59           HG2      ARG  59  -2.524 -10.327  12.537
 1351    HD2  ARG  59           HD3      ARG  59  -3.733  -7.657  13.227
 1352    HD3  ARG  59           HD2      ARG  59  -4.621  -9.035  12.593
 1353    HE   ARG  59           HE       ARG  59  -3.144  -9.569  15.014
 1354   HH11  ARG  59          HH11      ARG  59  -6.185  -8.541  13.616
 1355   HH12  ARG  59          HH12      ARG  59  -7.112  -8.921  15.032
 1356   HH21  ARG  59          HH21      ARG  59  -4.366 -10.078  16.883
 1357   HH22  ARG  59          HH22      ARG  59  -6.077  -9.794  16.887
 1358    H    ALA  60           H        ALA  60   0.497 -10.809  10.695
 1359    HA   ALA  60           HA       ALA  60   0.864 -13.189  12.333
 1360    HB1  ALA  60           HB1      ALA  60  -1.520 -13.221  11.804
 1361    HB2  ALA  60           HB2      ALA  60  -0.680 -14.507  10.937
 1362    HB3  ALA  60           HB3      ALA  60  -1.155 -13.037  10.089
 1363    H    SER  61           H        SER  61   2.236 -14.707  11.349
 1364    HA   SER  61           HA       SER  61   2.995 -14.411   8.585
 1365    HB2  SER  61           HB3      SER  61   4.993 -13.761  10.763
 1366    HB3  SER  61           HB2      SER  61   5.407 -14.017   9.070
 1367    HG   SER  61           HG       SER  61   3.396 -12.220   9.318
 1368    H    ASN  62           H        ASN  62   1.893 -16.582  10.100
 1369    HA   ASN  62           HA       ASN  62   4.180 -18.427   9.954
 1370    HB2  ASN  62           HB3      ASN  62   2.822 -20.005  11.368
 1371    HB3  ASN  62           HB2      ASN  62   3.338 -18.536  12.184
 1372   HD21  ASN  62          HD21      ASN  62   0.650 -20.365  11.002
 1373   HD22  ASN  62          HD22      ASN  62  -0.580 -19.399  11.739
 1374    HA   PRO  63           HA       PRO  63   3.435 -19.711   6.010
 1375    HB2  PRO  63           HB3      PRO  63   2.931 -22.459   7.012
 1376    HB3  PRO  63           HB2      PRO  63   4.092 -21.885   5.810
 1377    HG2  PRO  63           HG3      PRO  63   4.539 -22.380   8.587
 1378    HG3  PRO  63           HG2      PRO  63   5.691 -21.751   7.401
 1379    HD2  PRO  63           HD3      PRO  63   4.715 -20.317   9.565
 1380    HD3  PRO  63           HD2      PRO  63   5.377 -19.579   8.082
 1381    H    VAL  64           H        VAL  64   1.137 -21.714   7.940
 1382    HA   VAL  64           HA       VAL  64  -0.630 -21.485   5.632
 1383    HB   VAL  64           HB       VAL  64  -1.907 -23.368   6.954
 1384   HG11  VAL  64          HG11      VAL  64   0.713 -23.822   5.527
 1385   HG12  VAL  64          HG12      VAL  64  -0.855 -23.589   4.755
 1386   HG13  VAL  64          HG13      VAL  64  -0.565 -25.016   5.750
 1387   HG21  VAL  64          HG21      VAL  64  -0.499 -23.209   8.970
 1388   HG22  VAL  64          HG22      VAL  64   0.910 -23.646   8.005
 1389   HG23  VAL  64          HG23      VAL  64  -0.405 -24.802   8.221
 1390    H    GLU  65           H        GLU  65  -1.776 -22.187   8.885
 1391    HA   GLU  65           HA       GLU  65  -4.247 -21.098   8.460
 1392    HB2  GLU  65           HB3      GLU  65  -4.508 -21.130  10.941
 1393    HB3  GLU  65           HB2      GLU  65  -3.898 -22.626  10.251
 1394    HG2  GLU  65           HG3      GLU  65  -1.628 -21.999  10.917
 1395    HG3  GLU  65           HG2      GLU  65  -2.256 -20.511  11.623
 1396    H    SER  66           H        SER  66  -1.437 -19.417   9.796
 1397    HA   SER  66           HA       SER  66  -2.984 -16.927   9.578
 1398    HB2  SER  66           HB3      SER  66  -0.951 -17.491  11.750
 1399    HB3  SER  66           HB2      SER  66  -1.986 -16.067  11.602
 1400    HG   SER  66           HG       SER  66  -3.745 -17.801  11.654
 1401    H    GLY  67           H        GLY  67  -1.543 -17.852   7.527
 1402    HA2  GLY  67           HA3      GLY  67   0.648 -15.893   7.418
 1403    HA3  GLY  67           HA2      GLY  67   0.921 -17.542   6.853
 1404    H    CYS  68           H        CYS  68  -0.205 -18.283   4.991
 1405    HA   CYS  68           HA       CYS  68  -1.648 -16.200   3.513
 1406    HB2  CYS  68           HB3      CYS  68   0.493 -17.986   2.334
 1407    HB3  CYS  68           HB2      CYS  68  -0.533 -16.882   1.414
 1408    H    ARG  69           H        ARG  69  -1.202 -19.525   4.312
 1409    HA   ARG  69           HA       ARG  69  -2.531 -21.355   4.158
 1410    HB2  ARG  69           HB3      ARG  69  -4.630 -19.436   3.114
 1411    HB3  ARG  69           HB2      ARG  69  -4.924 -21.087   3.655
 1412    HG2  ARG  69           HG3      ARG  69  -4.171 -20.455   5.910
 1413    HG3  ARG  69           HG2      ARG  69  -3.927 -18.804   5.345
 1414    HD2  ARG  69           HD3      ARG  69  -6.322 -18.659   4.794
 1415    HD3  ARG  69           HD2      ARG  69  -6.552 -20.294   5.427
 1416    HE   ARG  69           HE       ARG  69  -5.303 -18.689   7.381
 1417   HH11  ARG  69          HH11      ARG  69  -8.403 -19.142   5.833
 1418   HH12  ARG  69          HH12      ARG  69  -9.304 -18.532   7.183
 1419   HH21  ARG  69          HH21      ARG  69  -6.474 -17.906   9.159
 1420   HH22  ARG  69          HH22      ARG  69  -8.206 -17.823   9.083
 1421    H    GLY  70           H        GLY  70  -3.195 -22.947   2.655
 1422    HA2  GLY  70           HA3      GLY  70  -3.420 -23.943   0.569
 1423    HA3  GLY  70           HA2      GLY  70  -3.389 -22.338  -0.157
 1424    H    ILE  71           H        ILE  71  -0.910 -21.500   0.887
 1425    HA   ILE  71           HA       ILE  71   0.905 -22.362  -1.019
 1426    HB   ILE  71           HB       ILE  71   1.467 -21.155   1.695
 1427   HG12  ILE  71          HG13      ILE  71  -0.000 -19.751   0.351
 1428   HG13  ILE  71          HG12      ILE  71   1.599 -19.024   0.450
 1429   HG21  ILE  71          HG21      ILE  71   3.600 -20.424   0.748
 1430   HG22  ILE  71          HG22      ILE  71   3.240 -21.300  -0.741
 1431   HG23  ILE  71          HG23      ILE  71   3.469 -22.183   0.768
 1432   HD11  ILE  71          HD11      ILE  71   0.736 -18.796  -1.782
 1433   HD12  ILE  71          HD12      ILE  71   0.452 -20.532  -1.888
 1434   HD13  ILE  71          HD13      ILE  71   2.101 -19.911  -1.798
 1435    H    ASP  72           H        ASP  72   2.340 -23.975  -1.167
 1436    HA   ASP  72           HA       ASP  72   2.279 -26.135   0.718
 1437    HB2  ASP  72           HB3      ASP  72   2.521 -26.651  -1.640
 1438    HB3  ASP  72           HB2      ASP  72   3.975 -25.660  -1.746
 1439    H    SER  73           H        SER  73   3.389 -26.117   2.547
 1440    HA   SER  73           HA       SER  73   5.453 -24.180   2.999
 1441    HB2  SER  73           HB3      SER  73   5.456 -25.214   5.307
 1442    HB3  SER  73           HB2      SER  73   3.897 -24.581   4.779
 1443    HG   SER  73           HG       SER  73   4.621 -27.135   5.397
 1444    H    LYS  74           H        LYS  74   5.492 -27.232   1.666
 1445    HA   LYS  74           HA       LYS  74   7.940 -28.156   2.858
 1446    HB2  LYS  74           HB3      LYS  74   6.249 -29.747   2.055
 1447    HB3  LYS  74           HB2      LYS  74   6.439 -29.131   0.422
 1448    HG2  LYS  74           HG3      LYS  74   8.680 -29.976   0.298
 1449    HG3  LYS  74           HG2      LYS  74   8.639 -30.448   1.998
 1450    HD2  LYS  74           HD3      LYS  74   8.288 -32.381   0.572
 1451    HD3  LYS  74           HD2      LYS  74   6.833 -32.028   1.498
 1452    HE2  LYS  74           HE3      LYS  74   5.880 -30.892  -0.449
 1453    HE3  LYS  74           HE2      LYS  74   7.326 -31.272  -1.374
 1454    HZ1  LYS  74           HZ1      LYS  74   6.845 -33.622  -1.086
 1455    HZ2  LYS  74           HZ2      LYS  74   5.553 -32.834  -1.836
 1456    HZ3  LYS  74           HZ3      LYS  74   5.451 -33.250  -0.202
 1457    H    HIS  75           H        HIS  75   6.956 -26.827  -0.277
 1458    HA   HIS  75           HA       HIS  75   9.770 -26.572  -1.047
 1459    HB2  HIS  75           HB3      HIS  75   8.177 -27.550  -2.668
 1460    HB3  HIS  75           HB2      HIS  75   7.257 -26.049  -2.653
 1461    HD1  HIS  75           HD1      HIS  75   7.889 -24.378  -4.378
 1462    HD2  HIS  75           HD2      HIS  75  10.911 -27.148  -3.703
 1463    HE1  HIS  75           HE1      HIS  75   9.664 -23.867  -6.081
 1464    HE2  HIS  75           HE2      HIS  75  11.353 -25.715  -5.810
 1465    H    TRP  76           H        TRP  76   7.053 -24.644  -0.053
 1466    HA   TRP  76           HA       TRP  76   8.635 -22.215  -0.573
 1467    HB2  TRP  76           HB3      TRP  76   5.631 -22.569  -0.697
 1468    HB3  TRP  76           HB2      TRP  76   6.444 -21.007  -0.753
 1469    HD1  TRP  76           HD1      TRP  76   5.230 -23.731  -2.942
 1470    HE1  TRP  76           HE1      TRP  76   6.003 -23.340  -5.367
 1471    HE3  TRP  76           HE3      TRP  76   8.696 -20.062  -2.112
 1472    HZ2  TRP  76           HZ2      TRP  76   7.837 -21.703  -6.739
 1473    HZ3  TRP  76           HZ3      TRP  76   9.915 -19.138  -4.037
 1474    HH2  TRP  76           HH2      TRP  76   9.494 -19.944  -6.304
 1475    H    ASN  77           H        ASN  77   8.440 -20.524   0.921
 1476    HA   ASN  77           HA       ASN  77   6.996 -21.150   3.411
 1477    HB2  ASN  77           HB3      ASN  77   9.444 -21.172   3.793
 1478    HB3  ASN  77           HB2      ASN  77   9.557 -19.552   3.123
 1479   HD21  ASN  77          HD21      ASN  77   8.481 -21.468   5.820
 1480   HD22  ASN  77          HD22      ASN  77   8.294 -20.153   6.931
 1481    H    SER  78           H        SER  78   5.551 -19.618   4.035
 1482    HA   SER  78           HA       SER  78   5.327 -17.295   2.271
 1483    HB2  SER  78           HB3      SER  78   2.940 -17.301   3.394
 1484    HB3  SER  78           HB2      SER  78   3.317 -18.417   2.081
 1485    HG   SER  78           HG       SER  78   2.363 -19.141   4.299
 1486    H    TYR  79           H        TYR  79   5.399 -15.283   3.019
 1487    HA   TYR  79           HA       TYR  79   5.375 -14.820   5.904
 1488    HB2  TYR  79           HB3      TYR  79   7.721 -15.125   5.432
 1489    HB3  TYR  79           HB2      TYR  79   7.629 -14.071   4.024
 1490    HD1  TYR  79           HD1      TYR  79   8.232 -11.842   4.236
 1491    HD2  TYR  79           HD2      TYR  79   7.149 -14.016   7.727
 1492    HE1  TYR  79           HE1      TYR  79   8.879  -9.923   5.622
 1493    HE2  TYR  79           HE2      TYR  79   7.791 -12.097   9.126
 1494    HH   TYR  79           HH       TYR  79   9.158 -10.130   9.046
 1495    H    CYS  80           H        CYS  80   4.560 -12.855   6.472
 1496    HA   CYS  80           HA       CYS  80   3.399 -11.281   4.308
 1497    HB2  CYS  80           HB3      CYS  80   2.935 -11.158   7.297
 1498    HB3  CYS  80           HB2      CYS  80   2.033 -10.255   6.078
 1499    H    THR  81           H        THR  81   4.388  -9.507   3.630
 1500    HA   THR  81           HA       THR  81   6.315  -8.218   5.452
 1501    HB   THR  81           HB       THR  81   6.273  -8.041   2.431
 1502    HG1  THR  81           HG1      THR  81   6.751 -10.183   3.451
 1503   HG21  THR  81          HG21      THR  81   8.551  -7.187   2.702
 1504   HG22  THR  81          HG22      THR  81   8.396  -7.307   4.454
 1505   HG23  THR  81          HG23      THR  81   7.391  -6.170   3.556
 1506    H    THR  82           H        THR  82   5.978  -6.161   6.039
 1507    HA   THR  82           HA       THR  82   3.650  -4.769   5.066
 1508    HB   THR  82           HB       THR  82   4.758  -2.984   6.717
 1509    HG1  THR  82           HG1      THR  82   6.212  -3.835   8.034
 1510   HG21  THR  82          HG21      THR  82   2.570  -4.013   7.021
 1511   HG22  THR  82          HG22      THR  82   3.466  -4.013   8.541
 1512   HG23  THR  82          HG23      THR  82   3.331  -5.496   7.596
 1513    H    THR  83           H        THR  83   3.911  -3.943   3.081
 1514    HA   THR  83           HA       THR  83   6.331  -2.668   2.222
 1515    HB   THR  83           HB       THR  83   3.599  -2.423   0.952
 1516    HG1  THR  83           HG1      THR  83   5.561  -4.470   0.574
 1517   HG21  THR  83          HG21      THR  83   6.385  -2.344  -0.220
 1518   HG22  THR  83          HG22      THR  83   5.357  -0.942   0.070
 1519   HG23  THR  83          HG23      THR  83   4.877  -2.155  -1.115
 1520    H    HIS  84           H        HIS  84   6.849  -0.554   2.388
 1521    HA   HIS  84           HA       HIS  84   4.916   1.155   3.798
 1522    HB2  HIS  84           HB3      HIS  84   7.921   1.499   3.593
 1523    HB3  HIS  84           HB2      HIS  84   6.819   2.476   4.560
 1524    HD1  HIS  84           HD1      HIS  84   6.126   1.571   6.842
 1525    HD2  HIS  84           HD2      HIS  84   8.439  -1.094   4.638
 1526    HE1  HIS  84           HE1      HIS  84   6.786  -0.244   8.447
 1527    HE2  HIS  84           HE2      HIS  84   8.063  -1.911   7.058
 1528    H    THR  85           H        THR  85   4.180   2.980   2.877
 1529    HA   THR  85           HA       THR  85   5.444   3.790   0.336
 1530    HB   THR  85           HB       THR  85   2.924   3.165   0.377
 1531    HG1  THR  85           HG1      THR  85   2.780   4.410  -1.363
 1532   HG21  THR  85          HG21      THR  85   2.315   4.441   2.382
 1533   HG22  THR  85          HG22      THR  85   1.414   5.004   0.974
 1534   HG23  THR  85          HG23      THR  85   2.785   5.938   1.575
 1535    H    PHE  86           H        PHE  86   5.364   6.210  -0.044
 1536    HA   PHE  86           HA       PHE  86   6.140   7.503   2.477
 1537    HB2  PHE  86           HB3      PHE  86   7.135   8.026  -0.335
 1538    HB3  PHE  86           HB2      PHE  86   7.577   8.987   1.077
 1539    HD1  PHE  86           HD1      PHE  86   8.227   5.987  -0.806
 1540    HD2  PHE  86           HD2      PHE  86   8.824   7.906   2.945
 1541    HE1  PHE  86           HE1      PHE  86  10.057   4.417  -0.297
 1542    HE2  PHE  86           HE2      PHE  86  10.649   6.343   3.461
 1543    HZ   PHE  86           HZ       PHE  86  11.270   4.599   1.843
 1544    H    VAL  87           H        VAL  87   4.761   8.926   3.183
 1545    HA   VAL  87           HA       VAL  87   3.101  10.389   1.245
 1546    HB   VAL  87           HB       VAL  87   1.517  10.773   3.128
 1547   HG11  VAL  87          HG11      VAL  87   1.083   8.979   1.568
 1548   HG12  VAL  87          HG12      VAL  87   0.624   8.474   3.196
 1549   HG13  VAL  87          HG13      VAL  87   2.128   7.893   2.484
 1550   HG21  VAL  87          HG21      VAL  87   3.072  10.521   4.992
 1551   HG22  VAL  87          HG22      VAL  87   3.266   8.809   4.607
 1552   HG23  VAL  87          HG23      VAL  87   1.705   9.419   5.155
 1553    H    LYS  88           H        LYS  88   3.061  12.589   1.313
 1554    HA   LYS  88           HA       LYS  88   5.192  13.825   2.851
 1555    HB2  LYS  88           HB3      LYS  88   4.734  15.824   1.446
 1556    HB3  LYS  88           HB2      LYS  88   5.141  14.392   0.515
 1557    HG2  LYS  88           HG3      LYS  88   2.519  14.135   0.406
 1558    HG3  LYS  88           HG2      LYS  88   2.577  15.871   0.704
 1559    HD2  LYS  88           HD3      LYS  88   4.130  16.104  -1.201
 1560    HD3  LYS  88           HD2      LYS  88   3.938  14.383  -1.532
 1561    HE2  LYS  88           HE3      LYS  88   2.472  15.503  -2.998
 1562    HE3  LYS  88           HE2      LYS  88   1.463  14.825  -1.722
 1563    HZ1  LYS  88           HZ1      LYS  88   0.882  17.130  -2.314
 1564    HZ2  LYS  88           HZ2      LYS  88   2.415  17.638  -1.799
 1565    HZ3  LYS  88           HZ3      LYS  88   1.327  16.971  -0.687
 1566    H    ALA  89           H        ALA  89   4.751  14.399   4.814
 1567    HA   ALA  89           HA       ALA  89   2.202  15.779   5.366
 1568    HB1  ALA  89           HB1      ALA  89   3.539  13.750   7.164
 1569    HB2  ALA  89           HB2      ALA  89   2.080  13.472   6.212
 1570    HB3  ALA  89           HB3      ALA  89   2.064  14.649   7.526
 1571    H    LEU  90           H        LEU  90   2.287  17.311   7.086
 1572    HA   LEU  90           HA       LEU  90   4.798  18.669   7.288
 1573    HB2  LEU  90           HB3      LEU  90   2.540  19.796   7.238
 1574    HB3  LEU  90           HB2      LEU  90   2.263  19.178   8.860
 1575    HG   LEU  90           HG       LEU  90   4.384  20.441   9.532
 1576   HD11  LEU  90          HD11      LEU  90   3.849  21.756   6.877
 1577   HD12  LEU  90          HD12      LEU  90   5.285  20.834   7.324
 1578   HD13  LEU  90          HD13      LEU  90   4.941  22.369   8.119
 1579   HD21  LEU  90          HD21      LEU  90   2.122  21.152  10.146
 1580   HD22  LEU  90          HD22      LEU  90   1.984  22.023   8.618
 1581   HD23  LEU  90          HD23      LEU  90   3.172  22.530   9.818
 1582    H    THR  91           H        THR  91   6.337  17.737   8.481
 1583    HA   THR  91           HA       THR  91   5.605  16.772  11.172
 1584    HB   THR  91           HB       THR  91   7.335  15.066  11.007
 1585    HG1  THR  91           HG1      THR  91   8.182  16.605   8.990
 1586   HG21  THR  91          HG21      THR  91   5.626  14.986   8.515
 1587   HG22  THR  91          HG22      THR  91   5.071  14.529  10.121
 1588   HG23  THR  91          HG23      THR  91   6.355  13.610   9.340
 1589    H    THR  92           H        THR  92   7.355  16.950  12.766
 1590    HA   THR  92           HA       THR  92   9.123  19.209  12.111
 1591    HB   THR  92           HB       THR  92   7.478  19.869  13.770
 1592    HG1  THR  92           HG1      THR  92   9.059  20.949  14.635
 1593   HG21  THR  92          HG21      THR  92   7.307  18.819  15.948
 1594   HG22  THR  92          HG22      THR  92   8.538  17.639  15.503
 1595   HG23  THR  92          HG23      THR  92   6.975  17.633  14.685
 1596    H    ASP  93           H        ASP  93  11.200  18.847  12.127
 1597    HA   ASP  93           HA       ASP  93  12.327  16.330  12.774
 1598    HB2  ASP  93           HB3      ASP  93  13.675  19.002  12.315
 1599    HB3  ASP  93           HB2      ASP  93  14.512  17.459  12.405
 1600    H    GLU  94           H        GLU  94  11.981  19.354  14.465
 1601    HA   GLU  94           HA       GLU  94  12.319  18.167  17.006
 1602    HB2  GLU  94           HB3      GLU  94  14.343  19.419  17.729
 1603    HB3  GLU  94           HB2      GLU  94  14.687  18.197  16.515
 1604    HG2  GLU  94           HG3      GLU  94  14.869  19.869  14.808
 1605    HG3  GLU  94           HG2      GLU  94  14.361  21.126  15.928
 1606    H    LYS  95           H        LYS  95  12.393  21.117  15.079
 1607    HA   LYS  95           HA       LYS  95  10.704  22.407  17.108
 1608    HB2  LYS  95           HB3      LYS  95  13.028  23.664  15.638
 1609    HB3  LYS  95           HB2      LYS  95  11.886  24.546  16.641
 1610    HG2  LYS  95           HG3      LYS  95  12.632  23.449  18.604
 1611    HG3  LYS  95           HG2      LYS  95  13.580  22.289  17.674
 1612    HD2  LYS  95           HD3      LYS  95  15.049  24.075  16.917
 1613    HD3  LYS  95           HD2      LYS  95  14.083  25.259  17.802
 1614    HE2  LYS  95           HE3      LYS  95  16.123  24.625  19.014
 1615    HE3  LYS  95           HE2      LYS  95  14.659  24.211  19.899
 1616    HZ1  LYS  95           HZ1      LYS  95  14.911  21.941  19.308
 1617    HZ2  LYS  95           HZ2      LYS  95  16.402  22.467  19.905
 1618    HZ3  LYS  95           HZ3      LYS  95  16.178  22.276  18.235
 1619    H    GLN  96           H        GLN  96  12.035  23.175  13.897
 1620    HA   GLN  96           HA       GLN  96   9.629  24.473  13.078
 1621    HB2  GLN  96           HB3      GLN  96  12.097  23.661  11.536
 1622    HB3  GLN  96           HB2      GLN  96  10.777  24.596  10.851
 1623    HG2  GLN  96           HG3      GLN  96  12.552  25.409  13.141
 1624    HG3  GLN  96           HG2      GLN  96  12.594  26.047  11.499
 1625   HE21  GLN  96          HE21      GLN  96  10.958  27.465  10.826
 1626   HE22  GLN  96          HE22      GLN  96   9.904  28.240  11.952
 1627    H    ALA  97           H        ALA  97   8.041  23.791  11.761
 1628    HA   ALA  97           HA       ALA  97   7.899  20.918  11.247
 1629    HB1  ALA  97           HB1      ALA  97   5.728  22.997  11.011
 1630    HB2  ALA  97           HB2      ALA  97   6.031  22.015  12.445
 1631    HB3  ALA  97           HB3      ALA  97   5.527  21.247  10.941
 1632    H    ALA  98           H        ALA  98   8.005  20.089   9.250
 1633    HA   ALA  98           HA       ALA  98   7.667  21.837   6.934
 1634    HB1  ALA  98           HB1      ALA  98   9.762  21.074   5.933
 1635    HB2  ALA  98           HB2      ALA  98  10.126  20.146   7.388
 1636    HB3  ALA  98           HB3      ALA  98  10.060  21.907   7.457
 1637    H    TRP  99           H        TRP  99   7.163  20.726   5.019
 1638    HA   TRP  99           HA       TRP  99   5.771  18.268   5.350
 1639    HB2  TRP  99           HB3      TRP  99   6.563  19.779   2.848
 1640    HB3  TRP  99           HB2      TRP  99   5.513  18.371   2.863
 1641    HD1  TRP  99           HD1      TRP  99   5.558  22.078   3.794
 1642    HE1  TRP  99           HE1      TRP  99   3.132  22.872   4.138
 1643    HE3  TRP  99           HE3      TRP  99   3.186  17.560   3.532
 1644    HZ2  TRP  99           HZ2      TRP  99   0.558  21.728   4.284
 1645    HZ3  TRP  99           HZ3      TRP  99   0.737  17.495   3.785
 1646    HH2  TRP  99           HH2      TRP  99  -0.547  19.538   4.153
 1647    H    ARG 100           H        ARG 100   6.796  16.424   5.683
 1648    HA   ARG 100           HA       ARG 100   9.233  15.860   4.121
 1649    HB2  ARG 100           HB3      ARG 100   8.374  14.615   6.745
 1650    HB3  ARG 100           HB2      ARG 100   9.876  14.301   5.894
 1651    HG2  ARG 100           HG3      ARG 100   9.089  16.951   7.081
 1652    HG3  ARG 100           HG2      ARG 100  10.142  15.769   7.846
 1653    HD2  ARG 100           HD3      ARG 100  11.622  15.953   5.815
 1654    HD3  ARG 100           HD2      ARG 100  10.639  17.334   5.329
 1655    HE   ARG 100           HE       ARG 100  11.737  17.453   8.012
 1656   HH11  ARG 100          HH11      ARG 100  12.104  18.352   4.658
 1657   HH12  ARG 100          HH12      ARG 100  13.241  19.617   4.990
 1658   HH21  ARG 100          HH21      ARG 100  13.216  19.104   8.468
 1659   HH22  ARG 100          HH22      ARG 100  13.884  20.043   7.159
 1660    H    PHE 101           H        PHE 101   9.462  13.753   3.270
 1661    HA   PHE 101           HA       PHE 101   6.927  12.394   2.757
 1662    HB2  PHE 101           HB3      PHE 101   9.688  12.031   1.554
 1663    HB3  PHE 101           HB2      PHE 101   8.308  11.018   1.154
 1664    HD1  PHE 101           HD1      PHE 101   9.653  14.458   0.948
 1665    HD2  PHE 101           HD2      PHE 101   6.652  11.732  -0.356
 1666    HE1  PHE 101           HE1      PHE 101   8.971  16.047  -0.799
 1667    HE2  PHE 101           HE2      PHE 101   5.966  13.320  -2.105
 1668    HZ   PHE 101           HZ       PHE 101   7.128  15.480  -2.326
 1669    H    ILE 102           H        ILE 102   6.375  11.050   4.353
 1670    HA   ILE 102           HA       ILE 102   8.527   9.560   5.706
 1671    HB   ILE 102           HB       ILE 102   6.944   9.395   7.637
 1672   HG12  ILE 102          HG13      ILE 102   5.385  11.514   6.147
 1673   HG13  ILE 102          HG12      ILE 102   4.876   9.839   6.315
 1674   HG21  ILE 102          HG21      ILE 102   8.751  11.020   7.623
 1675   HG22  ILE 102          HG22      ILE 102   7.328  11.674   8.434
 1676   HG23  ILE 102          HG23      ILE 102   7.717  12.181   6.789
 1677   HD11  ILE 102          HD11      ILE 102   3.716  11.250   7.890
 1678   HD12  ILE 102          HD12      ILE 102   5.251  11.819   8.547
 1679   HD13  ILE 102          HD13      ILE 102   4.779  10.131   8.744
 1680    H    ARG 103           H        ARG 103   8.266   7.410   6.132
 1681    HA   ARG 103           HA       ARG 103   6.506   6.081   4.259
 1682    HB2  ARG 103           HB3      ARG 103   7.771   4.063   4.781
 1683    HB3  ARG 103           HB2      ARG 103   8.852   5.391   4.400
 1684    HG2  ARG 103           HG3      ARG 103   9.282   5.719   6.785
 1685    HG3  ARG 103           HG2      ARG 103   8.198   4.380   7.160
 1686    HD2  ARG 103           HD3      ARG 103   9.662   2.895   5.797
 1687    HD3  ARG 103           HD2      ARG 103  10.780   4.246   5.607
 1688    HE   ARG 103           HE       ARG 103  10.385   3.964   8.321
 1689   HH11  ARG 103          HH11      ARG 103  11.639   2.009   5.697
 1690   HH12  ARG 103          HH12      ARG 103  12.702   1.097   6.721
 1691   HH21  ARG 103          HH21      ARG 103  11.807   2.766   9.661
 1692   HH22  ARG 103          HH22      ARG 103  12.807   1.534   8.961
 1693    H    ILE 104           H        ILE 104   4.740   4.983   4.699
 1694    HA   ILE 104           HA       ILE 104   4.114   4.369   7.520
 1695    HB   ILE 104           HB       ILE 104   1.727   4.618   6.989
 1696   HG12  ILE 104          HG13      ILE 104   2.661   5.658   4.307
 1697   HG13  ILE 104          HG12      ILE 104   1.890   4.100   4.571
 1698   HG21  ILE 104          HG21      ILE 104   3.383   7.044   6.317
 1699   HG22  ILE 104          HG22      ILE 104   2.871   6.528   7.925
 1700   HG23  ILE 104          HG23      ILE 104   1.676   7.071   6.750
 1701   HD11  ILE 104          HD11      ILE 104   0.653   6.801   5.031
 1702   HD12  ILE 104          HD12      ILE 104  -0.126   5.253   5.356
 1703   HD13  ILE 104          HD13      ILE 104   0.305   5.694   3.704
 1704    H    ASP 105           H        ASP 105   2.931   2.427   7.894
 1705    HA   ASP 105           HA       ASP 105   3.651   0.257   6.153
 1706    HB2  ASP 105           HB3      ASP 105   1.892   0.384   8.624
 1707    HB3  ASP 105           HB2      ASP 105   2.245  -1.111   7.758
 1708    H    THR 106           H        THR 106   2.623   0.140   4.229
 1709    HA   THR 106           HA       THR 106  -0.099   1.218   4.118
 1710    HB   THR 106           HB       THR 106   1.484   0.533   1.677
 1711    HG1  THR 106           HG1      THR 106   2.304   2.177   3.680
 1712   HG21  THR 106          HG21      THR 106  -0.791   1.416   1.457
 1713   HG22  THR 106          HG22      THR 106   0.396   2.568   0.842
 1714   HG23  THR 106          HG23      THR 106  -0.343   2.822   2.422
 1715    H    ALA 107           H        ALA 107   1.771  -1.614   3.058
 1716    HA   ALA 107           HA       ALA 107  -0.776  -3.020   2.670
 1717    HB1  ALA 107           HB1      ALA 107   0.020  -2.265   0.482
 1718    HB2  ALA 107           HB2      ALA 107   0.054  -4.024   0.615
 1719    HB3  ALA 107           HB3      ALA 107   1.549  -3.100   0.755
 1720    H    CYS 108           H        CYS 108  -0.799  -5.111   3.282
 1721    HA   CYS 108           HA       CYS 108   1.711  -6.242   4.312
 1722    HB2  CYS 108           HB3      CYS 108  -0.124  -6.033   5.969
 1723    HB3  CYS 108           HB2      CYS 108  -1.155  -7.026   4.939
 1724    H    VAL 109           H        VAL 109   2.610  -7.288   2.636
 1725    HA   VAL 109           HA       VAL 109   0.832  -8.654   0.746
 1726    HB   VAL 109           HB       VAL 109   2.711  -8.645  -0.819
 1727   HG11  VAL 109          HG11      VAL 109   2.188  -5.959   0.449
 1728   HG12  VAL 109          HG12      VAL 109   1.231  -6.732  -0.816
 1729   HG13  VAL 109          HG13      VAL 109   2.883  -6.212  -1.153
 1730   HG21  VAL 109          HG21      VAL 109   4.551  -8.852   0.779
 1731   HG22  VAL 109          HG22      VAL 109   4.239  -7.215   1.359
 1732   HG23  VAL 109          HG23      VAL 109   4.793  -7.475  -0.296
 1733    H    CYS 110           H        CYS 110   1.026 -10.779   0.224
 1734    HA   CYS 110           HA       CYS 110   2.564 -12.457   2.022
 1735    HB2  CYS 110           HB3      CYS 110   0.319 -13.206   1.518
 1736    HB3  CYS 110           HB2      CYS 110   0.627 -13.121  -0.209
 1737    H    VAL 111           H        VAL 111   4.629 -12.797   1.588
 1738    HA   VAL 111           HA       VAL 111   5.447 -12.970  -1.231
 1739    HB   VAL 111           HB       VAL 111   7.714 -12.465  -0.519
 1740   HG11  VAL 111          HG11      VAL 111   6.331 -10.570  -1.041
 1741   HG12  VAL 111          HG12      VAL 111   7.378 -10.159   0.318
 1742   HG13  VAL 111          HG13      VAL 111   5.681 -10.545   0.597
 1743   HG21  VAL 111          HG21      VAL 111   8.264 -11.889   1.783
 1744   HG22  VAL 111          HG22      VAL 111   7.674 -13.549   1.674
 1745   HG23  VAL 111          HG23      VAL 111   6.618 -12.277   2.283
 1746    H    LEU 112           H        LEU 112   6.663 -14.721  -1.929
 1747    HA   LEU 112           HA       LEU 112   6.650 -17.011  -0.085
 1748    HB2  LEU 112           HB3      LEU 112   6.710 -16.921  -3.106
 1749    HB3  LEU 112           HB2      LEU 112   6.896 -18.395  -2.167
 1750    HG   LEU 112           HG       LEU 112   4.441 -16.637  -2.287
 1751   HD11  LEU 112          HD11      LEU 112   4.771 -18.014  -4.268
 1752   HD12  LEU 112          HD12      LEU 112   3.406 -18.596  -3.315
 1753   HD13  LEU 112          HD13      LEU 112   4.949 -19.448  -3.255
 1754   HD21  LEU 112          HD21      LEU 112   3.394 -18.412  -0.911
 1755   HD22  LEU 112          HD22      LEU 112   4.636 -17.503  -0.058
 1756   HD23  LEU 112          HD23      LEU 112   4.990 -19.120  -0.667
 1757    H    SER 113           H        SER 113   8.448 -18.024   0.437
 1758    HA   SER 113           HA       SER 113  10.942 -17.224  -0.905
 1759    HB2  SER 113           HB3      SER 113  10.942 -16.574   1.453
 1760    HB3  SER 113           HB2      SER 113  10.484 -18.207   1.930
 1761    HG   SER 113           HG       SER 113  12.652 -18.106   2.203
 1762    H    ARG 114           H        ARG 114  12.222 -18.827  -1.729
 1763    HA   ARG 114           HA       ARG 114  10.979 -21.388  -2.130
 1764    HB2  ARG 114           HB3      ARG 114  12.368 -20.084  -3.837
 1765    HB3  ARG 114           HB2      ARG 114  13.782 -20.615  -2.937
 1766    HG2  ARG 114           HG3      ARG 114  13.149 -22.952  -3.347
 1767    HG3  ARG 114           HG2      ARG 114  11.759 -22.396  -4.286
 1768    HD2  ARG 114           HD3      ARG 114  13.509 -22.947  -5.815
 1769    HD3  ARG 114           HD2      ARG 114  13.346 -21.194  -5.782
 1770    HE   ARG 114           HE       ARG 114  15.406 -22.521  -4.159
 1771   HH11  ARG 114          HH11      ARG 114  14.508 -20.286  -6.701
 1772   HH12  ARG 114          HH12      ARG 114  16.119 -19.679  -6.907
 1773   HH21  ARG 114          HH21      ARG 114  17.521 -21.720  -4.422
 1774   HH22  ARG 114          HH22      ARG 114  17.833 -20.485  -5.598
 1775    H    LYS 115           H        LYS 115  12.373 -20.216   0.450
 1776    HA   LYS 115           HA       LYS 115  13.260 -21.074   2.343
 1777    HB2  LYS 115           HB3      LYS 115  12.827 -23.762   1.001
 1778    HB3  LYS 115           HB2      LYS 115  13.141 -23.510   2.713
 1779    HG2  LYS 115           HG3      LYS 115  11.036 -22.319   2.953
 1780    HG3  LYS 115           HG2      LYS 115  10.742 -22.468   1.218
 1781    HD2  LYS 115           HD3      LYS 115   9.454 -24.136   2.371
 1782    HD3  LYS 115           HD2      LYS 115  10.744 -24.930   1.469
 1783    HE2  LYS 115           HE3      LYS 115  12.060 -25.146   3.488
 1784    HE3  LYS 115           HE2      LYS 115  10.834 -24.276   4.410
 1785    HZ1  LYS 115           HZ1      LYS 115  10.413 -26.873   3.033
 1786    HZ2  LYS 115           HZ2      LYS 115   9.277 -26.052   3.980
 1787    HZ3  LYS 115           HZ3      LYS 115  10.676 -26.682   4.693
 1788    H    ALA 116           H        ALA 116  14.948 -20.126   0.403
 1789    HA   ALA 116           HA       ALA 116  17.315 -21.832   0.783
 1790    HB1  ALA 116           HB1      ALA 116  18.147 -21.167  -1.391
 1791    HB2  ALA 116           HB2      ALA 116  16.726 -20.156  -1.652
 1792    HB3  ALA 116           HB3      ALA 116  16.556 -21.908  -1.557
 1793    H    THR 117           H        THR 117  16.346 -18.524  -0.123
 1794    HA   THR 117           HA       THR 117  18.775 -17.405   0.916
 1795    HB   THR 117           HB       THR 117  17.623 -15.207   0.436
 1796    HG1  THR 117           HG1      THR 117  15.543 -15.307   0.095
 1797   HG21  THR 117          HG21      THR 117  17.792 -15.452  -2.005
 1798   HG22  THR 117          HG22      THR 117  17.813 -17.206  -1.820
 1799   HG23  THR 117          HG23      THR 117  19.139 -16.236  -1.177
 1800    H    ARG 118           H        ARG 118  18.945 -15.937   2.663
 1801    HA   ARG 118           HA       ARG 118  16.818 -15.496   4.487
 1802    HB2  ARG 118           HB3      ARG 118  18.062 -16.752   6.394
 1803    HB3  ARG 118           HB2      ARG 118  17.017 -17.659   5.320
 1804    HG2  ARG 118           HG3      ARG 118  18.812 -19.052   5.416
 1805    HG3  ARG 118           HG2      ARG 118  19.240 -18.093   4.005
 1806    HD2  ARG 118           HD3      ARG 118  20.211 -17.403   6.768
 1807    HD3  ARG 118           HD2      ARG 118  21.065 -18.542   5.733
 1808    HE   ARG 118           HE       ARG 118  20.525 -15.905   4.613
 1809   HH11  ARG 118          HH11      ARG 118  22.812 -18.050   6.177
 1810   HH12  ARG 118          HH12      ARG 118  24.199 -17.117   5.707
 1811   HH21  ARG 118          HH21      ARG 118  22.341 -14.669   4.015
 1812   HH22  ARG 118          HH22      ARG 118  23.930 -15.183   4.492
  Start of MODEL    3
    1    H1   SER   1           H1       SER   1  31.207  -9.873   6.949
    2    H2   SER   1           H2       SER   1  31.223  -8.196   7.163
    3    H3   SER   1           H3       SER   1  30.878  -8.850   5.644
    4    HA   SER   1           HA       SER   1  29.220  -9.181   8.068
    5    HB2  SER   1           HB3      SER   1  29.218  -6.866   7.110
    6    HB3  SER   1           HB2      SER   1  28.684  -7.540   5.572
    7    HG   SER   1           HG       SER   1  27.080  -6.679   7.254
    8    H    SER   2           H        SER   2  27.065 -10.073   7.477
    9    HA   SER   2           HA       SER   2  27.056 -11.671   5.031
   10    HB2  SER   2           HB3      SER   2  26.207 -13.642   6.429
   11    HB3  SER   2           HB2      SER   2  27.926 -13.272   6.552
   12    HG   SER   2           HG       SER   2  26.361 -11.932   8.373
   13    H    THR   3           H        THR   3  25.662  -9.344   5.546
   14    HA   THR   3           HA       THR   3  22.973 -10.083   6.383
   15    HB   THR   3           HB       THR   3  22.542  -7.595   5.837
   16    HG1  THR   3           HG1      THR   3  25.276  -7.191   6.248
   17   HG21  THR   3          HG21      THR   3  23.465  -6.888   7.994
   18   HG22  THR   3          HG22      THR   3  24.465  -8.341   8.045
   19   HG23  THR   3          HG23      THR   3  22.708  -8.477   8.116
   20    H    HIS   4           H        HIS   4  21.910 -11.186   4.885
   21    HA   HIS   4           HA       HIS   4  22.263 -10.753   2.075
   22    HB2  HIS   4           HB3      HIS   4  21.746 -12.985   3.059
   23    HB3  HIS   4           HB2      HIS   4  20.162 -12.380   3.525
   24    HD1  HIS   4           HD1      HIS   4  22.185 -12.798   0.326
   25    HD2  HIS   4           HD2      HIS   4  18.253 -12.867   1.673
   26    HE1  HIS   4           HE1      HIS   4  20.803 -13.458  -1.661
   27    HE2  HIS   4           HE2      HIS   4  18.471 -13.739  -0.755
   28    HA   PRO   5           HA       PRO   5  19.312  -7.443   1.758
   29    HB2  PRO   5           HB3      PRO   5  18.960  -7.514  -0.949
   30    HB3  PRO   5           HB2      PRO   5  20.370  -6.788  -0.170
   31    HG2  PRO   5           HG3      PRO   5  20.082  -9.483  -1.433
   32    HG3  PRO   5           HG2      PRO   5  21.434  -8.343  -1.531
   33    HD2  PRO   5           HD3      PRO   5  21.472 -10.501   0.097
   34    HD3  PRO   5           HD2      PRO   5  22.283  -8.978   0.517
   35    H    VAL   6           H        VAL   6  17.530  -8.279   2.770
   36    HA   VAL   6           HA       VAL   6  15.867 -10.310   1.677
   37    HB   VAL   6           HB       VAL   6  15.085  -8.246   3.744
   38   HG11  VAL   6          HG11      VAL   6  13.541  -9.961   4.535
   39   HG12  VAL   6          HG12      VAL   6  14.077 -11.044   3.249
   40   HG13  VAL   6          HG13      VAL   6  13.226  -9.552   2.849
   41   HG21  VAL   6          HG21      VAL   6  15.834  -9.850   5.432
   42   HG22  VAL   6          HG22      VAL   6  17.168  -9.318   4.411
   43   HG23  VAL   6          HG23      VAL   6  16.443 -10.903   4.159
   44    H    PHE   7           H        PHE   7  16.278  -7.030   1.008
   45    HA   PHE   7           HA       PHE   7  13.781  -6.173   0.159
   46    HB2  PHE   7           HB3      PHE   7  15.752  -4.706   0.245
   47    HB3  PHE   7           HB2      PHE   7  16.484  -5.595  -1.081
   48    HD1  PHE   7           HD1      PHE   7  13.653  -3.396  -0.181
   49    HD2  PHE   7           HD2      PHE   7  16.000  -5.062  -3.315
   50    HE1  PHE   7           HE1      PHE   7  12.593  -1.864  -1.782
   51    HE2  PHE   7           HE2      PHE   7  14.941  -3.534  -4.925
   52    HZ   PHE   7           HZ       PHE   7  13.235  -1.930  -4.160
   53    H    HIS   8           H        HIS   8  16.178  -8.146  -1.530
   54    HA   HIS   8           HA       HIS   8  14.713  -8.265  -3.982
   55    HB2  HIS   8           HB3      HIS   8  17.199  -8.632  -3.757
   56    HB3  HIS   8           HB2      HIS   8  16.844 -10.186  -3.016
   57    HD1  HIS   8           HD1      HIS   8  16.802  -8.401  -6.297
   58    HD2  HIS   8           HD2      HIS   8  16.010 -12.195  -4.801
   59    HE1  HIS   8           HE1      HIS   8  16.618  -9.889  -8.307
   60    HE2  HIS   8           HE2      HIS   8  16.318 -12.206  -7.373
   61    H    MET   9           H        MET   9  14.680 -10.022  -1.013
   62    HA   MET   9           HA       MET   9  13.350 -12.357  -2.034
   63    HB2  MET   9           HB3      MET   9  13.660 -11.383   0.817
   64    HB3  MET   9           HB2      MET   9  13.119 -12.985   0.337
   65    HG2  MET   9           HG3      MET   9  15.264 -13.522  -0.559
   66    HG3  MET   9           HG2      MET   9  15.823 -11.864  -0.366
   67    HE1  MET   9           HE1      MET   9  14.730 -15.149   1.512
   68    HE2  MET   9           HE2      MET   9  13.644 -13.919   2.156
   69    HE3  MET   9           HE3      MET   9  14.873 -14.639   3.194
   70    H    GLY  10           H        GLY  10  12.447  -9.266  -0.754
   71    HA2  GLY  10           HA3      GLY  10   9.698  -9.974  -0.242
   72    HA3  GLY  10           HA2      GLY  10  10.388  -8.362  -0.191
   73    H    GLU  11           H        GLU  11  11.333  -9.648  -3.041
   74    HA   GLU  11           HA       GLU  11   9.256  -8.233  -4.507
   75    HB2  GLU  11           HB3      GLU  11  11.877  -9.472  -5.373
   76    HB3  GLU  11           HB2      GLU  11  10.746  -8.701  -6.485
   77    HG2  GLU  11           HG3      GLU  11  12.085  -7.349  -4.143
   78    HG3  GLU  11           HG2      GLU  11  12.582  -7.210  -5.830
   79    H    PHE  12           H        PHE  12   9.687 -11.309  -3.388
   80    HA   PHE  12           HA       PHE  12   8.470 -12.626  -5.688
   81    HB2  PHE  12           HB3      PHE  12   9.436 -13.730  -3.040
   82    HB3  PHE  12           HB2      PHE  12   8.701 -14.702  -4.313
   83    HD1  PHE  12           HD1      PHE  12  11.720 -13.226  -3.079
   84    HD2  PHE  12           HD2      PHE  12   9.847 -14.810  -6.556
   85    HE1  PHE  12           HE1      PHE  12  13.923 -13.515  -4.131
   86    HE2  PHE  12           HE2      PHE  12  12.047 -15.106  -7.612
   87    HZ   PHE  12           HZ       PHE  12  14.091 -14.457  -6.399
   88    H    SER  13           H        SER  13   6.540 -11.365  -5.508
   89    HA   SER  13           HA       SER  13   4.858 -11.649  -3.184
   90    HB2  SER  13           HB3      SER  13   4.096 -10.480  -5.864
   91    HB3  SER  13           HB2      SER  13   3.408 -10.105  -4.291
   92    HG   SER  13           HG       SER  13   5.521  -9.260  -3.734
   93    H    VAL  14           H        VAL  14   2.858 -12.752  -3.112
   94    HA   VAL  14           HA       VAL  14   2.559 -15.134  -4.546
   95    HB   VAL  14           HB       VAL  14   0.191 -15.144  -3.732
   96   HG11  VAL  14          HG11      VAL  14   2.313 -14.493  -1.695
   97   HG12  VAL  14          HG12      VAL  14   1.943 -16.083  -2.363
   98   HG13  VAL  14          HG13      VAL  14   0.765 -15.259  -1.342
   99   HG21  VAL  14          HG21      VAL  14  -0.548 -13.393  -2.197
  100   HG22  VAL  14          HG22      VAL  14  -0.241 -12.739  -3.805
  101   HG23  VAL  14          HG23      VAL  14   0.929 -12.484  -2.510
  102    H    CYS  15           H        CYS  15   1.270 -11.924  -5.164
  103    HA   CYS  15           HA       CYS  15   0.418 -12.864  -7.814
  104    HB2  CYS  15           HB3      CYS  15  -1.529 -12.236  -6.422
  105    HB3  CYS  15           HB2      CYS  15  -0.832 -10.630  -6.189
  106    H    ASP  16           H        ASP  16   0.702 -11.321  -9.545
  107    HA   ASP  16           HA       ASP  16   3.166  -9.828  -9.113
  108    HB2  ASP  16           HB3      ASP  16   2.877 -11.423 -11.057
  109    HB3  ASP  16           HB2      ASP  16   1.707 -10.286 -11.726
  110    H    SER  17           H        SER  17   3.073  -7.786  -8.580
  111    HA   SER  17           HA       SER  17   0.721  -6.197  -9.345
  112    HB2  SER  17           HB3      SER  17   2.779  -5.682  -7.177
  113    HB3  SER  17           HB2      SER  17   1.308  -4.745  -7.461
  114    HG   SER  17           HG       SER  17   1.156  -7.520  -7.001
  115    H    VAL  18           H        VAL  18   1.019  -4.049 -10.136
  116    HA   VAL  18           HA       VAL  18   3.763  -3.464 -11.025
  117    HB   VAL  18           HB       VAL  18   2.463  -3.949 -12.972
  118   HG11  VAL  18          HG11      VAL  18   0.442  -2.725 -13.578
  119   HG12  VAL  18          HG12      VAL  18   0.483  -1.894 -12.022
  120   HG13  VAL  18          HG13      VAL  18   0.234  -3.639 -12.085
  121   HG21  VAL  18          HG21      VAL  18   4.039  -2.135 -13.203
  122   HG22  VAL  18          HG22      VAL  18   2.824  -0.977 -12.665
  123   HG23  VAL  18          HG23      VAL  18   2.617  -1.828 -14.196
  124    H    SER  19           H        SER  19   4.595  -1.854  -9.892
  125    HA   SER  19           HA       SER  19   2.817   0.149  -8.719
  126    HB2  SER  19           HB3      SER  19   5.758  -0.382  -8.203
  127    HB3  SER  19           HB2      SER  19   4.749   0.767  -7.321
  128    HG   SER  19           HG       SER  19   3.513  -0.950  -6.553
  129    H    VAL  20           H        VAL  20   2.515   1.981  -9.771
  130    HA   VAL  20           HA       VAL  20   4.669   2.974 -11.524
  131    HB   VAL  20           HB       VAL  20   1.692   3.356 -11.865
  132   HG11  VAL  20          HG11      VAL  20   3.993   4.168 -13.627
  133   HG12  VAL  20          HG12      VAL  20   2.923   5.241 -12.722
  134   HG13  VAL  20          HG13      VAL  20   2.287   4.284 -14.059
  135   HG21  VAL  20          HG21      VAL  20   2.305   1.061 -12.320
  136   HG22  VAL  20          HG22      VAL  20   3.604   1.593 -13.387
  137   HG23  VAL  20          HG23      VAL  20   1.923   1.895 -13.827
  138    H    TRP  21           H        TRP  21   5.301   5.048 -11.265
  139    HA   TRP  21           HA       TRP  21   3.858   6.675  -9.298
  140    HB2  TRP  21           HB3      TRP  21   6.686   6.844 -10.361
  141    HB3  TRP  21           HB2      TRP  21   5.953   8.113  -9.382
  142    HD1  TRP  21           HD1      TRP  21   7.227   4.500  -9.133
  143    HE1  TRP  21           HE1      TRP  21   7.563   3.913  -6.648
  144    HE3  TRP  21           HE3      TRP  21   5.185   8.693  -7.022
  145    HZ2  TRP  21           HZ2      TRP  21   7.033   5.073  -4.130
  146    HZ3  TRP  21           HZ3      TRP  21   5.143   8.875  -4.567
  147    HH2  TRP  21           HH2      TRP  21   6.046   7.103  -3.153
  148    H    VAL  22           H        VAL  22   2.257   7.585 -10.408
  149    HA   VAL  22           HA       VAL  22   2.549   8.438 -13.134
  150    HB   VAL  22           HB       VAL  22   0.262   8.936 -11.222
  151   HG11  VAL  22          HG11      VAL  22  -1.079   9.169 -13.266
  152   HG12  VAL  22          HG12      VAL  22   0.388   9.013 -14.230
  153   HG13  VAL  22          HG13      VAL  22   0.185  10.394 -13.152
  154   HG21  VAL  22          HG21      VAL  22   0.713   6.554 -11.415
  155   HG22  VAL  22          HG22      VAL  22   0.676   6.674 -13.172
  156   HG23  VAL  22          HG23      VAL  22  -0.790   6.971 -12.236
  157    H    GLY  23           H        GLY  23   3.296  10.350 -13.779
  158    HA2  GLY  23           HA3      GLY  23   3.506  12.515 -11.813
  159    HA3  GLY  23           HA2      GLY  23   4.335  12.441 -13.368
  160    H    ASP  24           H        ASP  24   1.457  11.500 -14.266
  161    HA   ASP  24           HA       ASP  24   0.228  14.149 -14.399
  162    HB2  ASP  24           HB3      ASP  24   1.586  13.973 -16.429
  163    HB3  ASP  24           HB2      ASP  24   0.847  12.420 -16.811
  164    H    LYS  25           H        LYS  25  -1.188  13.070 -12.860
  165    HA   LYS  25           HA       LYS  25  -3.057  11.171 -14.069
  166    HB2  LYS  25           HB3      LYS  25  -2.140  10.775 -11.760
  167    HB3  LYS  25           HB2      LYS  25  -2.976  12.226 -11.233
  168    HG2  LYS  25           HG3      LYS  25  -5.111  11.232 -11.714
  169    HG3  LYS  25           HG2      LYS  25  -4.332   9.804 -12.397
  170    HD2  LYS  25           HD3      LYS  25  -3.319   9.341 -10.197
  171    HD3  LYS  25           HD2      LYS  25  -4.161  10.742  -9.534
  172    HE2  LYS  25           HE3      LYS  25  -5.404   8.755  -8.973
  173    HE3  LYS  25           HE2      LYS  25  -6.317   9.682 -10.164
  174    HZ1  LYS  25           HZ1      LYS  25  -6.407   7.429 -10.807
  175    HZ2  LYS  25           HZ2      LYS  25  -4.740   7.208 -10.615
  176    HZ3  LYS  25           HZ3      LYS  25  -5.329   8.172 -11.881
  177    H    THR  26           H        THR  26  -5.192  11.750 -14.535
  178    HA   THR  26           HA       THR  26  -5.667  14.646 -14.370
  179    HB   THR  26           HB       THR  26  -5.370  13.823 -16.668
  180    HG1  THR  26           HG1      THR  26  -7.852  14.890 -15.841
  181   HG21  THR  26          HG21      THR  26  -6.237  11.571 -16.469
  182   HG22  THR  26          HG22      THR  26  -7.144  12.445 -17.701
  183   HG23  THR  26          HG23      THR  26  -7.845  12.192 -16.103
  184    H    THR  27           H        THR  27  -7.083  11.532 -13.647
  185    HA   THR  27           HA       THR  27  -9.352  12.953 -12.458
  186    HB   THR  27           HB       THR  27 -10.787  10.939 -13.178
  187    HG1  THR  27           HG1      THR  27  -9.461  10.671 -15.524
  188   HG21  THR  27          HG21      THR  27  -9.871  12.993 -15.189
  189   HG22  THR  27          HG22      THR  27 -11.168  13.181 -14.006
  190   HG23  THR  27          HG23      THR  27 -11.338  12.022 -15.325
  191    H    ALA  28           H        ALA  28 -10.106  12.164 -10.568
  192    HA   ALA  28           HA       ALA  28  -9.369   9.484  -9.702
  193    HB1  ALA  28           HB1      ALA  28  -8.389  10.185  -7.618
  194    HB2  ALA  28           HB2      ALA  28  -8.660  11.882  -8.018
  195    HB3  ALA  28           HB3      ALA  28  -7.501  10.931  -8.948
  196    H    THR  29           H        THR  29 -10.421   9.066  -7.483
  197    HA   THR  29           HA       THR  29 -12.980  10.515  -7.359
  198    HB   THR  29           HB       THR  29 -12.545   7.656  -6.495
  199    HG1  THR  29           HG1      THR  29 -12.824   8.698  -8.994
  200   HG21  THR  29          HG21      THR  29 -15.058   9.236  -7.060
  201   HG22  THR  29          HG22      THR  29 -14.446   8.816  -5.460
  202   HG23  THR  29          HG23      THR  29 -14.988   7.547  -6.559
  203    H    ASP  30           H        ASP  30 -13.242  11.662  -5.587
  204    HA   ASP  30           HA       ASP  30 -11.471  11.449  -3.337
  205    HB2  ASP  30           HB3      ASP  30 -12.393  13.628  -4.074
  206    HB3  ASP  30           HB2      ASP  30 -14.021  13.064  -3.694
  207    H    ILE  31           H        ILE  31 -12.325  11.249  -1.095
  208    HA   ILE  31           HA       ILE  31 -13.605   8.765  -0.745
  209    HB   ILE  31           HB       ILE  31 -11.975   9.684   0.853
  210   HG12  ILE  31          HG13      ILE  31 -14.685   9.225   2.128
  211   HG13  ILE  31          HG12      ILE  31 -13.587   7.954   1.599
  212   HG21  ILE  31          HG21      ILE  31 -12.625  12.020   0.769
  213   HG22  ILE  31          HG22      ILE  31 -12.635  11.436   2.433
  214   HG23  ILE  31          HG23      ILE  31 -14.154  11.643   1.561
  215   HD11  ILE  31          HD11      ILE  31 -13.060   9.976   3.763
  216   HD12  ILE  31          HD12      ILE  31 -11.926   8.739   3.221
  217   HD13  ILE  31          HD13      ILE  31 -13.442   8.269   3.990
  218    H    LYS  32           H        LYS  32 -14.850  11.981  -1.038
  219    HA   LYS  32           HA       LYS  32 -17.407  11.467   0.154
  220    HB2  LYS  32           HB3      LYS  32 -16.585  13.577  -1.848
  221    HB3  LYS  32           HB2      LYS  32 -18.072  13.580  -0.909
  222    HG2  LYS  32           HG3      LYS  32 -16.832  13.865   1.134
  223    HG3  LYS  32           HG2      LYS  32 -15.304  13.700   0.267
  224    HD2  LYS  32           HD3      LYS  32 -15.914  15.699  -1.063
  225    HD3  LYS  32           HD2      LYS  32 -17.336  15.905  -0.041
  226    HE2  LYS  32           HE3      LYS  32 -14.468  15.931   0.875
  227    HE3  LYS  32           HE2      LYS  32 -15.493  17.346   0.670
  228    HZ1  LYS  32           HZ1      LYS  32 -15.363  16.651   2.979
  229    HZ2  LYS  32           HZ2      LYS  32 -15.979  15.131   2.580
  230    HZ3  LYS  32           HZ3      LYS  32 -16.946  16.507   2.397
  231    H    GLY  33           H        GLY  33 -15.942  10.509  -2.726
  232    HA2  GLY  33           HA3      GLY  33 -16.929   9.021  -4.278
  233    HA3  GLY  33           HA2      GLY  33 -18.519   9.612  -3.797
  234    H    LYS  34           H        LYS  34 -16.114  11.964  -4.333
  235    HA   LYS  34           HA       LYS  34 -17.565  12.926  -6.665
  236    HB2  LYS  34           HB3      LYS  34 -15.385  14.175  -4.987
  237    HB3  LYS  34           HB2      LYS  34 -16.165  14.967  -6.346
  238    HG2  LYS  34           HG3      LYS  34 -17.594  14.027  -3.874
  239    HG3  LYS  34           HG2      LYS  34 -17.030  15.671  -4.146
  240    HD2  LYS  34           HD3      LYS  34 -18.432  15.788  -6.168
  241    HD3  LYS  34           HD2      LYS  34 -19.051  14.176  -5.808
  242    HE2  LYS  34           HE3      LYS  34 -20.020  14.964  -3.744
  243    HE3  LYS  34           HE2      LYS  34 -19.280  16.546  -3.965
  244    HZ1  LYS  34           HZ1      LYS  34 -21.619  16.547  -4.589
  245    HZ2  LYS  34           HZ2      LYS  34 -21.332  15.349  -5.745
  246    HZ3  LYS  34           HZ3      LYS  34 -20.638  16.880  -5.925
  247    H    GLU  35           H        GLU  35 -16.789  12.887  -8.682
  248    HA   GLU  35           HA       GLU  35 -14.169  11.768  -9.203
  249    HB2  GLU  35           HB3      GLU  35 -16.050  11.150 -10.656
  250    HB3  GLU  35           HB2      GLU  35 -16.294  12.838 -11.075
  251    HG2  GLU  35           HG3      GLU  35 -14.084  12.889 -12.126
  252    HG3  GLU  35           HG2      GLU  35 -13.867  11.186 -11.730
  253    H    VAL  36           H        VAL  36 -12.431  13.013  -9.176
  254    HA   VAL  36           HA       VAL  36 -12.811  15.901  -9.564
  255    HB   VAL  36           HB       VAL  36 -10.966  16.282  -8.008
  256   HG11  VAL  36          HG11      VAL  36 -13.056  14.448  -6.843
  257   HG12  VAL  36          HG12      VAL  36 -13.255  16.174  -7.142
  258   HG13  VAL  36          HG13      VAL  36 -12.079  15.616  -5.952
  259   HG21  VAL  36          HG21      VAL  36 -10.969  13.291  -7.619
  260   HG22  VAL  36          HG22      VAL  36 -10.017  14.455  -6.700
  261   HG23  VAL  36          HG23      VAL  36  -9.707  14.227  -8.421
  262    H    THR  37           H        THR  37 -11.243  17.068 -10.622
  263    HA   THR  37           HA       THR  37  -9.606  15.583 -12.492
  264    HB   THR  37           HB       THR  37  -9.851  18.576 -12.143
  265    HG1  THR  37           HG1      THR  37 -11.500  16.697 -13.361
  266   HG21  THR  37          HG21      THR  37  -7.866  17.873 -13.389
  267   HG22  THR  37          HG22      THR  37  -9.029  18.671 -14.448
  268   HG23  THR  37          HG23      THR  37  -8.880  16.913 -14.469
  269    H    VAL  38           H        VAL  38  -7.639  14.962 -11.938
  270    HA   VAL  38           HA       VAL  38  -6.353  16.078  -9.613
  271    HB   VAL  38           HB       VAL  38  -5.349  13.939 -11.499
  272   HG11  VAL  38          HG11      VAL  38  -3.895  13.302  -9.619
  273   HG12  VAL  38          HG12      VAL  38  -4.468  14.705  -8.719
  274   HG13  VAL  38          HG13      VAL  38  -3.551  14.928 -10.210
  275   HG21  VAL  38          HG21      VAL  38  -7.462  13.296 -10.471
  276   HG22  VAL  38          HG22      VAL  38  -6.806  13.667  -8.875
  277   HG23  VAL  38          HG23      VAL  38  -6.128  12.344  -9.823
  278    H    LEU  39           H        LEU  39  -4.535  17.317  -9.573
  279    HA   LEU  39           HA       LEU  39  -3.751  18.524 -12.118
  280    HB2  LEU  39           HB3      LEU  39  -3.032  19.354  -9.301
  281    HB3  LEU  39           HB2      LEU  39  -2.751  20.278 -10.766
  282    HG   LEU  39           HG       LEU  39  -5.454  19.612  -9.605
  283   HD11  LEU  39          HD11      LEU  39  -5.577  22.003  -9.115
  284   HD12  LEU  39          HD12      LEU  39  -3.920  22.201  -9.691
  285   HD13  LEU  39          HD13      LEU  39  -4.246  21.225  -8.257
  286   HD21  LEU  39          HD21      LEU  39  -5.521  19.766 -12.034
  287   HD22  LEU  39          HD22      LEU  39  -4.705  21.327 -11.965
  288   HD23  LEU  39          HD23      LEU  39  -6.325  21.148 -11.291
  289    H    ALA  40           H        ALA  40  -1.977  17.841 -13.084
  290    HA   ALA  40           HA       ALA  40  -0.166  15.987 -11.963
  291    HB1  ALA  40           HB1      ALA  40  -0.557  16.182 -14.380
  292    HB2  ALA  40           HB2      ALA  40   1.155  16.340 -13.984
  293    HB3  ALA  40           HB3      ALA  40   0.203  17.773 -14.369
  294    H    GLU  41           H        GLU  41  -0.114  19.455 -12.443
  295    HA   GLU  41           HA       GLU  41   2.303  19.651 -10.785
  296    HB2  GLU  41           HB3      GLU  41   0.966  21.708 -12.558
  297    HB3  GLU  41           HB2      GLU  41   2.429  21.975 -11.624
  298    HG2  GLU  41           HG3      GLU  41   2.250  19.830 -13.708
  299    HG3  GLU  41           HG2      GLU  41   2.675  21.493 -14.110
  300    H    VAL  42           H        VAL  42   1.864  19.997  -8.687
  301    HA   VAL  42           HA       VAL  42  -0.723  21.125  -7.972
  302    HB   VAL  42           HB       VAL  42  -0.239  20.485  -5.666
  303   HG11  VAL  42          HG11      VAL  42  -0.198  18.062  -5.947
  304   HG12  VAL  42          HG12      VAL  42   0.352  18.263  -7.611
  305   HG13  VAL  42          HG13      VAL  42  -1.248  18.834  -7.137
  306   HG21  VAL  42          HG21      VAL  42   1.765  19.227  -5.064
  307   HG22  VAL  42          HG22      VAL  42   2.172  20.852  -5.622
  308   HG23  VAL  42          HG23      VAL  42   2.410  19.466  -6.688
  309    H    ASN  43           H        ASN  43  -0.981  23.169  -7.542
  310    HA   ASN  43           HA       ASN  43   1.365  24.833  -7.111
  311    HB2  ASN  43           HB3      ASN  43  -0.271  26.746  -7.378
  312    HB3  ASN  43           HB2      ASN  43  -0.076  25.724  -8.793
  313   HD21  ASN  43          HD21      ASN  43  -1.787  24.422  -9.462
  314   HD22  ASN  43          HD22      ASN  43  -3.398  24.658  -8.876
  315    H    ILE  44           H        ILE  44   2.013  24.733  -5.073
  316    HA   ILE  44           HA       ILE  44   0.010  25.065  -2.949
  317    HB   ILE  44           HB       ILE  44   2.954  24.518  -2.550
  318   HG12  ILE  44          HG13      ILE  44   0.718  22.496  -2.832
  319   HG13  ILE  44          HG12      ILE  44   2.023  22.747  -3.985
  320   HG21  ILE  44          HG21      ILE  44   2.234  23.669  -0.383
  321   HG22  ILE  44          HG22      ILE  44   0.550  23.977  -0.803
  322   HG23  ILE  44          HG23      ILE  44   1.670  25.325  -0.610
  323   HD11  ILE  44          HD11      ILE  44   2.469  20.795  -2.652
  324   HD12  ILE  44          HD12      ILE  44   2.296  21.730  -1.166
  325   HD13  ILE  44          HD13      ILE  44   3.638  22.057  -2.261
  326    H    ASN  45           H        ASN  45  -0.067  27.266  -4.097
  327    HA   ASN  45           HA       ASN  45   0.133  29.508  -3.914
  328    HB2  ASN  45           HB3      ASN  45   1.642  28.763  -1.407
  329    HB3  ASN  45           HB2      ASN  45   1.430  30.436  -1.905
  330   HD21  ASN  45          HD21      ASN  45  -0.989  27.923  -2.356
  331   HD22  ASN  45          HD22      ASN  45  -2.125  28.568  -1.226
  332    H    ASN  46           H        ASN  46   3.344  28.664  -2.641
  333    HA   ASN  46           HA       ASN  46   4.477  30.315  -4.789
  334    HB2  ASN  46           HB3      ASN  46   6.401  30.640  -3.342
  335    HB3  ASN  46           HB2      ASN  46   4.925  31.034  -2.465
  336   HD21  ASN  46          HD21      ASN  46   7.584  30.250  -1.506
  337   HD22  ASN  46          HD22      ASN  46   7.336  28.858  -0.510
  338    H    SER  47           H        SER  47   4.135  27.080  -3.937
  339    HA   SER  47           HA       SER  47   6.537  26.379  -5.486
  340    HB2  SER  47           HB3      SER  47   6.743  25.817  -3.049
  341    HB3  SER  47           HB2      SER  47   5.348  24.751  -3.221
  342    HG   SER  47           HG       SER  47   7.932  24.499  -4.328
  343    H    VAL  48           H        VAL  48   5.970  25.596  -7.382
  344    HA   VAL  48           HA       VAL  48   3.560  23.912  -7.571
  345    HB   VAL  48           HB       VAL  48   4.875  25.422  -9.832
  346   HG11  VAL  48          HG11      VAL  48   2.783  24.961 -11.019
  347   HG12  VAL  48          HG12      VAL  48   2.204  24.043  -9.630
  348   HG13  VAL  48          HG13      VAL  48   3.609  23.480 -10.537
  349   HG21  VAL  48          HG21      VAL  48   3.046  27.024  -9.689
  350   HG22  VAL  48          HG22      VAL  48   3.992  27.008  -8.202
  351   HG23  VAL  48          HG23      VAL  48   2.427  26.203  -8.260
  352    H    PHE  49           H        PHE  49   3.958  21.819  -7.965
  353    HA   PHE  49           HA       PHE  49   6.049  20.957  -9.725
  354    HB2  PHE  49           HB3      PHE  49   7.387  19.723  -8.106
  355    HB3  PHE  49           HB2      PHE  49   7.351  21.423  -7.647
  356    HD1  PHE  49           HD1      PHE  49   5.927  22.142  -5.720
  357    HD2  PHE  49           HD2      PHE  49   6.538  18.043  -6.695
  358    HE1  PHE  49           HE1      PHE  49   5.172  21.490  -3.471
  359    HE2  PHE  49           HE2      PHE  49   5.780  17.390  -4.452
  360    HZ   PHE  49           HZ       PHE  49   5.094  19.115  -2.837
  361    H    ARG  50           H        ARG  50   6.184  18.485  -9.685
  362    HA   ARG  50           HA       ARG  50   3.504  17.419  -9.137
  363    HB2  ARG  50           HB3      ARG  50   4.111  15.589 -10.730
  364    HB3  ARG  50           HB2      ARG  50   4.017  17.182 -11.457
  365    HG2  ARG  50           HG3      ARG  50   6.489  17.310 -11.359
  366    HG3  ARG  50           HG2      ARG  50   6.506  15.648 -10.760
  367    HD2  ARG  50           HD3      ARG  50   6.873  15.812 -13.205
  368    HD3  ARG  50           HD2      ARG  50   5.454  14.860 -12.769
  369    HE   ARG  50           HE       ARG  50   4.880  17.641 -13.284
  370   HH11  ARG  50          HH11      ARG  50   5.287  14.482 -14.754
  371   HH12  ARG  50          HH12      ARG  50   4.259  14.839 -16.102
  372   HH21  ARG  50          HH21      ARG  50   3.540  18.105 -15.047
  373   HH22  ARG  50          HH22      ARG  50   3.268  16.913 -16.275
  374    H    GLN  51           H        GLN  51   3.292  16.205  -7.435
  375    HA   GLN  51           HA       GLN  51   5.636  15.293  -6.009
  376    HB2  GLN  51           HB3      GLN  51   4.020  14.681  -4.237
  377    HB3  GLN  51           HB2      GLN  51   3.843  16.352  -4.757
  378    HG2  GLN  51           HG3      GLN  51   1.957  15.611  -6.221
  379    HG3  GLN  51           HG2      GLN  51   2.079  14.021  -5.468
  380   HE21  GLN  51          HE21      GLN  51   0.056  14.092  -4.567
  381   HE22  GLN  51          HE22      GLN  51  -0.357  15.140  -3.250
  382    H    TYR  52           H        TYR  52   3.686  14.044  -8.370
  383    HA   TYR  52           HA       TYR  52   3.452  12.027  -9.352
  384    HB2  TYR  52           HB3      TYR  52   5.569  11.177  -7.368
  385    HB3  TYR  52           HB2      TYR  52   4.931  10.126  -8.627
  386    HD1  TYR  52           HD1      TYR  52   5.398  10.624 -11.007
  387    HD2  TYR  52           HD2      TYR  52   7.154  12.905  -7.873
  388    HE1  TYR  52           HE1      TYR  52   7.062  11.503 -12.584
  389    HE2  TYR  52           HE2      TYR  52   8.822  13.792  -9.448
  390    HH   TYR  52           HH       TYR  52   8.535  13.438 -12.821
  391    H    PHE  53           H        PHE  53   2.277  10.105  -9.149
  392    HA   PHE  53           HA       PHE  53   1.045   9.695  -6.504
  393    HB2  PHE  53           HB3      PHE  53  -0.331   9.412  -9.191
  394    HB3  PHE  53           HB2      PHE  53  -1.083   9.258  -7.603
  395    HD1  PHE  53           HD1      PHE  53  -1.278  11.271  -6.149
  396    HD2  PHE  53           HD2      PHE  53  -0.020  11.516 -10.205
  397    HE1  PHE  53           HE1      PHE  53  -1.754  13.684  -6.146
  398    HE2  PHE  53           HE2      PHE  53  -0.494  13.929 -10.212
  399    HZ   PHE  53           HZ       PHE  53  -1.358  15.016  -8.181
  400    H    PHE  54           H        PHE  54   1.420   7.731  -5.727
  401    HA   PHE  54           HA       PHE  54   2.551   5.717  -7.459
  402    HB2  PHE  54           HB3      PHE  54   2.832   4.426  -5.309
  403    HB3  PHE  54           HB2      PHE  54   3.652   5.979  -5.353
  404    HD1  PHE  54           HD1      PHE  54   1.107   3.973  -3.733
  405    HD2  PHE  54           HD2      PHE  54   2.762   7.883  -4.050
  406    HE1  PHE  54           HE1      PHE  54   0.006   4.604  -1.628
  407    HE2  PHE  54           HE2      PHE  54   1.663   8.519  -1.941
  408    HZ   PHE  54           HZ       PHE  54   0.282   6.880  -0.730
  409    H    GLU  55           H        GLU  55   1.342   4.349  -8.530
  410    HA   GLU  55           HA       GLU  55  -1.109   3.333  -7.247
  411    HB2  GLU  55           HB3      GLU  55  -0.680   3.676 -10.227
  412    HB3  GLU  55           HB2      GLU  55  -2.151   3.133  -9.437
  413    HG2  GLU  55           HG3      GLU  55  -2.238   5.405  -8.319
  414    HG3  GLU  55           HG2      GLU  55  -0.950   5.891  -9.426
  415    H    THR  56           H        THR  56  -0.688   1.330  -6.607
  416    HA   THR  56           HA       THR  56   0.959  -0.395  -8.317
  417    HB   THR  56           HB       THR  56  -0.058  -0.941  -5.519
  418    HG1  THR  56           HG1      THR  56   1.535   0.323  -4.961
  419   HG21  THR  56          HG21      THR  56   2.007  -2.368  -7.202
  420   HG22  THR  56          HG22      THR  56   0.400  -2.973  -6.800
  421   HG23  THR  56          HG23      THR  56   1.601  -2.752  -5.529
  422    H    LYS  57           H        LYS  57  -0.213  -1.292  -9.854
  423    HA   LYS  57           HA       LYS  57  -3.022  -1.963  -9.298
  424    HB2  LYS  57           HB3      LYS  57  -1.620  -1.552 -11.950
  425    HB3  LYS  57           HB2      LYS  57  -3.344  -1.815 -11.721
  426    HG2  LYS  57           HG3      LYS  57  -3.495   0.301 -10.495
  427    HG3  LYS  57           HG2      LYS  57  -1.772   0.569 -10.762
  428    HD2  LYS  57           HD3      LYS  57  -2.980   1.817 -12.405
  429    HD3  LYS  57           HD2      LYS  57  -2.215   0.451 -13.214
  430    HE2  LYS  57           HE3      LYS  57  -4.359  -0.780 -13.040
  431    HE3  LYS  57           HE2      LYS  57  -5.096   0.673 -12.372
  432    HZ1  LYS  57           HZ1      LYS  57  -3.849   0.464 -15.055
  433    HZ2  LYS  57           HZ2      LYS  57  -4.598   1.836 -14.416
  434    HZ3  LYS  57           HZ3      LYS  57  -5.510   0.453 -14.745
  435    H    CYS  58           H        CYS  58  -3.852  -3.775 -10.707
  436    HA   CYS  58           HA       CYS  58  -2.049  -6.067 -10.504
  437    HB2  CYS  58           HB3      CYS  58  -5.023  -5.969 -11.092
  438    HB3  CYS  58           HB2      CYS  58  -4.077  -7.431 -10.852
  439    H    ARG  59           H        ARG  59  -0.796  -6.243 -12.297
  440    HA   ARG  59           HA       ARG  59  -2.041  -5.860 -14.911
  441    HB2  ARG  59           HB3      ARG  59   0.249  -6.197 -15.821
  442    HB3  ARG  59           HB2      ARG  59   0.129  -4.847 -14.707
  443    HG2  ARG  59           HG3      ARG  59   1.157  -6.144 -12.958
  444    HG3  ARG  59           HG2      ARG  59   1.195  -7.568 -14.000
  445    HD2  ARG  59           HD3      ARG  59   2.757  -6.533 -15.476
  446    HD3  ARG  59           HD2      ARG  59   2.564  -4.974 -14.680
  447    HE   ARG  59           HE       ARG  59   3.596  -7.203 -13.091
  448   HH11  ARG  59          HH11      ARG  59   4.249  -4.248 -14.867
  449   HH12  ARG  59          HH12      ARG  59   5.775  -3.969 -14.088
  450   HH21  ARG  59          HH21      ARG  59   5.614  -6.835 -12.077
  451   HH22  ARG  59          HH22      ARG  59   6.554  -5.443 -12.508
  452    H    ALA  60           H        ALA  60  -2.125  -8.139 -12.772
  453    HA   ALA  60           HA       ALA  60  -2.682 -10.182 -14.731
  454    HB1  ALA  60           HB1      ALA  60  -1.328 -11.900 -13.632
  455    HB2  ALA  60           HB2      ALA  60  -0.693 -10.698 -12.510
  456    HB3  ALA  60           HB3      ALA  60  -0.308 -10.593 -14.227
  457    H    SER  61           H        SER  61  -4.670 -10.813 -14.163
  458    HA   SER  61           HA       SER  61  -5.699 -10.380 -11.528
  459    HB2  SER  61           HB3      SER  61  -7.712 -11.625 -12.465
  460    HB3  SER  61           HB2      SER  61  -7.252 -10.153 -13.319
  461    HG   SER  61           HG       SER  61  -7.124 -11.360 -15.022
  462    H    ASN  62           H        ASN  62  -4.272 -13.001 -13.263
  463    HA   ASN  62           HA       ASN  62  -3.984 -14.472 -10.779
  464    HB2  ASN  62           HB3      ASN  62  -5.308 -15.620 -13.237
  465    HB3  ASN  62           HB2      ASN  62  -4.492 -16.647 -12.065
  466   HD21  ASN  62          HD21      ASN  62  -5.333 -16.773  -9.944
  467   HD22  ASN  62          HD22      ASN  62  -6.988 -16.393  -9.619
  468    HA   PRO  63           HA       PRO  63   0.041 -14.257 -12.819
  469    HB2  PRO  63           HB3      PRO  63   1.391 -15.529 -10.782
  470    HB3  PRO  63           HB2      PRO  63   1.038 -13.795 -10.806
  471    HG2  PRO  63           HG3      PRO  63  -0.420 -16.017  -9.423
  472    HG3  PRO  63           HG2      PRO  63  -0.015 -14.402  -8.818
  473    HD2  PRO  63           HD3      PRO  63  -2.489 -14.975  -9.684
  474    HD3  PRO  63           HD2      PRO  63  -1.754 -13.382 -10.001
  475    H    VAL  64           H        VAL  64  -1.256 -17.114 -11.214
  476    HA   VAL  64           HA       VAL  64  -0.316 -18.751 -13.457
  477    HB   VAL  64           HB       VAL  64   0.145 -20.626 -11.885
  478   HG11  VAL  64          HG11      VAL  64   2.014 -19.335 -12.694
  479   HG12  VAL  64          HG12      VAL  64   2.284 -19.759 -11.002
  480   HG13  VAL  64          HG13      VAL  64   1.767 -18.129 -11.432
  481   HG21  VAL  64          HG21      VAL  64  -0.134 -18.523  -9.747
  482   HG22  VAL  64          HG22      VAL  64   0.424 -20.177  -9.507
  483   HG23  VAL  64          HG23      VAL  64  -1.236 -19.872 -10.017
  484    H    GLU  65           H        GLU  65  -1.607 -20.751 -13.691
  485    HA   GLU  65           HA       GLU  65  -4.383 -20.079 -13.404
  486    HB2  GLU  65           HB3      GLU  65  -3.084 -22.575 -14.497
  487    HB3  GLU  65           HB2      GLU  65  -4.791 -22.185 -14.622
  488    HG2  GLU  65           HG3      GLU  65  -4.197 -20.168 -15.908
  489    HG3  GLU  65           HG2      GLU  65  -2.505 -20.663 -15.846
  490    H    SER  66           H        SER  66  -2.192 -21.648 -11.415
  491    HA   SER  66           HA       SER  66  -4.167 -23.334 -10.120
  492    HB2  SER  66           HB3      SER  66  -1.353 -22.730  -9.189
  493    HB3  SER  66           HB2      SER  66  -2.370 -24.094  -8.723
  494    HG   SER  66           HG       SER  66  -2.086 -23.970 -11.413
  495    H    GLY  67           H        GLY  67  -3.412 -20.094 -10.068
  496    HA2  GLY  67           HA3      GLY  67  -4.986 -18.895  -8.490
  497    HA3  GLY  67           HA2      GLY  67  -4.184 -19.825  -7.229
  498    H    CYS  68           H        CYS  68  -2.765 -18.649  -6.125
  499    HA   CYS  68           HA       CYS  68  -1.274 -16.562  -7.572
  500    HB2  CYS  68           HB3      CYS  68  -2.182 -16.578  -4.682
  501    HB3  CYS  68           HB2      CYS  68  -1.154 -15.339  -5.406
  502    H    ARG  69           H        ARG  69  -0.131 -18.902  -7.767
  503    HA   ARG  69           HA       ARG  69   1.898 -19.900  -7.583
  504    HB2  ARG  69           HB3      ARG  69   2.548 -17.402  -6.010
  505    HB3  ARG  69           HB2      ARG  69   3.742 -18.598  -6.506
  506    HG2  ARG  69           HG3      ARG  69   3.256 -18.130  -8.848
  507    HG3  ARG  69           HG2      ARG  69   2.009 -16.980  -8.364
  508    HD2  ARG  69           HD3      ARG  69   3.650 -15.550  -7.332
  509    HD3  ARG  69           HD2      ARG  69   4.929 -16.732  -7.629
  510    HE   ARG  69           HE       ARG  69   4.117 -16.273 -10.109
  511   HH11  ARG  69          HH11      ARG  69   4.661 -13.968  -7.524
  512   HH12  ARG  69          HH12      ARG  69   5.202 -12.714  -8.595
  513   HH21  ARG  69          HH21      ARG  69   4.825 -14.628 -11.507
  514   HH22  ARG  69          HH22      ARG  69   5.304 -13.091 -10.863
  515    H    GLY  70           H        GLY  70   1.137 -21.669  -6.406
  516    HA2  GLY  70           HA3      GLY  70   2.043 -23.046  -4.617
  517    HA3  GLY  70           HA2      GLY  70   1.997 -21.627  -3.581
  518    H    ILE  71           H        ILE  71  -0.671 -20.889  -4.633
  519    HA   ILE  71           HA       ILE  71  -2.262 -22.022  -2.639
  520    HB   ILE  71           HB       ILE  71  -3.184 -20.771  -5.232
  521   HG12  ILE  71          HG13      ILE  71  -1.691 -19.283  -3.965
  522   HG13  ILE  71          HG12      ILE  71  -3.343 -18.680  -3.962
  523   HG21  ILE  71          HG21      ILE  71  -4.637 -21.163  -2.621
  524   HG22  ILE  71          HG22      ILE  71  -4.972 -21.989  -4.144
  525   HG23  ILE  71          HG23      ILE  71  -5.247 -20.253  -4.004
  526   HD11  ILE  71          HD11      ILE  71  -2.324 -18.410  -1.785
  527   HD12  ILE  71          HD12      ILE  71  -1.977 -20.136  -1.710
  528   HD13  ILE  71          HD13      ILE  71  -3.648 -19.574  -1.699
  529    H    ASP  72           H        ASP  72  -3.608 -23.745  -2.551
  530    HA   ASP  72           HA       ASP  72  -3.390 -25.744  -4.628
  531    HB2  ASP  72           HB3      ASP  72  -3.286 -26.452  -2.287
  532    HB3  ASP  72           HB2      ASP  72  -4.891 -25.786  -1.997
  533    H    SER  73           H        SER  73  -4.726 -25.854  -6.281
  534    HA   SER  73           HA       SER  73  -6.906 -24.038  -6.521
  535    HB2  SER  73           HB3      SER  73  -6.239 -26.315  -8.390
  536    HB3  SER  73           HB2      SER  73  -7.049 -24.796  -8.780
  537    HG   SER  73           HG       SER  73  -4.902 -23.901  -7.882
  538    H    LYS  74           H        LYS  74  -6.768 -27.047  -5.070
  539    HA   LYS  74           HA       LYS  74  -9.444 -27.841  -5.910
  540    HB2  LYS  74           HB3      LYS  74  -7.720 -29.574  -5.788
  541    HB3  LYS  74           HB2      LYS  74  -7.449 -29.205  -4.094
  542    HG2  LYS  74           HG3      LYS  74  -9.562 -30.067  -3.474
  543    HG3  LYS  74           HG2      LYS  74 -10.092 -30.159  -5.154
  544    HD2  LYS  74           HD3      LYS  74  -9.491 -32.364  -4.311
  545    HD3  LYS  74           HD2      LYS  74  -8.399 -31.859  -5.596
  546    HE2  LYS  74           HE3      LYS  74  -6.719 -31.243  -3.970
  547    HE3  LYS  74           HE2      LYS  74  -7.813 -31.642  -2.650
  548    HZ1  LYS  74           HZ1      LYS  74  -7.798 -33.941  -3.370
  549    HZ2  LYS  74           HZ2      LYS  74  -6.218 -33.415  -3.077
  550    HZ3  LYS  74           HZ3      LYS  74  -6.777 -33.564  -4.663
  551    H    HIS  75           H        HIS  75  -7.791 -26.372  -3.257
  552    HA   HIS  75           HA       HIS  75 -10.209 -26.562  -1.601
  553    HB2  HIS  75           HB3      HIS  75  -7.353 -25.890  -0.879
  554    HB3  HIS  75           HB2      HIS  75  -8.698 -25.731   0.245
  555    HD1  HIS  75           HD1      HIS  75  -6.754 -28.340  -1.666
  556    HD2  HIS  75           HD2      HIS  75  -9.517 -28.079   1.436
  557    HE1  HIS  75           HE1      HIS  75  -6.854 -30.641  -0.644
  558    HE2  HIS  75           HE2      HIS  75  -8.474 -30.442   1.274
  559    H    TRP  76           H        TRP  76  -8.052 -24.288  -3.170
  560    HA   TRP  76           HA       TRP  76  -9.838 -22.113  -2.318
  561    HB2  TRP  76           HB3      TRP  76  -6.817 -22.074  -2.396
  562    HB3  TRP  76           HB2      TRP  76  -7.809 -20.627  -2.239
  563    HD1  TRP  76           HD1      TRP  76  -6.178 -23.296  -0.225
  564    HE1  TRP  76           HE1      TRP  76  -6.797 -23.025   2.259
  565    HE3  TRP  76           HE3      TRP  76  -9.998 -19.924  -0.692
  566    HZ2  TRP  76           HZ2      TRP  76  -8.639 -21.573   3.811
  567    HZ3  TRP  76           HZ3      TRP  76 -11.131 -19.145   1.346
  568    HH2  TRP  76           HH2      TRP  76 -10.467 -19.956   3.552
  569    H    ASN  77           H        ASN  77 -10.472 -20.768  -3.875
  570    HA   ASN  77           HA       ASN  77  -9.017 -20.779  -6.437
  571    HB2  ASN  77           HB3      ASN  77 -11.437 -21.240  -6.642
  572    HB3  ASN  77           HB2      ASN  77 -11.798 -19.744  -5.793
  573   HD21  ASN  77          HD21      ASN  77 -10.676 -21.153  -8.771
  574   HD22  ASN  77          HD22      ASN  77 -10.835 -19.727  -9.736
  575    H    SER  78           H        SER  78  -8.034 -18.919  -7.107
  576    HA   SER  78           HA       SER  78  -7.966 -16.770  -5.099
  577    HB2  SER  78           HB3      SER  78  -5.728 -17.551  -6.975
  578    HB3  SER  78           HB2      SER  78  -5.637 -16.462  -5.593
  579    HG   SER  78           HG       SER  78  -6.076 -18.257  -4.247
  580    H    TYR  79           H        TYR  79  -7.761 -14.636  -5.783
  581    HA   TYR  79           HA       TYR  79  -7.680 -14.027  -8.611
  582    HB2  TYR  79           HB3      TYR  79 -10.068 -14.338  -8.335
  583    HB3  TYR  79           HB2      TYR  79 -10.076 -13.324  -6.894
  584    HD1  TYR  79           HD1      TYR  79 -10.601 -11.065  -7.094
  585    HD2  TYR  79           HD2      TYR  79  -9.302 -13.191 -10.541
  586    HE1  TYR  79           HE1      TYR  79 -11.083  -9.097  -8.481
  587    HE2  TYR  79           HE2      TYR  79  -9.781 -11.228 -11.939
  588    HH   TYR  79           HH       TYR  79 -10.382  -8.155 -10.636
  589    H    CYS  80           H        CYS  80  -6.649 -12.133  -8.964
  590    HA   CYS  80           HA       CYS  80  -5.687 -10.711  -6.624
  591    HB2  CYS  80           HB3      CYS  80  -5.013 -10.400  -9.558
  592    HB3  CYS  80           HB2      CYS  80  -4.218  -9.535  -8.240
  593    H    THR  81           H        THR  81  -6.458  -8.874  -5.898
  594    HA   THR  81           HA       THR  81  -8.131  -7.217  -7.668
  595    HB   THR  81           HB       THR  81  -8.589  -7.694  -4.708
  596    HG1  THR  81           HG1      THR  81  -9.119  -9.408  -6.397
  597   HG21  THR  81          HG21      THR  81 -10.261  -6.211  -6.741
  598   HG22  THR  81          HG22      THR  81  -9.292  -5.467  -5.469
  599   HG23  THR  81          HG23      THR  81 -10.677  -6.475  -5.047
  600    H    THR  82           H        THR  82  -7.562  -5.099  -7.720
  601    HA   THR  82           HA       THR  82  -5.281  -4.252  -6.193
  602    HB   THR  82           HB       THR  82  -5.422  -3.507  -8.495
  603    HG1  THR  82           HG1      THR  82  -5.523  -1.076  -7.935
  604   HG21  THR  82          HG21      THR  82  -7.147  -1.836  -9.166
  605   HG22  THR  82          HG22      THR  82  -7.998  -2.176  -7.658
  606   HG23  THR  82          HG23      THR  82  -7.793  -3.447  -8.862
  607    H    THR  83           H        THR  83  -5.253  -3.025  -4.422
  608    HA   THR  83           HA       THR  83  -7.784  -2.422  -3.146
  609    HB   THR  83           HB       THR  83  -6.194  -1.602  -1.277
  610    HG1  THR  83           HG1      THR  83  -4.338  -3.212  -2.712
  611   HG21  THR  83          HG21      THR  83  -7.444  -3.695  -1.157
  612   HG22  THR  83          HG22      THR  83  -5.824  -3.898  -0.494
  613   HG23  THR  83          HG23      THR  83  -6.198  -4.505  -2.106
  614    H    HIS  84           H        HIS  84  -8.229  -0.310  -2.235
  615    HA   HIS  84           HA       HIS  84  -6.954   1.846  -3.776
  616    HB2  HIS  84           HB3      HIS  84  -9.209   2.998  -3.774
  617    HB3  HIS  84           HB2      HIS  84  -9.087   1.581  -4.804
  618    HD1  HIS  84           HD1      HIS  84 -10.663   2.758  -1.587
  619    HD2  HIS  84           HD2      HIS  84 -10.816  -0.486  -4.180
  620    HE1  HIS  84           HE1      HIS  84 -12.670   1.423  -0.881
  621    HE2  HIS  84           HE2      HIS  84 -12.675  -0.597  -2.386
  622    H    THR  85           H        THR  85  -5.997   3.279  -2.538
  623    HA   THR  85           HA       THR  85  -7.009   3.639   0.209
  624    HB   THR  85           HB       THR  85  -4.645   2.759  -0.015
  625    HG1  THR  85           HG1      THR  85  -4.071   3.911   1.739
  626   HG21  THR  85          HG21      THR  85  -2.886   4.356  -0.620
  627   HG22  THR  85          HG22      THR  85  -4.111   5.547  -1.053
  628   HG23  THR  85          HG23      THR  85  -3.965   4.056  -1.983
  629    H    PHE  86           H        PHE  86  -6.726   5.892   1.065
  630    HA   PHE  86           HA       PHE  86  -7.361   7.778  -1.098
  631    HB2  PHE  86           HB3      PHE  86  -8.346   7.693   1.761
  632    HB3  PHE  86           HB2      PHE  86  -8.585   9.079   0.697
  633    HD1  PHE  86           HD1      PHE  86  -9.732   5.777   1.598
  634    HD2  PHE  86           HD2      PHE  86  -9.935   8.820  -1.368
  635    HE1  PHE  86           HE1      PHE  86 -11.763   4.738   0.679
  636    HE2  PHE  86           HE2      PHE  86 -11.966   7.789  -2.292
  637    HZ   PHE  86           HZ       PHE  86 -12.884   5.747  -1.273
  638    H    VAL  87           H        VAL  87  -5.852   9.198  -1.501
  639    HA   VAL  87           HA       VAL  87  -4.040   9.998   0.689
  640    HB   VAL  87           HB       VAL  87  -2.349  10.482  -1.061
  641   HG11  VAL  87          HG11      VAL  87  -2.285   8.361   0.121
  642   HG12  VAL  87          HG12      VAL  87  -1.780   8.149  -1.556
  643   HG13  VAL  87          HG13      VAL  87  -3.397   7.656  -1.054
  644   HG21  VAL  87          HG21      VAL  87  -3.886  10.845  -2.938
  645   HG22  VAL  87          HG22      VAL  87  -4.290   9.127  -2.931
  646   HG23  VAL  87          HG23      VAL  87  -2.651   9.647  -3.324
  647    H    LYS  88           H        LYS  88  -3.268  12.182   0.666
  648    HA   LYS  88           HA       LYS  88  -5.321  14.048  -0.149
  649    HB2  LYS  88           HB3      LYS  88  -2.686  14.617   1.223
  650    HB3  LYS  88           HB2      LYS  88  -4.042  15.720   1.067
  651    HG2  LYS  88           HG3      LYS  88  -5.396  14.125   2.428
  652    HG3  LYS  88           HG2      LYS  88  -3.923  13.197   2.697
  653    HD2  LYS  88           HD3      LYS  88  -4.235  14.631   4.574
  654    HD3  LYS  88           HD2      LYS  88  -2.887  15.270   3.632
  655    HE2  LYS  88           HE3      LYS  88  -4.404  16.908   2.609
  656    HE3  LYS  88           HE2      LYS  88  -5.733  16.269   3.573
  657    HZ1  LYS  88           HZ1      LYS  88  -3.311  17.666   4.552
  658    HZ2  LYS  88           HZ2      LYS  88  -4.387  16.855   5.573
  659    HZ3  LYS  88           HZ3      LYS  88  -4.918  18.185   4.665
  660    H    ALA  89           H        ALA  89  -5.347  14.645  -2.181
  661    HA   ALA  89           HA       ALA  89  -2.812  15.522  -3.401
  662    HB1  ALA  89           HB1      ALA  89  -3.586  14.693  -5.563
  663    HB2  ALA  89           HB2      ALA  89  -5.048  14.061  -4.808
  664    HB3  ALA  89           HB3      ALA  89  -3.474  13.385  -4.386
  665    H    LEU  90           H        LEU  90  -2.885  17.424  -4.499
  666    HA   LEU  90           HA       LEU  90  -5.134  19.129  -4.052
  667    HB2  LEU  90           HB3      LEU  90  -2.723  19.884  -4.120
  668    HB3  LEU  90           HB2      LEU  90  -2.755  19.614  -5.857
  669    HG   LEU  90           HG       LEU  90  -4.699  21.277  -5.918
  670   HD11  LEU  90          HD11      LEU  90  -3.624  21.874  -3.167
  671   HD12  LEU  90          HD12      LEU  90  -5.244  21.302  -3.565
  672   HD13  LEU  90          HD13      LEU  90  -4.726  22.908  -4.075
  673   HD21  LEU  90          HD21      LEU  90  -1.945  22.210  -5.123
  674   HD22  LEU  90          HD22      LEU  90  -3.174  23.197  -5.913
  675   HD23  LEU  90          HD23      LEU  90  -2.486  21.808  -6.755
  676    H    THR  91           H        THR  91  -6.928  18.718  -5.150
  677    HA   THR  91           HA       THR  91  -6.716  18.331  -8.060
  678    HB   THR  91           HB       THR  91  -8.567  16.715  -7.975
  679    HG1  THR  91           HG1      THR  91  -8.288  16.796  -5.144
  680   HG21  THR  91          HG21      THR  91  -6.401  15.893  -6.036
  681   HG22  THR  91          HG22      THR  91  -6.219  15.892  -7.787
  682   HG23  THR  91          HG23      THR  91  -7.399  14.829  -7.026
  683    H    THR  92           H        THR  92  -8.858  18.804  -9.152
  684    HA   THR  92           HA       THR  92 -10.271  20.897  -7.647
  685    HB   THR  92           HB       THR  92  -8.954  21.908  -9.431
  686    HG1  THR  92           HG1      THR  92 -11.027  22.786  -8.934
  687   HG21  THR  92          HG21      THR  92 -10.561  20.215 -11.343
  688   HG22  THR  92          HG22      THR  92  -8.847  20.008 -10.974
  689   HG23  THR  92          HG23      THR  92  -9.407  21.471 -11.785
  690    H    ASP  93           H        ASP  93 -12.238  20.307  -7.122
  691    HA   ASP  93           HA       ASP  93 -13.598  18.260  -8.692
  692    HB2  ASP  93           HB3      ASP  93 -15.149  18.073  -6.820
  693    HB3  ASP  93           HB2      ASP  93 -13.490  17.974  -6.244
  694    H    GLU  94           H        GLU  94 -13.753  21.663  -8.024
  695    HA   GLU  94           HA       GLU  94 -16.076  21.797  -9.822
  696    HB2  GLU  94           HB3      GLU  94 -15.498  23.564  -7.441
  697    HB3  GLU  94           HB2      GLU  94 -16.703  23.940  -8.660
  698    HG2  GLU  94           HG3      GLU  94 -17.849  21.812  -8.087
  699    HG3  GLU  94           HG2      GLU  94 -16.691  21.595  -6.780
  700    H    LYS  95           H        LYS  95 -14.307  24.567  -8.564
  701    HA   LYS  95           HA       LYS  95 -12.997  24.895 -11.175
  702    HB2  LYS  95           HB3      LYS  95 -14.620  26.979  -9.709
  703    HB3  LYS  95           HB2      LYS  95 -13.556  27.338 -11.060
  704    HG2  LYS  95           HG3      LYS  95 -14.889  25.913 -12.507
  705    HG3  LYS  95           HG2      LYS  95 -15.941  25.508 -11.152
  706    HD2  LYS  95           HD3      LYS  95 -16.581  27.847 -10.944
  707    HD3  LYS  95           HD2      LYS  95 -15.525  28.265 -12.294
  708    HE2  LYS  95           HE3      LYS  95 -17.886  26.396 -12.422
  709    HE3  LYS  95           HE2      LYS  95 -17.883  28.071 -12.970
  710    HZ1  LYS  95           HZ1      LYS  95 -16.208  25.878 -14.069
  711    HZ2  LYS  95           HZ2      LYS  95 -16.170  27.488 -14.582
  712    HZ3  LYS  95           HZ3      LYS  95 -17.565  26.563 -14.812
  713    H    GLN  96           H        GLN  96 -12.496  24.543  -8.005
  714    HA   GLN  96           HA       GLN  96 -10.117  26.275  -8.033
  715    HB2  GLN  96           HB3      GLN  96 -11.945  25.623  -5.717
  716    HB3  GLN  96           HB2      GLN  96 -10.364  26.357  -5.520
  717    HG2  GLN  96           HG3      GLN  96 -12.609  27.558  -7.122
  718    HG3  GLN  96           HG2      GLN  96 -12.248  27.958  -5.445
  719   HE21  GLN  96          HE21      GLN  96 -11.273  28.307  -8.752
  720   HE22  GLN  96          HE22      GLN  96 -10.068  29.517  -8.479
  721    H    ALA  97           H        ALA  97  -8.333  25.456  -6.732
  722    HA   ALA  97           HA       ALA  97  -8.207  22.534  -6.863
  723    HB1  ALA  97           HB1      ALA  97  -5.795  22.796  -6.726
  724    HB2  ALA  97           HB2      ALA  97  -5.977  24.531  -6.488
  725    HB3  ALA  97           HB3      ALA  97  -6.447  23.798  -8.023
  726    H    ALA  98           H        ALA  98  -8.197  21.322  -5.081
  727    HA   ALA  98           HA       ALA  98  -7.477  22.520  -2.515
  728    HB1  ALA  98           HB1      ALA  98  -9.501  21.675  -1.438
  729    HB2  ALA  98           HB2      ALA  98 -10.092  21.090  -2.994
  730    HB3  ALA  98           HB3      ALA  98  -9.902  22.822  -2.717
  731    H    TRP  99           H        TRP  99  -6.915  20.988  -0.912
  732    HA   TRP  99           HA       TRP  99  -5.793  18.564  -1.965
  733    HB2  TRP  99           HB3      TRP  99  -5.966  19.617   0.871
  734    HB3  TRP  99           HB2      TRP  99  -5.098  18.160   0.411
  735    HD1  TRP  99           HD1      TRP  99  -4.769  21.919   0.476
  736    HE1  TRP  99           HE1      TRP  99  -2.423  22.583  -0.352
  737    HE3  TRP  99           HE3      TRP  99  -3.219  17.382  -1.288
  738    HZ2  TRP  99           HZ2      TRP  99  -0.213  21.342  -1.590
  739    HZ3  TRP  99           HZ3      TRP  99  -0.971  17.206  -2.286
  740    HH2  TRP  99           HH2      TRP  99   0.497  19.150  -2.432
  741    H    ARG 100           H        ARG 100  -7.232  17.095  -2.568
  742    HA   ARG 100           HA       ARG 100  -9.465  16.437  -0.781
  743    HB2  ARG 100           HB3      ARG 100  -8.928  15.647  -3.657
  744    HB3  ARG 100           HB2      ARG 100 -10.346  15.171  -2.736
  745    HG2  ARG 100           HG3      ARG 100  -9.604  18.013  -3.403
  746    HG3  ARG 100           HG2      ARG 100 -10.756  17.028  -4.304
  747    HD2  ARG 100           HD3      ARG 100 -12.107  16.795  -2.247
  748    HD3  ARG 100           HD2      ARG 100 -10.980  17.864  -1.418
  749    HE   ARG 100           HE       ARG 100 -12.245  18.889  -3.832
  750   HH11  ARG 100          HH11      ARG 100 -12.125  18.824  -0.334
  751   HH12  ARG 100          HH12      ARG 100 -13.075  20.265  -0.151
  752   HH21  ARG 100          HH21      ARG 100 -13.480  20.780  -3.610
  753   HH22  ARG 100          HH22      ARG 100 -13.838  21.385  -2.014
  754    H    PHE 101           H        PHE 101 -10.009  14.099  -0.647
  755    HA   PHE 101           HA       PHE 101  -7.553  12.502  -0.335
  756    HB2  PHE 101           HB3      PHE 101 -10.270  12.289   0.994
  757    HB3  PHE 101           HB2      PHE 101  -9.065  11.018   1.097
  758    HD1  PHE 101           HD1      PHE 101  -7.533  11.033   2.822
  759    HD2  PHE 101           HD2      PHE 101  -9.507  14.655   1.768
  760    HE1  PHE 101           HE1      PHE 101  -6.517  12.150   4.764
  761    HE2  PHE 101           HE2      PHE 101  -8.491  15.775   3.706
  762    HZ   PHE 101           HZ       PHE 101  -6.997  14.523   5.208
  763    H    ILE 102           H        ILE 102  -7.240  11.392  -2.177
  764    HA   ILE 102           HA       ILE 102  -9.648  10.423  -3.577
  765    HB   ILE 102           HB       ILE 102  -8.330  10.498  -5.660
  766   HG12  ILE 102          HG13      ILE 102  -6.250  11.978  -4.047
  767   HG13  ILE 102          HG12      ILE 102  -6.090  10.296  -4.537
  768   HG21  ILE 102          HG21      ILE 102  -9.774  12.358  -5.081
  769   HG22  ILE 102          HG22      ILE 102  -8.332  12.934  -5.917
  770   HG23  ILE 102          HG23      ILE 102  -8.466  13.111  -4.167
  771   HD11  ILE 102          HD11      ILE 102  -6.313  12.668  -6.371
  772   HD12  ILE 102          HD12      ILE 102  -6.188  10.985  -6.883
  773   HD13  ILE 102          HD13      ILE 102  -4.851  11.747  -6.017
  774    H    ARG 103           H        ARG 103  -9.702   8.413  -4.433
  775    HA   ARG 103           HA       ARG 103  -8.046   6.471  -3.106
  776    HB2  ARG 103           HB3      ARG 103  -9.451   4.804  -4.331
  777    HB3  ARG 103           HB2      ARG 103 -10.366   5.917  -3.326
  778    HG2  ARG 103           HG3      ARG 103 -11.146   7.114  -5.204
  779    HG3  ARG 103           HG2      ARG 103  -9.990   6.323  -6.276
  780    HD2  ARG 103           HD3      ARG 103 -12.142   4.828  -4.793
  781    HD3  ARG 103           HD2      ARG 103 -12.375   5.491  -6.413
  782    HE   ARG 103           HE       ARG 103 -10.108   4.015  -6.651
  783   HH11  ARG 103          HH11      ARG 103 -13.311   3.294  -5.423
  784   HH12  ARG 103          HH12      ARG 103 -13.276   1.640  -5.947
  785   HH21  ARG 103          HH21      ARG 103 -10.051   1.839  -7.330
  786   HH22  ARG 103          HH22      ARG 103 -11.418   0.809  -7.036
  787    H    ILE 104           H        ILE 104  -6.222   5.714  -3.817
  788    HA   ILE 104           HA       ILE 104  -5.831   5.439  -6.722
  789    HB   ILE 104           HB       ILE 104  -3.385   5.677  -6.330
  790   HG12  ILE 104          HG13      ILE 104  -4.206   6.666  -3.594
  791   HG13  ILE 104          HG12      ILE 104  -3.436   5.116  -3.906
  792   HG21  ILE 104          HG21      ILE 104  -5.059   8.047  -5.516
  793   HG22  ILE 104          HG22      ILE 104  -4.671   7.558  -7.166
  794   HG23  ILE 104          HG23      ILE 104  -3.391   8.118  -6.087
  795   HD11  ILE 104          HD11      ILE 104  -2.240   7.817  -4.460
  796   HD12  ILE 104          HD12      ILE 104  -1.463   6.261  -4.745
  797   HD13  ILE 104          HD13      ILE 104  -1.848   6.765  -3.101
  798    H    ASP 105           H        ASP 105  -4.449   3.661  -7.343
  799    HA   ASP 105           HA       ASP 105  -5.128   1.246  -6.035
  800    HB2  ASP 105           HB3      ASP 105  -3.062   1.791  -8.186
  801    HB3  ASP 105           HB2      ASP 105  -3.569   0.182  -7.672
  802    H    THR 106           H        THR 106  -4.244   0.363  -4.329
  803    HA   THR 106           HA       THR 106  -1.821   1.577  -3.247
  804    HB   THR 106           HB       THR 106  -3.507  -0.454  -1.815
  805    HG1  THR 106           HG1      THR 106  -4.423   1.797  -2.891
  806   HG21  THR 106          HG21      THR 106  -2.873   0.850   0.138
  807   HG22  THR 106          HG22      THR 106  -2.060   2.031  -0.888
  808   HG23  THR 106          HG23      THR 106  -1.434   0.386  -0.768
  809    H    ALA 107           H        ALA 107  -3.168  -1.697  -3.575
  810    HA   ALA 107           HA       ALA 107  -0.651  -2.767  -4.460
  811    HB1  ALA 107           HB1      ALA 107  -0.396  -4.366  -2.627
  812    HB2  ALA 107           HB2      ALA 107  -1.760  -3.627  -1.787
  813    HB3  ALA 107           HB3      ALA 107  -0.276  -2.706  -2.042
  814    H    CYS 108           H        CYS 108  -0.867  -4.990  -5.159
  815    HA   CYS 108           HA       CYS 108  -3.641  -5.640  -5.816
  816    HB2  CYS 108           HB3      CYS 108  -1.923  -5.523  -7.647
  817    HB3  CYS 108           HB2      CYS 108  -1.107  -6.900  -6.899
  818    H    VAL 109           H        VAL 109  -4.634  -6.910  -4.423
  819    HA   VAL 109           HA       VAL 109  -3.017  -8.719  -2.772
  820    HB   VAL 109           HB       VAL 109  -4.891  -8.784  -1.225
  821   HG11  VAL 109          HG11      VAL 109  -4.252  -5.969  -2.088
  822   HG12  VAL 109          HG12      VAL 109  -3.307  -6.961  -0.978
  823   HG13  VAL 109          HG13      VAL 109  -4.929  -6.436  -0.528
  824   HG21  VAL 109          HG21      VAL 109  -6.903  -7.420  -1.580
  825   HG22  VAL 109          HG22      VAL 109  -6.739  -8.676  -2.808
  826   HG23  VAL 109          HG23      VAL 109  -6.329  -7.005  -3.195
  827    H    CYS 110           H        CYS 110  -3.631 -10.887  -2.474
  828    HA   CYS 110           HA       CYS 110  -5.272 -11.958  -4.652
  829    HB2  CYS 110           HB3      CYS 110  -3.006 -12.899  -4.477
  830    HB3  CYS 110           HB2      CYS 110  -3.326 -13.382  -2.818
  831    H    VAL 111           H        VAL 111  -7.311 -12.328  -4.159
  832    HA   VAL 111           HA       VAL 111  -8.069 -12.845  -1.396
  833    HB   VAL 111           HB       VAL 111 -10.363 -12.621  -2.103
  834   HG11  VAL 111          HG11      VAL 111  -9.226 -10.537  -1.729
  835   HG12  VAL 111          HG12      VAL 111 -10.339 -10.351  -3.083
  836   HG13  VAL 111          HG13      VAL 111  -8.612 -10.531  -3.382
  837   HG21  VAL 111          HG21      VAL 111 -10.251 -13.825  -4.214
  838   HG22  VAL 111          HG22      VAL 111  -9.337 -12.500  -4.934
  839   HG23  VAL 111          HG23      VAL 111 -11.007 -12.248  -4.430
  840    H    LEU 112           H        LEU 112  -9.197 -14.712  -0.751
  841    HA   LEU 112           HA       LEU 112  -8.799 -17.018  -2.541
  842    HB2  LEU 112           HB3      LEU 112  -8.631 -16.902   0.474
  843    HB3  LEU 112           HB2      LEU 112  -8.514 -18.367  -0.481
  844    HG   LEU 112           HG       LEU 112  -6.562 -16.063  -0.630
  845   HD11  LEU 112          HD11      LEU 112  -6.352 -18.738   0.743
  846   HD12  LEU 112          HD12      LEU 112  -6.443 -17.160   1.526
  847   HD13  LEU 112          HD13      LEU 112  -5.036 -17.580   0.548
  848   HD21  LEU 112          HD21      LEU 112  -5.173 -17.657  -1.875
  849   HD22  LEU 112          HD22      LEU 112  -6.690 -17.322  -2.709
  850   HD23  LEU 112          HD23      LEU 112  -6.485 -18.835  -1.824
  851    H    SER 113           H        SER 113 -10.464 -18.400  -2.821
  852    HA   SER 113           HA       SER 113 -12.816 -18.069  -1.091
  853    HB2  SER 113           HB3      SER 113 -14.227 -18.490  -3.144
  854    HB3  SER 113           HB2      SER 113 -13.394 -16.937  -3.130
  855    HG   SER 113           HG       SER 113 -11.760 -17.943  -4.444
  856    H    ARG 114           H        ARG 114 -14.062 -19.954  -0.788
  857    HA   ARG 114           HA       ARG 114 -12.505 -22.356  -0.762
  858    HB2  ARG 114           HB3      ARG 114 -15.278 -21.653   0.148
  859    HB3  ARG 114           HB2      ARG 114 -14.730 -23.323   0.139
  860    HG2  ARG 114           HG3      ARG 114 -13.333 -21.089   1.592
  861    HG3  ARG 114           HG2      ARG 114 -14.491 -22.197   2.330
  862    HD2  ARG 114           HD3      ARG 114 -13.042 -24.085   1.672
  863    HD3  ARG 114           HD2      ARG 114 -11.868 -22.934   1.040
  864    HE   ARG 114           HE       ARG 114 -12.403 -22.282   3.709
  865   HH11  ARG 114          HH11      ARG 114 -10.905 -24.823   1.837
  866   HH12  ARG 114          HH12      ARG 114  -9.772 -25.253   3.074
  867   HH21  ARG 114          HH21      ARG 114 -10.920 -22.850   5.359
  868   HH22  ARG 114          HH22      ARG 114  -9.788 -24.137   5.090
  869    H    LYS 115           H        LYS 115 -13.824 -21.027  -3.290
  870    HA   LYS 115           HA       LYS 115 -14.361 -21.736  -5.372
  871    HB2  LYS 115           HB3      LYS 115 -14.171 -24.555  -4.277
  872    HB3  LYS 115           HB2      LYS 115 -14.267 -24.116  -5.974
  873    HG2  LYS 115           HG3      LYS 115 -12.112 -22.887  -5.701
  874    HG3  LYS 115           HG2      LYS 115 -12.016 -23.545  -4.064
  875    HD2  LYS 115           HD3      LYS 115 -10.703 -24.914  -5.555
  876    HD3  LYS 115           HD2      LYS 115 -12.110 -25.820  -5.002
  877    HE2  LYS 115           HE3      LYS 115 -13.247 -25.437  -7.074
  878    HE3  LYS 115           HE2      LYS 115 -11.977 -24.349  -7.626
  879    HZ1  LYS 115           HZ1      LYS 115 -10.436 -26.242  -7.571
  880    HZ2  LYS 115           HZ2      LYS 115 -11.719 -26.487  -8.650
  881    HZ3  LYS 115           HZ3      LYS 115 -11.717 -27.265  -7.149
  882    H    ALA 116           H        ALA 116 -15.961 -23.766  -2.936
  883    HA   ALA 116           HA       ALA 116 -18.527 -23.455  -4.243
  884    HB1  ALA 116           HB1      ALA 116 -18.000 -25.549  -3.087
  885    HB2  ALA 116           HB2      ALA 116 -19.401 -24.757  -2.367
  886    HB3  ALA 116           HB3      ALA 116 -17.832 -24.670  -1.567
  887    H    THR 117           H        THR 117 -20.376 -22.730  -2.767
  888    HA   THR 117           HA       THR 117 -21.488 -21.020  -1.815
  889    HB   THR 117           HB       THR 117 -20.683 -20.053   0.259
  890    HG1  THR 117           HG1      THR 117 -18.220 -20.883  -0.706
  891   HG21  THR 117          HG21      THR 117 -20.355 -22.121   1.543
  892   HG22  THR 117          HG22      THR 117 -20.062 -22.995   0.042
  893   HG23  THR 117          HG23      THR 117 -21.644 -22.280   0.351
  894    H    ARG 118           H        ARG 118 -21.442 -18.621  -1.268
  895    HA   ARG 118           HA       ARG 118 -19.486 -17.163  -2.874
  896    HB2  ARG 118           HB3      ARG 118 -22.484 -16.898  -3.190
  897    HB3  ARG 118           HB2      ARG 118 -21.302 -15.821  -3.916
  898    HG2  ARG 118           HG3      ARG 118 -20.378 -17.738  -5.168
  899    HG3  ARG 118           HG2      ARG 118 -21.644 -18.757  -4.488
  900    HD2  ARG 118           HD3      ARG 118 -22.043 -16.348  -6.262
  901    HD3  ARG 118           HD2      ARG 118 -22.253 -18.036  -6.721
  902    HE   ARG 118           HE       ARG 118 -23.900 -17.402  -4.508
  903   HH11  ARG 118          HH11      ARG 118 -23.620 -16.923  -7.958
  904   HH12  ARG 118          HH12      ARG 118 -25.326 -16.736  -8.204
  905   HH21  ARG 118          HH21      ARG 118 -26.149 -17.157  -4.817
  906   HH22  ARG 118          HH22      ARG 118 -26.767 -16.870  -6.413
  907    H1   SER   1           H1       SER   1 -32.962  -8.431  -8.577
  908    H2   SER   1           H2       SER   1 -32.982  -6.744  -8.492
  909    H3   SER   1           H3       SER   1 -32.653  -7.659  -7.108
  910    HA   SER   1           HA       SER   1 -30.968  -7.548  -9.530
  911    HB2  SER   1           HB3      SER   1 -30.972  -5.452  -8.159
  912    HB3  SER   1           HB2      SER   1 -30.450  -6.405  -6.772
  913    HG   SER   1           HG       SER   1 -28.849  -5.250  -8.293
  914    H    SER   2           H        SER   2 -28.822  -8.539  -9.107
  915    HA   SER   2           HA       SER   2 -28.833 -10.563  -6.999
  916    HB2  SER   2           HB3      SER   2 -27.968 -12.240  -8.736
  917    HB3  SER   2           HB2      SER   2 -29.688 -11.855  -8.792
  918    HG   SER   2           HG       SER   2 -28.066 -10.224 -10.332
  919    H    THR   3           H        THR   3 -27.432  -8.180  -7.075
  920    HA   THR   3           HA       THR   3 -24.741  -8.749  -8.022
  921    HB   THR   3           HB       THR   3 -24.313  -6.406  -7.021
  922    HG1  THR   3           HG1      THR   3 -27.048  -5.939  -7.364
  923   HG21  THR   3          HG21      THR   3 -25.218  -5.312  -9.013
  924   HG22  THR   3          HG22      THR   3 -26.224  -6.721  -9.339
  925   HG23  THR   3          HG23      THR   3 -24.468  -6.855  -9.424
  926    H    HIS   4           H        HIS   4 -23.667 -10.104  -6.749
  927    HA   HIS   4           HA       HIS   4 -24.039 -10.203  -3.907
  928    HB2  HIS   4           HB3      HIS   4 -23.510 -12.212  -5.285
  929    HB3  HIS   4           HB2      HIS   4 -21.927 -11.530  -5.623
  930    HD1  HIS   4           HD1      HIS   4 -23.964 -12.547  -2.574
  931    HD2  HIS   4           HD2      HIS   4 -20.025 -12.349  -3.883
  932    HE1  HIS   4           HE1      HIS   4 -22.590 -13.556  -0.731
  933    HE2  HIS   4           HE2      HIS   4 -20.256 -13.675  -1.672
  934    HA   PRO   5           HA       PRO   5 -21.092  -7.004  -2.979
  935    HB2  PRO   5           HB3      PRO   5 -20.748  -7.567  -0.331
  936    HB3  PRO   5           HB2      PRO   5 -22.156  -6.712  -0.968
  937    HG2  PRO   5           HG3      PRO   5 -21.870  -9.593  -0.220
  938    HG3  PRO   5           HG2      PRO   5 -23.225  -8.490   0.081
  939    HD2  PRO   5           HD3      PRO   5 -23.253 -10.317  -1.914
  940    HD3  PRO   5           HD2      PRO   5 -24.065  -8.743  -2.052
  941    H    VAL   6           H        VAL   6 -19.304  -7.641  -4.121
  942    HA   VAL   6           HA       VAL   6 -17.643  -9.838  -3.415
  943    HB   VAL   6           HB       VAL   6 -16.856  -7.430  -5.063
  944   HG11  VAL   6          HG11      VAL   6 -15.309  -8.970  -6.152
  945   HG12  VAL   6          HG12      VAL   6 -15.845 -10.270  -5.086
  946   HG13  VAL   6          HG13      VAL   6 -14.999  -8.873  -4.418
  947   HG21  VAL   6          HG21      VAL   6 -17.597  -8.698  -7.022
  948   HG22  VAL   6          HG22      VAL   6 -18.936  -8.348  -5.929
  949   HG23  VAL   6          HG23      VAL   6 -18.223  -9.960  -5.963
  950    H    PHE   7           H        PHE   7 -18.058  -6.739  -2.151
  951    HA   PHE   7           HA       PHE   7 -15.562  -6.052  -1.154
  952    HB2  PHE   7           HB3      PHE   7 -17.534  -4.592  -0.978
  953    HB3  PHE   7           HB2      PHE   7 -18.267  -5.711   0.163
  954    HD1  PHE   7           HD1      PHE   7 -15.431  -3.385  -0.312
  955    HD2  PHE   7           HD2      PHE   7 -17.793  -5.592   2.454
  956    HE1  PHE   7           HE1      PHE   7 -14.381  -2.169   1.547
  957    HE2  PHE   7           HE2      PHE   7 -16.746  -4.381   4.321
  958    HZ   PHE   7           HZ       PHE   7 -15.037  -2.667   3.871
  959    H    HIS   8           H        HIS   8 -17.973  -8.292   0.144
  960    HA   HIS   8           HA       HIS   8 -16.514  -8.866   2.530
  961    HB2  HIS   8           HB3      HIS   8 -18.999  -9.188   2.238
  962    HB3  HIS   8           HB2      HIS   8 -18.642 -10.579   1.221
  963    HD1  HIS   8           HD1      HIS   8 -18.621  -9.428   4.774
  964    HD2  HIS   8           HD2      HIS   8 -17.797 -12.877   2.609
  965    HE1  HIS   8           HE1      HIS   8 -18.428 -11.266   6.477
  966    HE2  HIS   8           HE2      HIS   8 -18.110 -13.370   5.127
  967    H    MET   9           H        MET   9 -16.472 -10.052  -0.715
  968    HA   MET   9           HA       MET   9 -15.140 -12.531  -0.130
  969    HB2  MET   9           HB3      MET   9 -15.440 -11.053  -2.755
  970    HB3  MET   9           HB2      MET   9 -14.897 -12.713  -2.574
  971    HG2  MET   9           HG3      MET   9 -17.044 -13.407  -1.796
  972    HG3  MET   9           HG2      MET   9 -17.603 -11.743  -1.687
  973    HE1  MET   9           HE1      MET   9 -16.497 -14.628  -4.138
  974    HE2  MET   9           HE2      MET   9 -15.416 -13.294  -4.536
  975    HE3  MET   9           HE3      MET   9 -16.639 -13.813  -5.696
  976    H    GLY  10           H        GLY  10 -14.233  -9.259  -0.821
  977    HA2  GLY  10           HA3      GLY  10 -11.485  -9.865  -1.442
  978    HA3  GLY  10           HA2      GLY  10 -12.172  -8.270  -1.197
  979    H    GLU  11           H        GLU  11 -13.129 -10.059   1.365
  980    HA   GLU  11           HA       GLU  11 -11.054  -8.938   3.071
  981    HB2  GLU  11           HB3      GLU  11 -13.678 -10.309   3.689
  982    HB3  GLU  11           HB2      GLU  11 -12.549  -9.755   4.927
  983    HG2  GLU  11           HG3      GLU  11 -13.882  -7.995   2.867
  984    HG3  GLU  11           HG2      GLU  11 -14.383  -8.166   4.551
  985    H    PHE  12           H        PHE  12 -11.481 -11.753   1.402
  986    HA   PHE  12           HA       PHE  12 -10.269 -13.468   3.426
  987    HB2  PHE  12           HB3      PHE  12 -11.228 -14.068   0.619
  988    HB3  PHE  12           HB2      PHE  12 -10.497 -15.258   1.695
  989    HD1  PHE  12           HD1      PHE  12 -13.512 -13.573   0.746
  990    HD2  PHE  12           HD2      PHE  12 -11.651 -15.778   3.874
  991    HE1  PHE  12           HE1      PHE  12 -15.719 -14.051   1.718
  992    HE2  PHE  12           HE2      PHE  12 -13.856 -16.263   4.849
  993    HZ   PHE  12           HZ       PHE  12 -15.895 -15.399   3.772
  994    H    SER  13           H        SER  13  -8.341 -12.185   3.487
  995    HA   SER  13           HA       SER  13  -6.648 -12.046   1.159
  996    HB2  SER  13           HB3      SER  13  -5.898 -11.391   4.012
  997    HB3  SER  13           HB2      SER  13  -5.204 -10.731   2.534
  998    HG   SER  13           HG       SER  13  -7.312  -9.800   2.133
  999    H    VAL  14           H        VAL  14  -4.652 -13.121   0.888
 1000    HA   VAL  14           HA       VAL  14  -4.357 -15.724   1.863
 1001    HB   VAL  14           HB       VAL  14  -1.985 -15.585   1.070
 1002   HG11  VAL  14          HG11      VAL  14  -4.103 -14.572  -0.820
 1003   HG12  VAL  14          HG12      VAL  14  -3.732 -16.256  -0.457
 1004   HG13  VAL  14          HG13      VAL  14  -2.552 -15.257  -1.304
 1005   HG21  VAL  14          HG21      VAL  14  -1.242 -13.582  -0.118
 1006   HG22  VAL  14          HG22      VAL  14  -1.549 -13.236   1.584
 1007   HG23  VAL  14          HG23      VAL  14  -2.718 -12.743   0.358
 1008    H    CYS  15           H        CYS  15  -3.066 -12.680   3.065
 1009    HA   CYS  15           HA       CYS  15  -2.227 -14.093   5.500
 1010    HB2  CYS  15           HB3      CYS  15  -0.274 -13.221   4.256
 1011    HB3  CYS  15           HB2      CYS  15  -0.972 -11.600   4.319
 1012    H    ASP  16           H        ASP  16  -2.518 -12.892   7.484
 1013    HA   ASP  16           HA       ASP  16  -4.984 -11.349   7.325
 1014    HB2  ASP  16           HB3      ASP  16  -4.705 -13.270   8.949
 1015    HB3  ASP  16           HB2      ASP  16  -3.530 -12.280   9.814
 1016    H    SER  17           H        SER  17  -4.886  -9.242   7.174
 1017    HA   SER  17           HA       SER  17  -2.536  -7.825   8.230
 1018    HB2  SER  17           HB3      SER  17  -4.586  -6.916   6.186
 1019    HB3  SER  17           HB2      SER  17  -3.117  -6.047   6.643
 1020    HG   SER  17           HG       SER  17  -2.968  -8.689   5.675
 1021    H    VAL  18           H        VAL  18  -2.838  -5.851   9.396
 1022    HA   VAL  18           HA       VAL  18  -5.590  -5.443  10.368
 1023    HB   VAL  18           HB       VAL  18  -4.296  -6.278  12.202
 1024   HG11  VAL  18          HG11      VAL  18  -2.279  -5.181  13.029
 1025   HG12  VAL  18          HG12      VAL  18  -2.316  -4.080  11.652
 1026   HG13  VAL  18          HG13      VAL  18  -2.064  -5.808  11.396
 1027   HG21  VAL  18          HG21      VAL  18  -5.877  -4.534  12.752
 1028   HG22  VAL  18          HG22      VAL  18  -4.656  -3.300  12.446
 1029   HG23  VAL  18          HG23      VAL  18  -4.461  -4.419  13.795
 1030    H    SER  19           H        SER  19  -6.414  -3.651   9.549
 1031    HA   SER  19           HA       SER  19  -4.634  -1.466   8.764
 1032    HB2  SER  19           HB3      SER  19  -7.578  -1.894   8.165
 1033    HB3  SER  19           HB2      SER  19  -6.571  -0.602   7.509
 1034    HG   SER  19           HG       SER  19  -5.330  -2.156   6.445
 1035    H    VAL  20           H        VAL  20  -4.333   0.143  10.140
 1036    HA   VAL  20           HA       VAL  20  -6.494   0.791  12.040
 1037    HB   VAL  20           HB       VAL  20  -3.519   1.106  12.463
 1038   HG11  VAL  20          HG11      VAL  20  -5.830   1.577  14.329
 1039   HG12  VAL  20          HG12      VAL  20  -4.758   2.799  13.643
 1040   HG13  VAL  20          HG13      VAL  20  -4.127   1.613  14.786
 1041   HG21  VAL  20          HG21      VAL  20  -4.135  -1.233  12.479
 1042   HG22  VAL  20          HG22      VAL  20  -5.437  -0.905  13.624
 1043   HG23  VAL  20          HG23      VAL  20  -3.756  -0.694  14.116
 1044    H    TRP  21           H        TRP  21  -7.131   2.877  12.166
 1045    HA   TRP  21           HA       TRP  21  -5.680   4.840  10.543
 1046    HB2  TRP  21           HB3      TRP  21  -8.512   4.813  11.604
 1047    HB3  TRP  21           HB2      TRP  21  -7.775   6.239  10.878
 1048    HD1  TRP  21           HD1      TRP  21  -9.050   2.734   9.966
 1049    HE1  TRP  21           HE1      TRP  21  -9.376   2.612   7.417
 1050    HE3  TRP  21           HE3      TRP  21  -7.002   7.244   8.668
 1051    HZ2  TRP  21           HZ2      TRP  21  -8.842   4.216   5.156
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.953   7.872   6.288
 1053    HH2  TRP  21           HH2      TRP  21  -7.852   6.391   4.571
 1054    H    VAL  22           H        VAL  22  -4.088   5.533  11.803
 1055    HA   VAL  22           HA       VAL  22  -4.391   5.865  14.640
 1056    HB   VAL  22           HB       VAL  22  -2.097   6.708  12.861
 1057   HG11  VAL  22          HG11      VAL  22  -0.762   6.559  14.919
 1058   HG12  VAL  22          HG12      VAL  22  -2.234   6.231  15.833
 1059   HG13  VAL  22          HG13      VAL  22  -2.024   7.785  15.025
 1060   HG21  VAL  22          HG21      VAL  22  -2.545   4.329  12.610
 1061   HG22  VAL  22          HG22      VAL  22  -2.511   4.126  14.360
 1062   HG23  VAL  22          HG23      VAL  22  -1.045   4.591  13.498
 1063    H    GLY  23           H        GLY  23  -5.137   7.631  15.623
 1064    HA2  GLY  23           HA3      GLY  23  -5.342  10.117  14.084
 1065    HA3  GLY  23           HA2      GLY  23  -6.178   9.762  15.596
 1066    H    ASP  24           H        ASP  24  -3.309   8.670  16.323
 1067    HA   ASP  24           HA       ASP  24  -2.070  11.247  16.937
 1068    HB2  ASP  24           HB3      ASP  24  -3.431  10.706  18.897
 1069    HB3  ASP  24           HB2      ASP  24  -2.694   9.107  18.990
 1070    H    LYS  25           H        LYS  25  -0.651  10.470  15.231
 1071    HA   LYS  25           HA       LYS  25   1.217   8.380  16.079
 1072    HB2  LYS  25           HB3      LYS  25   0.304   8.418  13.731
 1073    HB3  LYS  25           HB2      LYS  25   1.143   9.939  13.483
 1074    HG2  LYS  25           HG3      LYS  25   3.276   8.871  13.783
 1075    HG3  LYS  25           HG2      LYS  25   2.491   7.343  14.186
 1076    HD2  LYS  25           HD3      LYS  25   1.491   7.294  11.934
 1077    HD3  LYS  25           HD2      LYS  25   2.339   8.790  11.543
 1078    HE2  LYS  25           HE3      LYS  25   3.579   6.935  10.633
 1079    HE3  LYS  25           HE2      LYS  25   4.489   7.628  11.976
 1080    HZ1  LYS  25           HZ1      LYS  25   4.576   5.296  12.204
 1081    HZ2  LYS  25           HZ2      LYS  25   2.911   5.113  11.960
 1082    HZ3  LYS  25           HZ3      LYS  25   3.488   5.829  13.384
 1083    H    THR  26           H        THR  26   3.343   8.875  16.655
 1084    HA   THR  26           HA       THR  26   3.814  11.751  17.017
 1085    HB   THR  26           HB       THR  26   3.502  10.524  19.124
 1086    HG1  THR  26           HG1      THR  26   6.005  11.708  18.525
 1087   HG21  THR  26          HG21      THR  26   4.378   8.348  18.529
 1088   HG22  THR  26          HG22      THR  26   5.280   8.985  19.902
 1089   HG23  THR  26          HG23      THR  26   5.987   9.026  18.286
 1090    H    THR  27           H        THR  27   5.236   8.818  15.747
 1091    HA   THR  27           HA       THR  27   7.510  10.434  14.847
 1092    HB   THR  27           HB       THR  27   8.941   8.317  15.191
 1093    HG1  THR  27           HG1      THR  27   7.605   7.632  17.448
 1094   HG21  THR  27          HG21      THR  27   8.027   9.971  17.542
 1095   HG22  THR  27          HG22      THR  27   9.325  10.371  16.418
 1096   HG23  THR  27          HG23      THR  27   9.489   8.988  17.501
 1097    H    ALA  28           H        ALA  28   8.274  10.003  12.845
 1098    HA   ALA  28           HA       ALA  28   7.542   7.527  11.498
 1099    HB1  ALA  28           HB1      ALA  28   6.571   8.599   9.574
 1100    HB2  ALA  28           HB2      ALA  28   6.839  10.193  10.280
 1101    HB3  ALA  28           HB3      ALA  28   5.677   9.089  11.014
 1102    H    THR  29           H        THR  29   8.605   7.515   9.246
 1103    HA   THR  29           HA       THR  29  11.159   8.971   9.396
 1104    HB   THR  29           HB       THR  29  10.737   6.310   8.032
 1105    HG1  THR  29           HG1      THR  29  10.948   6.862  10.664
 1106   HG21  THR  29          HG21      THR  29  13.246   7.775   8.865
 1107   HG22  THR  29          HG22      THR  29  12.629   7.653   7.216
 1108   HG23  THR  29          HG23      THR  29  13.178   6.205   8.061
 1109    H    ASP  30           H        ASP  30  11.424  10.422   7.870
 1110    HA   ASP  30           HA       ASP  30   9.666  10.627   5.613
 1111    HB2  ASP  30           HB3      ASP  30  10.584  12.631   6.741
 1112    HB3  ASP  30           HB2      ASP  30  12.213  12.148   6.267
 1113    H    ILE  31           H        ILE  31  10.527  10.842   3.376
 1114    HA   ILE  31           HA       ILE  31  11.807   8.465   2.575
 1115    HB   ILE  31           HB       ILE  31  10.181   9.665   1.170
 1116   HG12  ILE  31          HG13      ILE  31  12.896   9.448  -0.156
 1117   HG13  ILE  31          HG12      ILE  31  11.798   8.101   0.130
 1118   HG21  ILE  31          HG21      ILE  31  10.825  11.947   1.679
 1119   HG22  ILE  31          HG22      ILE  31  10.847  11.677  -0.063
 1120   HG23  ILE  31          HG23      ILE  31  12.361  11.723   0.842
 1121   HD11  ILE  31          HD11      ILE  31  11.277  10.481  -1.632
 1122   HD12  ILE  31          HD12      ILE  31  10.143   9.167  -1.326
 1123   HD13  ILE  31          HD13      ILE  31  11.661   8.843  -2.162
 1124    H    LYS  32           H        LYS  32  13.046  11.572   3.462
 1125    HA   LYS  32           HA       LYS  32  15.605  11.289   2.202
 1126    HB2  LYS  32           HB3      LYS  32  14.779  12.994   4.555
 1127    HB3  LYS  32           HB2      LYS  32  16.269  13.167   3.636
 1128    HG2  LYS  32           HG3      LYS  32  15.035  13.825   1.678
 1129    HG3  LYS  32           HG2      LYS  32  13.505  13.503   2.493
 1130    HD2  LYS  32           HD3      LYS  32  14.105  15.225   4.168
 1131    HD3  LYS  32           HD2      LYS  32  15.531  15.617   3.207
 1132    HE2  LYS  32           HE3      LYS  32  12.666  15.802   2.297
 1133    HE3  LYS  32           HE2      LYS  32  13.687  17.161   2.761
 1134    HZ1  LYS  32           HZ1      LYS  32  13.571  16.895   0.359
 1135    HZ2  LYS  32           HZ2      LYS  32  14.192  15.329   0.481
 1136    HZ3  LYS  32           HZ3      LYS  32  15.149  16.650   0.916
 1137    H    GLY  33           H        GLY  33  14.133   9.814   4.851
 1138    HA2  GLY  33           HA3      GLY  33  15.118   8.068   6.104
 1139    HA3  GLY  33           HA2      GLY  33  16.707   8.738   5.746
 1140    H    LYS  34           H        LYS  34  14.307  10.954   6.698
 1141    HA   LYS  34           HA       LYS  34  15.749  11.471   9.170
 1142    HB2  LYS  34           HB3      LYS  34  13.570  13.003   7.745
 1143    HB3  LYS  34           HB2      LYS  34  14.343  13.533   9.229
 1144    HG2  LYS  34           HG3      LYS  34  15.780  13.068   6.630
 1145    HG3  LYS  34           HG2      LYS  34  15.215  14.634   7.202
 1146    HD2  LYS  34           HD3      LYS  34  16.613  14.369   9.215
 1147    HD3  LYS  34           HD2      LYS  34  17.231  12.853   8.559
 1148    HE2  LYS  34           HE3      LYS  34  18.205  14.011   6.685
 1149    HE3  LYS  34           HE2      LYS  34  17.462  15.523   7.193
 1150    HZ1  LYS  34           HZ1      LYS  34  19.800  15.403   7.812
 1151    HZ2  LYS  34           HZ2      LYS  34  19.503  14.019   8.731
 1152    HZ3  LYS  34           HZ3      LYS  34  18.815  15.494   9.180
 1153    H    GLU  35           H        GLU  35  14.967  11.067  11.147
 1154    HA   GLU  35           HA       GLU  35  12.346   9.863  11.441
 1155    HB2  GLU  35           HB3      GLU  35  14.219   8.990  12.766
 1156    HB3  GLU  35           HB2      GLU  35  14.460  10.572  13.489
 1157    HG2  GLU  35           HG3      GLU  35  12.242  10.430  14.517
 1158    HG3  GLU  35           HG2      GLU  35  12.027   8.831  13.813
 1159    H    VAL  36           H        VAL  36  10.602  11.092  11.634
 1160    HA   VAL  36           HA       VAL  36  10.978  13.859  12.551
 1161    HB   VAL  36           HB       VAL  36   9.139  14.518  11.086
 1162   HG11  VAL  36          HG11      VAL  36  11.234  12.933   9.610
 1163   HG12  VAL  36          HG12      VAL  36  11.431  14.574  10.224
 1164   HG13  VAL  36          HG13      VAL  36  10.260  14.245   8.947
 1165   HG21  VAL  36          HG21      VAL  36   9.143  11.651  10.151
 1166   HG22  VAL  36          HG22      VAL  36   8.196  12.968   9.459
 1167   HG23  VAL  36          HG23      VAL  36   7.878  12.425  11.106
 1168    H    THR  37           H        THR  37   9.405  14.811  13.798
 1169    HA   THR  37           HA       THR  37   7.761  13.008  15.355
 1170    HB   THR  37           HB       THR  37   8.011  16.012  15.560
 1171    HG1  THR  37           HG1      THR  37   9.643  13.927  16.428
 1172   HG21  THR  37          HG21      THR  37   6.031  15.089  16.666
 1173   HG22  THR  37          HG22      THR  37   7.195  15.685  17.847
 1174   HG23  THR  37          HG23      THR  37   7.048  13.952  17.549
 1175    H    VAL  38           H        VAL  38   5.796  12.508  14.699
 1176    HA   VAL  38           HA       VAL  38   4.520  14.027  12.606
 1177    HB   VAL  38           HB       VAL  38   3.513  11.577  14.066
 1178   HG11  VAL  38          HG11      VAL  38   2.067  11.295  12.098
 1179   HG12  VAL  38          HG12      VAL  38   2.640  12.841  11.474
 1180   HG13  VAL  38          HG13      VAL  38   1.719  12.783  12.978
 1181   HG21  VAL  38          HG21      VAL  38   5.629  11.133  12.943
 1182   HG22  VAL  38          HG22      VAL  38   4.980  11.794  11.443
 1183   HG23  VAL  38          HG23      VAL  38   4.297  10.317  12.124
 1184    H    LEU  39           H        LEU  39   2.698  15.252  12.793
 1185    HA   LEU  39           HA       LEU  39   1.911  15.967  15.515
 1186    HB2  LEU  39           HB3      LEU  39   1.200  17.304  12.895
 1187    HB3  LEU  39           HB2      LEU  39   0.913  17.942  14.506
 1188    HG   LEU  39           HG       LEU  39   3.622  17.501  13.253
 1189   HD11  LEU  39          HD11      LEU  39   3.744  19.941  13.212
 1190   HD12  LEU  39          HD12      LEU  39   2.083  20.027  13.804
 1191   HD13  LEU  39          HD13      LEU  39   2.418  19.335  12.218
 1192   HD21  LEU  39          HD21      LEU  39   3.680  17.209  15.668
 1193   HD22  LEU  39          HD22      LEU  39   2.860  18.754  15.882
 1194   HD23  LEU  39          HD23      LEU  39   4.483  18.705  15.193
 1195    H    ALA  40           H        ALA  40   0.129  15.127  16.334
 1196    HA   ALA  40           HA       ALA  40  -1.674  13.504  14.885
 1197    HB1  ALA  40           HB1      ALA  40  -1.288  13.257  17.301
 1198    HB2  ALA  40           HB2      ALA  40  -2.998  13.478  16.933
 1199    HB3  ALA  40           HB3      ALA  40  -2.053  14.822  17.577
 1200    H    GLU  41           H        GLU  41  -1.726  16.829  15.988
 1201    HA   GLU  41           HA       GLU  41  -4.144  17.323  14.392
 1202    HB2  GLU  41           HB3      GLU  41  -2.807  19.023  16.514
 1203    HB3  GLU  41           HB2      GLU  41  -4.270  19.455  15.644
 1204    HG2  GLU  41           HG3      GLU  41  -4.091  16.965  17.300
 1205    HG3  GLU  41           HG2      GLU  41  -4.517  18.527  17.999
 1206    H    VAL  42           H        VAL  42  -3.700  18.050  12.391
 1207    HA   VAL  42           HA       VAL  42  -1.109  19.285  11.907
 1208    HB   VAL  42           HB       VAL  42  -1.582  19.084   9.522
 1209   HG11  VAL  42          HG11      VAL  42  -1.623  16.652   9.351
 1210   HG12  VAL  42          HG12      VAL  42  -2.176  16.542  11.022
 1211   HG13  VAL  42          HG13      VAL  42  -0.576  17.192  10.664
 1212   HG21  VAL  42          HG21      VAL  42  -3.583  17.957   8.691
 1213   HG22  VAL  42          HG22      VAL  42  -3.993  19.451   9.536
 1214   HG23  VAL  42          HG23      VAL  42  -4.234  17.893  10.328
 1215    H    ASN  43           H        ASN  43  -0.846  21.373  11.861
 1216    HA   ASN  43           HA       ASN  43  -3.189  23.091  11.734
 1217    HB2  ASN  43           HB3      ASN  43  -1.555  24.920  12.355
 1218    HB3  ASN  43           HB2      ASN  43  -1.749  23.651  13.557
 1219   HD21  ASN  43          HD21      ASN  43  -0.041  22.257  13.973
 1220   HD22  ASN  43          HD22      ASN  43   1.572  22.595  13.449
 1221    H    ILE  44           H        ILE  44  -3.832  23.369   9.710
 1222    HA   ILE  44           HA       ILE  44  -1.826  24.085   7.685
 1223    HB   ILE  44           HB       ILE  44  -4.768  23.620   7.186
 1224   HG12  ILE  44          HG13      ILE  44  -2.530  21.581   7.099
 1225   HG13  ILE  44          HG12      ILE  44  -3.839  21.616   8.275
 1226   HG21  ILE  44          HG21      ILE  44  -4.042  23.182   4.903
 1227   HG22  ILE  44          HG22      ILE  44  -2.359  23.409   5.378
 1228   HG23  ILE  44          HG23      ILE  44  -3.481  24.769   5.433
 1229   HD11  ILE  44          HD11      ILE  44  -4.278  19.939   6.602
 1230   HD12  ILE  44          HD12      ILE  44  -4.101  21.132   5.316
 1231   HD13  ILE  44          HD13      ILE  44  -5.450  21.250   6.446
 1232    H    ASN  45           H        ASN  45  -1.760  26.033   9.227
 1233    HA   ASN  45           HA       ASN  45  -1.955  28.270   9.457
 1234    HB2  ASN  45           HB3      ASN  45  -3.450  28.006   6.849
 1235    HB3  ASN  45           HB2      ASN  45  -3.241  29.559   7.649
 1236   HD21  ASN  45          HD21      ASN  45  -0.829  27.004   7.643
 1237   HD22  ASN  45          HD22      ASN  45   0.315  27.834   6.648
 1238    H    ASN  46           H        ASN  46  -5.158  27.672   8.038
 1239    HA   ASN  46           HA       ASN  46  -6.299  28.908  10.446
 1240    HB2  ASN  46           HB3      ASN  46  -8.221  29.490   9.081
 1241    HB3  ASN  46           HB2      ASN  46  -6.747  30.042   8.295
 1242   HD21  ASN  46          HD21      ASN  46  -9.402  29.455   7.199
 1243   HD22  ASN  46          HD22      ASN  46  -9.148  28.282   5.955
 1244    H    SER  47           H        SER  47  -5.952  25.884   9.014
 1245    HA   SER  47           HA       SER  47  -8.357  24.911  10.406
 1246    HB2  SER  47           HB3      SER  47  -8.553  24.814   7.908
 1247    HB3  SER  47           HB2      SER  47  -7.167  23.725   7.885
 1248    HG   SER  47           HG       SER  47  -9.751  23.294   8.931
 1249    H    VAL  48           H        VAL  48  -7.790  23.803  12.126
 1250    HA   VAL  48           HA       VAL  48  -5.386  22.101  12.008
 1251    HB   VAL  48           HB       VAL  48  -6.712  23.173  14.505
 1252   HG11  VAL  48          HG11      VAL  48  -4.629  22.498  15.600
 1253   HG12  VAL  48          HG12      VAL  48  -4.038  21.852  14.070
 1254   HG13  VAL  48          HG13      VAL  48  -5.447  21.131  14.847
 1255   HG21  VAL  48          HG21      VAL  48  -4.879  24.773  14.664
 1256   HG22  VAL  48          HG22      VAL  48  -5.822  25.029  13.197
 1257   HG23  VAL  48          HG23      VAL  48  -4.257  24.226  13.111
 1258    H    PHE  49           H        PHE  49  -5.780  19.974  12.021
 1259    HA   PHE  49           HA       PHE  49  -7.877  18.803  13.575
 1260    HB2  PHE  49           HB3      PHE  49  -9.214  17.887  11.755
 1261    HB3  PHE  49           HB2      PHE  49  -9.177  19.641  11.616
 1262    HD1  PHE  49           HD1      PHE  49  -7.754  20.704   9.856
 1263    HD2  PHE  49           HD2      PHE  49  -8.362  16.494  10.062
 1264    HE1  PHE  49           HE1      PHE  49  -6.991  20.476   7.528
 1265    HE2  PHE  49           HE2      PHE  49  -7.593  16.265   7.739
 1266    HZ   PHE  49           HZ       PHE  49  -6.905  18.257   6.470
 1267    H    ARG  50           H        ARG  50  -8.015  16.378  13.087
 1268    HA   ARG  50           HA       ARG  50  -5.334  15.432  12.359
 1269    HB2  ARG  50           HB3      ARG  50  -5.945  13.341  13.586
 1270    HB3  ARG  50           HB2      ARG  50  -5.857  14.772  14.594
 1271    HG2  ARG  50           HG3      ARG  50  -8.330  14.916  14.507
 1272    HG3  ARG  50           HG2      ARG  50  -8.343  13.391  13.613
 1273    HD2  ARG  50           HD3      ARG  50  -8.721  13.104  16.048
 1274    HD3  ARG  50           HD2      ARG  50  -7.299  12.247  15.452
 1275    HE   ARG  50           HE       ARG  50  -6.728  14.887  16.466
 1276   HH11  ARG  50          HH11      ARG  50  -7.136  11.511  17.336
 1277   HH12  ARG  50          HH12      ARG  50  -6.112  11.623  18.733
 1278   HH21  ARG  50          HH21      ARG  50  -5.384  15.020  18.291
 1279   HH22  ARG  50          HH22      ARG  50  -5.110  13.616  19.270
 1280    H    GLN  51           H        GLN  51  -5.115  14.555  10.461
 1281    HA   GLN  51           HA       GLN  51  -7.452  13.920   8.885
 1282    HB2  GLN  51           HB3      GLN  51  -5.833  13.640   7.036
 1283    HB3  GLN  51           HB2      GLN  51  -5.659  15.188   7.851
 1284    HG2  GLN  51           HG3      GLN  51  -3.777  14.192   9.162
 1285    HG3  GLN  51           HG2      GLN  51  -3.893  12.767   8.129
 1286   HE21  GLN  51          HE21      GLN  51  -1.868  13.003   7.265
 1287   HE22  GLN  51          HE22      GLN  51  -1.449  14.275   6.165
 1288    H    TYR  52           H        TYR  52  -5.506  12.256  10.980
 1289    HA   TYR  52           HA       TYR  52  -5.279  10.091  11.577
 1290    HB2  TYR  52           HB3      TYR  52  -7.393   9.623   9.463
 1291    HB3  TYR  52           HB2      TYR  52  -6.756   8.358  10.509
 1292    HD1  TYR  52           HD1      TYR  52  -7.232   8.411  12.941
 1293    HD2  TYR  52           HD2      TYR  52  -8.978  11.227  10.270
 1294    HE1  TYR  52           HE1      TYR  52  -8.902   8.987  14.646
 1295    HE2  TYR  52           HE2      TYR  52 -10.651  11.813  11.975
 1296    HH   TYR  52           HH       TYR  52 -10.385  10.815  15.237
 1297    H    PHE  53           H        PHE  53  -4.105   8.239  11.023
 1298    HA   PHE  53           HA       PHE  53  -2.861   8.324   8.354
 1299    HB2  PHE  53           HB3      PHE  53  -1.497   7.551  10.950
 1300    HB3  PHE  53           HB2      PHE  53  -0.738   7.693   9.364
 1301    HD1  PHE  53           HD1      PHE  53  -0.536   9.937   8.306
 1302    HD2  PHE  53           HD2      PHE  53  -1.811   9.434  12.333
 1303    HE1  PHE  53           HE1      PHE  53  -0.064  12.312   8.746
 1304    HE2  PHE  53           HE2      PHE  53  -1.339  11.805  12.786
 1305    HZ   PHE  53           HZ       PHE  53  -0.469  13.248  10.992
 1306    H    PHE  54           H        PHE  54  -3.234   6.533   7.230
 1307    HA   PHE  54           HA       PHE  54  -4.370   4.236   8.559
 1308    HB2  PHE  54           HB3      PHE  54  -4.644   3.363   6.208
 1309    HB3  PHE  54           HB2      PHE  54  -5.463   4.883   6.533
 1310    HD1  PHE  54           HD1      PHE  54  -2.911   3.207   4.583
 1311    HD2  PHE  54           HD2      PHE  54  -4.571   6.991   5.603
 1312    HE1  PHE  54           HE1      PHE  54  -1.804   4.214   2.633
 1313    HE2  PHE  54           HE2      PHE  54  -3.464   8.005   3.655
 1314    HZ   PHE  54           HZ       PHE  54  -2.078   6.617   2.167
 1315    H    GLU  55           H        GLU  55  -3.160   2.700   9.370
 1316    HA   GLU  55           HA       GLU  55  -0.707   1.933   7.927
 1317    HB2  GLU  55           HB3      GLU  55  -1.145   1.726  10.919
 1318    HB3  GLU  55           HB2      GLU  55   0.328   1.333  10.046
 1319    HG2  GLU  55           HG3      GLU  55   0.420   3.769   9.358
 1320    HG3  GLU  55           HG2      GLU  55  -0.866   4.050  10.536
 1321    H    THR  56           H        THR  56  -1.121   0.081   6.932
 1322    HA   THR  56           HA       THR  56  -2.777  -1.928   8.283
 1323    HB   THR  56           HB       THR  56  -1.746  -1.950   5.436
 1324    HG1  THR  56           HG1      THR  56  -3.345  -0.612   5.105
 1325   HG21  THR  56          HG21      THR  56  -3.820  -3.660   6.822
 1326   HG22  THR  56          HG22      THR  56  -2.212  -4.184   6.320
 1327   HG23  THR  56          HG23      THR  56  -3.409  -3.729   5.108
 1328    H    LYS  57           H        LYS  57  -1.608  -3.090   9.637
 1329    HA   LYS  57           HA       LYS  57   1.203  -3.652   8.975
 1330    HB2  LYS  57           HB3      LYS  57  -0.205  -3.735  11.652
 1331    HB3  LYS  57           HB2      LYS  57   1.519  -3.952  11.384
 1332    HG2  LYS  57           HG3      LYS  57   1.672  -1.646  10.568
 1333    HG3  LYS  57           HG2      LYS  57  -0.052  -1.432  10.871
 1334    HD2  LYS  57           HD3      LYS  57   1.152  -0.504  12.718
 1335    HD3  LYS  57           HD2      LYS  57   0.380  -1.991  13.262
 1336    HE2  LYS  57           HE3      LYS  57   2.526  -3.173  12.877
 1337    HE3  LYS  57           HE2      LYS  57   3.265  -1.621  12.495
 1338    HZ1  LYS  57           HZ1      LYS  57   2.006  -2.330  15.084
 1339    HZ2  LYS  57           HZ2      LYS  57   2.746  -0.856  14.714
 1340    HZ3  LYS  57           HZ3      LYS  57   3.669  -2.271  14.784
 1341    H    CYS  58           H        CYS  58   2.027  -5.694  10.022
 1342    HA   CYS  58           HA       CYS  58   0.227  -7.910   9.403
 1343    HB2  CYS  58           HB3      CYS  58   3.199  -7.917  10.010
 1344    HB3  CYS  58           HB2      CYS  58   2.258  -9.311   9.503
 1345    H    ARG  59           H        ARG  59  -1.033  -8.409  11.127
 1346    HA   ARG  59           HA       ARG  59   0.203  -8.513  13.770
 1347    HB2  ARG  59           HB3      ARG  59  -2.088  -9.016  14.595
 1348    HB3  ARG  59           HB2      ARG  59  -1.965  -7.482  13.752
 1349    HG2  ARG  59           HG3      ARG  59  -2.986  -8.431  11.787
 1350    HG3  ARG  59           HG2      ARG  59  -3.030 -10.023  12.547
 1351    HD2  ARG  59           HD3      ARG  59  -4.592  -9.276  14.189
 1352    HD3  ARG  59           HD2      ARG  59  -4.398  -7.598  13.691
 1353    HE   ARG  59           HE       ARG  59  -5.432  -9.499  11.720
 1354   HH11  ARG  59          HH11      ARG  59  -6.086  -6.912  14.008
 1355   HH12  ARG  59          HH12      ARG  59  -7.612  -6.499  13.294
 1356   HH21  ARG  59          HH21      ARG  59  -7.449  -8.951  10.792
 1357   HH22  ARG  59          HH22      ARG  59  -8.386  -7.656  11.470
 1358    H    ALA  60           H        ALA  60   0.299 -10.360  11.252
 1359    HA   ALA  60           HA       ALA  60   0.850 -12.728  12.804
 1360    HB1  ALA  60           HB1      ALA  60  -0.501 -14.215  11.407
 1361    HB2  ALA  60           HB2      ALA  60  -1.135 -12.826  10.525
 1362    HB3  ALA  60           HB3      ALA  60  -1.524 -13.038  12.232
 1363    H    SER  61           H        SER  61   2.846 -13.231  12.137
 1364    HA   SER  61           HA       SER  61   3.874 -12.335   9.627
 1365    HB2  SER  61           HB3      SER  61   5.889 -13.719  10.321
 1366    HB3  SER  61           HB2      SER  61   5.418 -12.441  11.442
 1367    HG   SER  61           HG       SER  61   5.290 -13.949  12.882
 1368    H    ASN  62           H        ASN  62   2.445 -15.226  10.842
 1369    HA   ASN  62           HA       ASN  62   2.168 -16.215   8.132
 1370    HB2  ASN  62           HB3      ASN  62   3.483 -17.796  10.344
 1371    HB3  ASN  62           HB2      ASN  62   2.671 -18.593   9.002
 1372   HD21  ASN  62          HD21      ASN  62   3.517 -18.330   6.896
 1373   HD22  ASN  62          HD22      ASN  62   5.172 -17.891   6.644
 1374    HA   PRO  63           HA       PRO  63  -1.867 -16.384  10.165
 1375    HB2  PRO  63           HB3      PRO  63  -3.210 -17.259   7.924
 1376    HB3  PRO  63           HB2      PRO  63  -2.855 -15.557   8.267
 1377    HG2  PRO  63           HG3      PRO  63  -1.394 -17.489   6.503
 1378    HG3  PRO  63           HG2      PRO  63  -1.796 -15.790   6.205
 1379    HD2  PRO  63           HD3      PRO  63   0.675 -16.515   6.957
 1380    HD3  PRO  63           HD2      PRO  63  -0.061 -15.005   7.559
 1381    H    VAL  64           H        VAL  64  -0.552 -18.898   8.071
 1382    HA   VAL  64           HA       VAL  64  -1.503 -20.919   9.969
 1383    HB   VAL  64           HB       VAL  64  -1.961 -22.472   8.076
 1384   HG11  VAL  64          HG11      VAL  64  -3.829 -21.348   9.104
 1385   HG12  VAL  64          HG12      VAL  64  -4.093 -21.447   7.364
 1386   HG13  VAL  64          HG13      VAL  64  -3.574 -19.929   8.089
 1387   HG21  VAL  64          HG21      VAL  64  -1.679 -20.009   6.365
 1388   HG22  VAL  64          HG22      VAL  64  -2.232 -21.593   5.821
 1389   HG23  VAL  64          HG23      VAL  64  -0.573 -21.380   6.384
 1390    H    GLU  65           H        GLU  65  -0.215 -22.933   9.825
 1391    HA   GLU  65           HA       GLU  65   2.560 -22.216   9.691
 1392    HB2  GLU  65           HB3      GLU  65   1.254 -24.868  10.299
 1393    HB3  GLU  65           HB2      GLU  65   2.962 -24.512  10.498
 1394    HG2  GLU  65           HG3      GLU  65   2.368 -22.765  12.131
 1395    HG3  GLU  65           HG2      GLU  65   0.676 -23.230  11.972
 1396    H    SER  66           H        SER  66   0.381 -23.385   7.438
 1397    HA   SER  66           HA       SER  66   2.358 -24.810   5.865
 1398    HB2  SER  66           HB3      SER  66  -0.457 -24.053   5.058
 1399    HB3  SER  66           HB2      SER  66   0.563 -25.304   4.349
 1400    HG   SER  66           HG       SER  66   0.273 -25.671   7.019
 1401    H    GLY  67           H        GLY  67   1.599 -21.616   6.396
 1402    HA2  GLY  67           HA3      GLY  67   3.181 -20.149   5.070
 1403    HA3  GLY  67           HA2      GLY  67   2.378 -20.830   3.659
 1404    H    CYS  68           H        CYS  68   0.960 -19.474   2.791
 1405    HA   CYS  68           HA       CYS  68  -0.530 -17.681   4.590
 1406    HB2  CYS  68           HB3      CYS  68   0.386 -17.169   1.749
 1407    HB3  CYS  68           HB2      CYS  68  -0.645 -16.083   2.686
 1408    H    ARG  69           H        ARG  69  -1.664 -20.033   4.329
 1409    HA   ARG  69           HA       ARG  69  -3.700 -20.968   3.973
 1410    HB2  ARG  69           HB3      ARG  69  -4.344 -18.223   2.884
 1411    HB3  ARG  69           HB2      ARG  69  -5.541 -19.487   3.147
 1412    HG2  ARG  69           HG3      ARG  69  -5.059 -19.458   5.537
 1413    HG3  ARG  69           HG2      ARG  69  -3.813 -18.237   5.274
 1414    HD2  ARG  69           HD3      ARG  69  -5.452 -16.643   4.523
 1415    HD3  ARG  69           HD2      ARG  69  -6.730 -17.862   4.580
 1416    HE   ARG  69           HE       ARG  69  -5.957 -17.884   7.106
 1417   HH11  ARG  69          HH11      ARG  69  -6.457 -15.125   4.999
 1418   HH12  ARG  69          HH12      ARG  69  -6.992 -14.087   6.285
 1419   HH21  ARG  69          HH21      ARG  69  -6.668 -16.510   8.794
 1420   HH22  ARG  69          HH22      ARG  69  -7.109 -14.870   8.439
 1421    H    GLY  70           H        GLY  70  -2.927 -22.487   2.487
 1422    HA2  GLY  70           HA3      GLY  70  -3.835 -23.511   0.475
 1423    HA3  GLY  70           HA2      GLY  70  -3.790 -21.925  -0.281
 1424    H    ILE  71           H        ILE  71  -1.117 -21.407   0.914
 1425    HA   ILE  71           HA       ILE  71   0.478 -22.143  -1.261
 1426    HB   ILE  71           HB       ILE  71   1.390 -21.390   1.520
 1427   HG12  ILE  71          HG13      ILE  71  -0.102 -19.695   0.542
 1428   HG13  ILE  71          HG12      ILE  71   1.550 -19.101   0.659
 1429   HG21  ILE  71          HG21      ILE  71   2.853 -21.298  -1.113
 1430   HG22  ILE  71          HG22      ILE  71   3.180 -22.390   0.233
 1431   HG23  ILE  71          HG23      ILE  71   3.456 -20.657   0.415
 1432   HD11  ILE  71          HD11      ILE  71   0.544 -18.434  -1.435
 1433   HD12  ILE  71          HD12      ILE  71   0.193 -20.116  -1.830
 1434   HD13  ILE  71          HD13      ILE  71   1.866 -19.565  -1.729
 1435    H    ASP  72           H        ASP  72   1.821 -23.822  -1.665
 1436    HA   ASP  72           HA       ASP  72   1.608 -26.167   0.008
 1437    HB2  ASP  72           HB3      ASP  72   1.512 -26.421  -2.426
 1438    HB3  ASP  72           HB2      ASP  72   3.125 -25.726  -2.575
 1439    H    SER  73           H        SER  73   2.933 -26.579   1.616
 1440    HA   SER  73           HA       SER  73   5.111 -24.838   2.200
 1441    HB2  SER  73           HB3      SER  73   4.441 -27.420   3.615
 1442    HB3  SER  73           HB2      SER  73   5.235 -25.991   4.281
 1443    HG   SER  73           HG       SER  73   3.101 -24.950   3.567
 1444    H    LYS  74           H        LYS  74   4.980 -27.528   0.220
 1445    HA   LYS  74           HA       LYS  74   7.654 -28.464   0.909
 1446    HB2  LYS  74           HB3      LYS  74   5.926 -30.141   0.471
 1447    HB3  LYS  74           HB2      LYS  74   5.661 -29.471  -1.130
 1448    HG2  LYS  74           HG3      LYS  74   7.779 -30.206  -1.887
 1449    HG3  LYS  74           HG2      LYS  74   8.300 -30.607  -0.251
 1450    HD2  LYS  74           HD3      LYS  74   7.705 -32.615  -1.501
 1451    HD3  LYS  74           HD2      LYS  74   6.609 -32.364  -0.145
 1452    HE2  LYS  74           HE3      LYS  74   4.937 -31.441  -1.631
 1453    HE3  LYS  74           HE2      LYS  74   6.035 -31.598  -3.000
 1454    HZ1  LYS  74           HZ1      LYS  74   6.003 -33.987  -2.715
 1455    HZ2  LYS  74           HZ2      LYS  74   4.427 -33.405  -2.910
 1456    HZ3  LYS  74           HZ3      LYS  74   4.981 -33.848  -1.376
 1457    H    HIS  75           H        HIS  75   6.010 -26.529  -1.436
 1458    HA   HIS  75           HA       HIS  75   8.436 -26.413  -3.092
 1459    HB2  HIS  75           HB3      HIS  75   5.579 -25.623  -3.687
 1460    HB3  HIS  75           HB2      HIS  75   6.927 -25.259  -4.760
 1461    HD1  HIS  75           HD1      HIS  75   4.968 -28.173  -3.374
 1462    HD2  HIS  75           HD2      HIS  75   7.755 -27.354  -6.359
 1463    HE1  HIS  75           HE1      HIS  75   5.085 -30.254  -4.792
 1464    HE2  HIS  75           HE2      HIS  75   6.726 -29.714  -6.625
 1465    H    TRP  76           H        TRP  76   6.272 -24.470  -1.134
 1466    HA   TRP  76           HA       TRP  76   8.055 -22.173  -1.566
 1467    HB2  TRP  76           HB3      TRP  76   5.032 -22.151  -1.495
 1468    HB3  TRP  76           HB2      TRP  76   6.023 -20.700  -1.378
 1469    HD1  TRP  76           HD1      TRP  76   4.400 -22.950  -3.855
 1470    HE1  TRP  76           HE1      TRP  76   5.027 -22.223  -6.245
 1471    HE3  TRP  76           HE3      TRP  76   8.217 -19.722  -2.765
 1472    HZ2  TRP  76           HZ2      TRP  76   6.875 -20.515  -7.497
 1473    HZ3  TRP  76           HZ3      TRP  76   9.359 -18.582  -4.620
 1474    HH2  TRP  76           HH2      TRP  76   8.701 -18.973  -6.938
 1475    H    ASN  77           H        ASN  77   8.680 -21.140   0.212
 1476    HA   ASN  77           HA       ASN  77   7.219 -21.621   2.724
 1477    HB2  ASN  77           HB3      ASN  77   9.639 -22.110   2.854
 1478    HB3  ASN  77           HB2      ASN  77  10.002 -20.487   2.287
 1479   HD21  ASN  77          HD21      ASN  77   8.873 -22.404   4.964
 1480   HD22  ASN  77          HD22      ASN  77   9.028 -21.170   6.168
 1481    H    SER  78           H        SER  78   6.238 -19.913   3.726
 1482    HA   SER  78           HA       SER  78   6.173 -17.433   2.146
 1483    HB2  SER  78           HB3      SER  78   3.931 -18.549   3.838
 1484    HB3  SER  78           HB2      SER  78   3.842 -17.225   2.677
 1485    HG   SER  78           HG       SER  78   4.280 -18.737   1.026
 1486    H    TYR  79           H        TYR  79   5.962 -15.465   3.209
 1487    HA   TYR  79           HA       TYR  79   5.871 -15.383   6.101
 1488    HB2  TYR  79           HB3      TYR  79   8.261 -15.640   5.774
 1489    HB3  TYR  79           HB2      TYR  79   8.270 -14.373   4.548
 1490    HD1  TYR  79           HD1      TYR  79   8.793 -12.192   5.163
 1491    HD2  TYR  79           HD2      TYR  79   7.488 -14.923   8.157
 1492    HE1  TYR  79           HE1      TYR  79   9.267 -10.514   6.891
 1493    HE2  TYR  79           HE2      TYR  79   7.960 -13.246   9.894
 1494    HH   TYR  79           HH       TYR  79   8.564  -9.984   9.182
 1495    H    CYS  80           H        CYS  80   4.833 -13.586   6.790
 1496    HA   CYS  80           HA       CYS  80   3.879 -11.757   4.748
 1497    HB2  CYS  80           HB3      CYS  80   3.198 -11.991   7.687
 1498    HB3  CYS  80           HB2      CYS  80   2.407 -10.900   6.548
 1499    H    THR  81           H        THR  81   4.648  -9.818   4.375
 1500    HA   THR  81           HA       THR  81   6.321  -8.514   6.419
 1501    HB   THR  81           HB       THR  81   6.781  -8.435   3.425
 1502    HG1  THR  81           HG1      THR  81   7.298 -10.438   4.787
 1503   HG21  THR  81          HG21      THR  81   8.452  -7.372   5.707
 1504   HG22  THR  81          HG22      THR  81   7.496  -6.399   4.590
 1505   HG23  THR  81          HG23      THR  81   8.878  -7.319   3.997
 1506    H    THR  82           H        THR  82   5.747  -6.442   6.863
 1507    HA   THR  82           HA       THR  82   3.470  -5.332   5.509
 1508    HB   THR  82           HB       THR  82   3.601  -5.025   7.908
 1509    HG1  THR  82           HG1      THR  82   3.711  -2.525   7.794
 1510   HG21  THR  82          HG21      THR  82   5.327  -3.498   8.874
 1511   HG22  THR  82          HG22      THR  82   6.181  -3.572   7.336
 1512   HG23  THR  82          HG23      THR  82   5.966  -5.033   8.297
 1513    H    THR  83           H        THR  83   3.447  -3.804   3.989
 1514    HA   THR  83           HA       THR  83   5.983  -2.973   2.861
 1515    HB   THR  83           HB       THR  83   4.405  -1.823   1.163
 1516    HG1  THR  83           HG1      THR  83   2.541  -3.662   2.279
 1517   HG21  THR  83          HG21      THR  83   5.656  -3.860   0.668
 1518   HG22  THR  83          HG22      THR  83   4.037  -3.937  -0.028
 1519   HG23  THR  83          HG23      THR  83   4.406  -4.829   1.447
 1520    H    HIS  84           H        HIS  84   6.442  -0.732   2.366
 1521    HA   HIS  84           HA       HIS  84   5.146   1.105   4.260
 1522    HB2  HIS  84           HB3      HIS  84   7.396   2.244   4.476
 1523    HB3  HIS  84           HB2      HIS  84   7.276   0.661   5.230
 1524    HD1  HIS  84           HD1      HIS  84   8.862   2.413   2.288
 1525    HD2  HIS  84           HD2      HIS  84   9.017  -1.251   4.245
 1526    HE1  HIS  84           HE1      HIS  84  10.887   1.243   1.375
 1527    HE2  HIS  84           HE2      HIS  84  10.849  -1.037   2.434
 1528    H    THR  85           H        THR  85   4.197   2.752   3.308
 1529    HA   THR  85           HA       THR  85   5.218   3.605   0.673
 1530    HB   THR  85           HB       THR  85   2.854   2.697   0.725
 1531    HG1  THR  85           HG1      THR  85   2.273   4.154  -0.786
 1532   HG21  THR  85          HG21      THR  85   1.090   4.159   1.605
 1533   HG22  THR  85          HG22      THR  85   2.315   5.249   2.253
 1534   HG23  THR  85          HG23      THR  85   2.167   3.613   2.891
 1535    H    PHE  86           H        PHE  86   4.939   5.975   0.244
 1536    HA   PHE  86           HA       PHE  86   5.563   7.432   2.720
 1537    HB2  PHE  86           HB3      PHE  86   6.558   7.872  -0.103
 1538    HB3  PHE  86           HB2      PHE  86   6.791   9.042   1.196
 1539    HD1  PHE  86           HD1      PHE  86   7.946   5.963  -0.292
 1540    HD2  PHE  86           HD2      PHE  86   8.133   8.406   3.187
 1541    HE1  PHE  86           HE1      PHE  86   9.981   4.775   0.431
 1542    HE2  PHE  86           HE2      PHE  86  10.162   7.226   3.914
 1543    HZ   PHE  86           HZ       PHE  86  11.089   5.409   2.539
 1544    H    VAL  87           H        VAL  87   4.052   8.753   3.372
 1545    HA   VAL  87           HA       VAL  87   2.249   9.941   1.360
 1546    HB   VAL  87           HB       VAL  87   0.550  10.096   3.161
 1547   HG11  VAL  87          HG11      VAL  87   0.491   8.228   1.611
 1548   HG12  VAL  87          HG12      VAL  87  -0.023   7.714   3.218
 1549   HG13  VAL  87          HG13      VAL  87   1.597   7.319   2.641
 1550   HG21  VAL  87          HG21      VAL  87   2.080  10.108   5.078
 1551   HG22  VAL  87          HG22      VAL  87   2.485   8.422   4.758
 1552   HG23  VAL  87          HG23      VAL  87   0.845   8.859   5.234
 1553    H    LYS  88           H        LYS  88   1.474  12.084   1.779
 1554    HA   LYS  88           HA       LYS  88   3.522  13.769   2.931
 1555    HB2  LYS  88           HB3      LYS  88   0.891  14.580   1.678
 1556    HB3  LYS  88           HB2      LYS  88   2.245  15.636   2.040
 1557    HG2  LYS  88           HG3      LYS  88   3.607  14.318   0.414
 1558    HG3  LYS  88           HG2      LYS  88   2.136  13.456  -0.028
 1559    HD2  LYS  88           HD3      LYS  88   2.455  15.212  -1.607
 1560    HD3  LYS  88           HD2      LYS  88   1.102  15.666  -0.569
 1561    HE2  LYS  88           HE3      LYS  88   2.615  17.089   0.747
 1562    HE3  LYS  88           HE2      LYS  88   3.947  16.640  -0.319
 1563    HZ1  LYS  88           HZ1      LYS  88   1.528  18.200  -1.015
 1564    HZ2  LYS  88           HZ2      LYS  88   2.598  17.594  -2.174
 1565    HZ3  LYS  88           HZ3      LYS  88   3.134  18.728  -1.033
 1566    H    ALA  89           H        ALA  89   3.541  13.978   5.039
 1567    HA   ALA  89           HA       ALA  89   1.003  14.622   6.391
 1568    HB1  ALA  89           HB1      ALA  89   1.769  13.410   8.367
 1569    HB2  ALA  89           HB2      ALA  89   3.234  12.928   7.512
 1570    HB3  ALA  89           HB3      ALA  89   1.663  12.338   6.970
 1571    H    LEU  90           H        LEU  90   1.072  16.289   7.819
 1572    HA   LEU  90           HA       LEU  90   3.319  18.049   7.699
 1573    HB2  LEU  90           HB3      LEU  90   0.905  18.776   7.901
 1574    HB3  LEU  90           HB2      LEU  90   0.938  18.192   9.559
 1575    HG   LEU  90           HG       LEU  90   2.877  19.818   9.928
 1576   HD11  LEU  90          HD11      LEU  90   1.810  20.908   7.330
 1577   HD12  LEU  90          HD12      LEU  90   3.430  20.273   7.623
 1578   HD13  LEU  90          HD13      LEU  90   2.908  21.758   8.417
 1579   HD21  LEU  90          HD21      LEU  90   0.124  20.881   9.311
 1580   HD22  LEU  90          HD22      LEU  90   1.350  21.706  10.272
 1581   HD23  LEU  90          HD23      LEU  90   0.661  20.185  10.842
 1582    H    THR  91           H        THR  91   5.114  17.443   8.712
 1583    HA   THR  91           HA       THR  91   4.892  16.523  11.500
 1584    HB   THR  91           HB       THR  91   6.744  14.952  11.127
 1585    HG1  THR  91           HG1      THR  91   6.474  15.545   8.357
 1586   HG21  THR  91          HG21      THR  91   4.585  14.503   9.061
 1587   HG22  THR  91          HG22      THR  91   4.395  14.180  10.780
 1588   HG23  THR  91          HG23      THR  91   5.578  13.272   9.843
 1589    H    THR  92           H        THR  92   7.027  16.793  12.670
 1590    HA   THR  92           HA       THR  92   8.444  19.124  11.580
 1591    HB   THR  92           HB       THR  92   7.115  19.787  13.512
 1592    HG1  THR  92           HG1      THR  92   9.199  20.739  13.194
 1593   HG21  THR  92          HG21      THR  92   8.718  17.775  15.088
 1594   HG22  THR  92          HG22      THR  92   7.008  17.635  14.677
 1595   HG23  THR  92          HG23      THR  92   7.554  18.927  15.747
 1596    H    ASP  93           H        ASP  93  10.413  18.638  10.959
 1597    HA   ASP  93           HA       ASP  93  11.769  16.340  12.134
 1598    HB2  ASP  93           HB3      ASP  93  13.330  16.500  10.265
 1599    HB3  ASP  93           HB2      ASP  93  11.672  16.497   9.675
 1600    H    GLU  94           H        GLU  94  11.925  19.805  12.104
 1601    HA   GLU  94           HA       GLU  94  14.239  19.614  13.905
 1602    HB2  GLU  94           HB3      GLU  94  13.672  21.784  11.883
 1603    HB3  GLU  94           HB2      GLU  94  14.868  21.934  13.158
 1604    HG2  GLU  94           HG3      GLU  94  16.026  19.950  12.217
 1605    HG3  GLU  94           HG2      GLU  94  14.874  19.967  10.886
 1606    H    LYS  95           H        LYS  95  12.479  22.566  13.161
 1607    HA   LYS  95           HA       LYS  95  11.158  22.406  15.782
 1608    HB2  LYS  95           HB3      LYS  95  12.782  24.725  14.732
 1609    HB3  LYS  95           HB2      LYS  95  11.715  24.825  16.124
 1610    HG2  LYS  95           HG3      LYS  95  13.045  23.156  17.287
 1611    HG3  LYS  95           HG2      LYS  95  14.102  23.012  15.882
 1612    HD2  LYS  95           HD3      LYS  95  14.740  25.353  16.117
 1613    HD3  LYS  95           HD2      LYS  95  13.677  25.509  17.518
 1614    HE2  LYS  95           HE3      LYS  95  16.038  23.646  17.307
 1615    HE3  LYS  95           HE2      LYS  95  16.036  25.189  18.154
 1616    HZ1  LYS  95           HZ1      LYS  95  14.350  22.839  18.820
 1617    HZ2  LYS  95           HZ2      LYS  95  14.312  24.323  19.624
 1618    HZ3  LYS  95           HZ3      LYS  95  15.702  23.365  19.686
 1619    H    GLN  96           H        GLN  96  10.667  22.644  12.601
 1620    HA   GLN  96           HA       GLN  96   8.287  24.339  12.948
 1621    HB2  GLN  96           HB3      GLN  96  10.120  24.128  10.553
 1622    HB3  GLN  96           HB2      GLN  96   8.535  24.879  10.490
 1623    HG2  GLN  96           HG3      GLN  96  10.774  25.779  12.289
 1624    HG3  GLN  96           HG2      GLN  96  10.408  26.479  10.714
 1625   HE21  GLN  96          HE21      GLN  96   9.422  26.197  14.025
 1626   HE22  GLN  96          HE22      GLN  96   8.216  27.434  13.982
 1627    H    ALA  97           H        ALA  97   6.499  23.770  11.521
 1628    HA   ALA  97           HA       ALA  97   6.382  20.877  11.104
 1629    HB1  ALA  97           HB1      ALA  97   3.967  21.156  11.011
 1630    HB2  ALA  97           HB2      ALA  97   4.148  22.907  11.100
 1631    HB3  ALA  97           HB3      ALA  97   4.616  21.901  12.471
 1632    H    ALA  98           H        ALA  98   6.380  20.011   9.126
 1633    HA   ALA  98           HA       ALA  98   5.667  21.663   6.821
 1634    HB1  ALA  98           HB1      ALA  98   7.695  21.029   5.614
 1635    HB2  ALA  98           HB2      ALA  98   8.280  20.165   7.037
 1636    HB3  ALA  98           HB3      ALA  98   8.092  21.918   7.083
 1637    H    TRP  99           H        TRP  99   5.105  20.454   4.962
 1638    HA   TRP  99           HA       TRP  99   3.989  17.877   5.542
 1639    HB2  TRP  99           HB3      TRP  99   4.169  19.441   2.956
 1640    HB3  TRP  99           HB2      TRP  99   3.304  17.920   3.134
 1641    HD1  TRP  99           HD1      TRP  99   2.964  21.622   3.764
 1642    HE1  TRP  99           HE1      TRP  99   0.614  22.125   4.696
 1643    HE3  TRP  99           HE3      TRP  99   1.415  16.835   4.655
 1644    HZ2  TRP  99           HZ2      TRP  99  -1.595  20.672   5.676
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.835  16.480   5.596
 1646    HH2  TRP  99           HH2      TRP  99  -2.304  18.361   6.095
 1647    H    ARG 100           H        ARG 100   5.422  16.320   5.871
 1648    HA   ARG 100           HA       ARG 100   7.664  16.000   4.006
 1649    HB2  ARG 100           HB3      ARG 100   7.117  14.696   6.686
 1650    HB3  ARG 100           HB2      ARG 100   8.538  14.399   5.700
 1651    HG2  ARG 100           HG3      ARG 100   7.790  17.072   6.873
 1652    HG3  ARG 100           HG2      ARG 100   8.941  15.938   7.583
 1653    HD2  ARG 100           HD3      ARG 100  10.299  16.088   5.522
 1654    HD3  ARG 100           HD2      ARG 100   9.174  17.291   4.902
 1655    HE   ARG 100           HE       ARG 100  10.433  17.856   7.466
 1656   HH11  ARG 100          HH11      ARG 100  10.327  18.427   4.016
 1657   HH12  ARG 100          HH12      ARG 100  11.269  19.879   4.100
 1658   HH21  ARG 100          HH21      ARG 100  11.672  19.752   7.593
 1659   HH22  ARG 100          HH22      ARG 100  12.039  20.639   6.138
 1660    H    PHE 101           H        PHE 101   8.208  13.734   3.435
 1661    HA   PHE 101           HA       PHE 101   5.756  12.218   2.836
 1662    HB2  PHE 101           HB3      PHE 101   8.477  12.249   1.501
 1663    HB3  PHE 101           HB2      PHE 101   7.268  11.020   1.160
 1664    HD1  PHE 101           HD1      PHE 101   5.744  11.357  -0.533
 1665    HD2  PHE 101           HD2      PHE 101   7.721  14.719   1.170
 1666    HE1  PHE 101           HE1      PHE 101   4.738  12.810  -2.241
 1667    HE2  PHE 101           HE2      PHE 101   6.718  16.178  -0.534
 1668    HZ   PHE 101           HZ       PHE 101   5.224  15.224  -2.243
 1669    H    ILE 102           H        ILE 102   5.437  10.787   4.447
 1670    HA   ILE 102           HA       ILE 102   7.842   9.575   5.651
 1671    HB   ILE 102           HB       ILE 102   6.516   9.267   7.709
 1672   HG12  ILE 102          HG13      ILE 102   4.440  11.017   6.386
 1673   HG13  ILE 102          HG12      ILE 102   4.281   9.274   6.559
 1674   HG21  ILE 102          HG21      ILE 102   7.960  11.202   7.486
 1675   HG22  ILE 102          HG22      ILE 102   6.513  11.614   8.406
 1676   HG23  ILE 102          HG23      ILE 102   6.654  12.110   6.720
 1677   HD11  ILE 102          HD11      ILE 102   4.496  11.269   8.800
 1678   HD12  ILE 102          HD12      ILE 102   4.367   9.520   8.991
 1679   HD13  ILE 102          HD13      ILE 102   3.034  10.431   8.276
 1680    H    ARG 103           H        ARG 103   7.891   7.438   6.120
 1681    HA   ARG 103           HA       ARG 103   6.241   5.776   4.453
 1682    HB2  ARG 103           HB3      ARG 103   7.645   3.912   5.360
 1683    HB3  ARG 103           HB2      ARG 103   8.561   5.192   4.578
 1684    HG2  ARG 103           HG3      ARG 103   9.333   6.026   6.645
 1685    HG3  ARG 103           HG2      ARG 103   8.176   5.052   7.552
 1686    HD2  ARG 103           HD3      ARG 103  10.333   3.858   5.827
 1687    HD3  ARG 103           HD2      ARG 103  10.561   4.211   7.539
 1688    HE   ARG 103           HE       ARG 103   8.297   2.716   7.495
 1689   HH11  ARG 103          HH11      ARG 103  11.501   2.238   6.154
 1690   HH12  ARG 103          HH12      ARG 103  11.468   0.515   6.362
 1691   HH21  ARG 103          HH21      ARG 103   8.248   0.454   7.764
 1692   HH22  ARG 103          HH22      ARG 103   9.610  -0.502   7.269
 1693    H    ILE 104           H        ILE 104   4.416   4.901   5.008
 1694    HA   ILE 104           HA       ILE 104   4.015   4.099   7.810
 1695    HB   ILE 104           HB       ILE 104   1.568   4.406   7.459
 1696   HG12  ILE 104          HG13      ILE 104   2.401   5.881   4.956
 1697   HG13  ILE 104          HG12      ILE 104   1.631   4.300   4.976
 1698   HG21  ILE 104          HG21      ILE 104   3.245   6.884   7.100
 1699   HG22  ILE 104          HG22      ILE 104   2.852   6.102   8.631
 1700   HG23  ILE 104          HG23      ILE 104   1.577   6.851   7.669
 1701   HD11  ILE 104          HD11      ILE 104   0.432   6.853   6.012
 1702   HD12  ILE 104          HD12      ILE 104  -0.346   5.270   6.006
 1703   HD13  ILE 104          HD13      ILE 104   0.044   6.068   4.481
 1704    H    ASP 105           H        ASP 105   2.638   2.237   8.092
 1705    HA   ASP 105           HA       ASP 105   3.319   0.104   6.366
 1706    HB2  ASP 105           HB3      ASP 105   1.241   0.251   8.571
 1707    HB3  ASP 105           HB2      ASP 105   1.751  -1.238   7.773
 1708    H    THR 106           H        THR 106   2.441  -0.453   4.523
 1709    HA   THR 106           HA       THR 106   0.020   0.939   3.676
 1710    HB   THR 106           HB       THR 106   1.713  -0.791   1.897
 1711    HG1  THR 106           HG1      THR 106   2.625   1.221   3.371
 1712   HG21  THR 106          HG21      THR 106   1.084   0.848   0.214
 1713   HG22  THR 106          HG22      THR 106   0.264   1.820   1.435
 1714   HG23  THR 106          HG23      THR 106  -0.360   0.226   1.014
 1715    H    ALA 107           H        ALA 107   1.367  -2.337   3.404
 1716    HA   ALA 107           HA       ALA 107  -1.152  -3.554   4.064
 1717    HB1  ALA 107           HB1      ALA 107  -1.399  -4.785   1.963
 1718    HB2  ALA 107           HB2      ALA 107  -0.031  -3.905   1.281
 1719    HB3  ALA 107           HB3      ALA 107  -1.515  -3.047   1.695
 1720    H    CYS 108           H        CYS 108  -0.936  -5.863   4.344
 1721    HA   CYS 108           HA       CYS 108   1.834  -6.623   4.879
 1722    HB2  CYS 108           HB3      CYS 108   0.113  -6.850   6.694
 1723    HB3  CYS 108           HB2      CYS 108  -0.700  -8.064   5.703
 1724    H    VAL 109           H        VAL 109   2.834  -7.614   3.280
 1725    HA   VAL 109           HA       VAL 109   1.224  -9.092   1.320
 1726    HB   VAL 109           HB       VAL 109   3.103  -8.872  -0.208
 1727   HG11  VAL 109          HG11      VAL 109   2.456  -6.261   1.152
 1728   HG12  VAL 109          HG12      VAL 109   1.516  -7.035  -0.123
 1729   HG13  VAL 109          HG13      VAL 109   3.139  -6.434  -0.464
 1730   HG21  VAL 109          HG21      VAL 109   5.113  -7.595   0.398
 1731   HG22  VAL 109          HG22      VAL 109   4.945  -9.056   1.374
 1732   HG23  VAL 109          HG23      VAL 109   4.533  -7.484   2.060
 1733    H    CYS 110           H        CYS 110   1.842 -11.167   0.630
 1734    HA   CYS 110           HA       CYS 110   3.475 -12.624   2.579
 1735    HB2  CYS 110           HB3      CYS 110   1.208 -13.517   2.227
 1736    HB3  CYS 110           HB2      CYS 110   1.534 -13.685   0.507
 1737    H    VAL 111           H        VAL 111   5.516 -12.897   2.032
 1738    HA   VAL 111           HA       VAL 111   6.282 -12.892  -0.777
 1739    HB   VAL 111           HB       VAL 111   8.573 -12.805  -0.033
 1740   HG11  VAL 111          HG11      VAL 111   7.434 -10.690  -0.023
 1741   HG12  VAL 111          HG12      VAL 111   8.548 -10.753   1.344
 1742   HG13  VAL 111          HG13      VAL 111   6.820 -10.987   1.604
 1743   HG21  VAL 111          HG21      VAL 111   8.455 -14.377   1.819
 1744   HG22  VAL 111          HG22      VAL 111   7.533 -13.207   2.766
 1745   HG23  VAL 111          HG23      VAL 111   9.204 -12.862   2.326
 1746    H    LEU 112           H        LEU 112   7.414 -14.609  -1.750
 1747    HA   LEU 112           HA       LEU 112   7.010 -17.206  -0.415
 1748    HB2  LEU 112           HB3      LEU 112   6.853 -16.539  -3.359
 1749    HB3  LEU 112           HB2      LEU 112   6.733 -18.155  -2.690
 1750    HG   LEU 112           HG       LEU 112   4.780 -15.918  -2.128
 1751   HD11  LEU 112          HD11      LEU 112   4.576 -18.297  -3.966
 1752   HD12  LEU 112          HD12      LEU 112   4.668 -16.602  -4.449
 1753   HD13  LEU 112          HD13      LEU 112   3.260 -17.192  -3.569
 1754   HD21  LEU 112          HD21      LEU 112   3.389 -17.712  -1.200
 1755   HD22  LEU 112          HD22      LEU 112   4.902 -17.535  -0.315
 1756   HD23  LEU 112          HD23      LEU 112   4.702 -18.861  -1.460
 1757    H    SER 113           H        SER 113   8.674 -18.617  -0.392
 1758    HA   SER 113           HA       SER 113  11.038 -17.976  -2.020
 1759    HB2  SER 113           HB3      SER 113  12.433 -18.770  -0.068
 1760    HB3  SER 113           HB2      SER 113  11.592 -17.243   0.202
 1761    HG   SER 113           HG       SER 113   9.962 -18.450   1.304
 1762    H    ARG 114           H        ARG 114  12.296 -19.779  -2.641
 1763    HA   ARG 114           HA       ARG 114  10.723 -22.127  -3.135
 1764    HB2  ARG 114           HB3      ARG 114  13.500 -21.267  -3.889
 1765    HB3  ARG 114           HB2      ARG 114  12.955 -22.911  -4.190
 1766    HG2  ARG 114           HG3      ARG 114  11.565 -20.445  -5.214
 1767    HG3  ARG 114           HG2      ARG 114  12.725 -21.405  -6.140
 1768    HD2  ARG 114           HD3      ARG 114  11.269 -23.377  -5.841
 1769    HD3  ARG 114           HD2      ARG 114  10.093 -22.361  -5.012
 1770    HE   ARG 114           HE       ARG 114  10.635 -21.226  -7.512
 1771   HH11  ARG 114          HH11      ARG 114   9.141 -24.080  -6.145
 1772   HH12  ARG 114          HH12      ARG 114   8.009 -24.274  -7.447
 1773   HH21  ARG 114          HH21      ARG 114   9.155 -21.485  -9.248
 1774   HH22  ARG 114          HH22      ARG 114   8.029 -22.804  -9.226
 1775    H    LYS 115           H        LYS 115  12.031 -21.287  -0.401
 1776    HA   LYS 115           HA       LYS 115  12.565 -22.364   1.519
 1777    HB2  LYS 115           HB3      LYS 115  12.382 -24.935  -0.077
 1778    HB3  LYS 115           HB2      LYS 115  12.474 -24.816   1.674
 1779    HG2  LYS 115           HG3      LYS 115  10.319 -23.560   1.626
 1780    HG3  LYS 115           HG2      LYS 115  10.227 -23.902  -0.104
 1781    HD2  LYS 115           HD3      LYS 115   8.912 -25.526   1.101
 1782    HD3  LYS 115           HD2      LYS 115  10.322 -26.313   0.393
 1783    HE2  LYS 115           HE3      LYS 115  11.452 -26.322   2.501
 1784    HE3  LYS 115           HE2      LYS 115  10.181 -25.353   3.242
 1785    HZ1  LYS 115           HZ1      LYS 115   8.639 -27.198   2.833
 1786    HZ2  LYS 115           HZ2      LYS 115   9.914 -27.637   3.856
 1787    HZ3  LYS 115           HZ3      LYS 115   9.922 -28.132   2.240
 1788    H    ALA 116           H        ALA 116  14.176 -23.911  -1.245
 1789    HA   ALA 116           HA       ALA 116  16.736 -23.844   0.111
 1790    HB1  ALA 116           HB1      ALA 116  16.217 -25.691  -1.414
 1791    HB2  ALA 116           HB2      ALA 116  17.622 -24.780  -1.967
 1792    HB3  ALA 116           HB3      ALA 116  16.059 -24.548  -2.748
 1793    H    THR 117           H        THR 117  18.585 -22.863  -1.209
 1794    HA   THR 117           HA       THR 117  19.704 -21.010  -1.822
 1795    HB   THR 117           HB       THR 117  18.907 -19.675  -3.683
 1796    HG1  THR 117           HG1      THR 117  16.442 -20.705  -2.915
 1797   HG21  THR 117          HG21      THR 117  18.581 -21.472  -5.331
 1798   HG22  THR 117          HG22      THR 117  18.285 -22.609  -4.016
 1799   HG23  THR 117          HG23      THR 117  19.867 -21.848  -4.186
 1800    H    ARG 118           H        ARG 118  19.657 -18.551  -1.919
 1801    HA   ARG 118           HA       ARG 118  17.697 -17.414  -0.076
 1802    HB2  ARG 118           HB3      ARG 118  20.694 -17.206   0.289
 1803    HB3  ARG 118           HB2      ARG 118  19.511 -16.280   1.198
 1804    HG2  ARG 118           HG3      ARG 118  18.585 -18.396   2.077
 1805    HG3  ARG 118           HG2      ARG 118  19.852 -19.271   1.223
 1806    HD2  ARG 118           HD3      ARG 118  20.245 -17.233   3.415
 1807    HD3  ARG 118           HD2      ARG 118  20.451 -18.976   3.557
 1808    HE   ARG 118           HE       ARG 118  22.111 -17.947   1.505
 1809   HH11  ARG 118          HH11      ARG 118  21.824 -18.098   4.991
 1810   HH12  ARG 118          HH12      ARG 118  23.533 -17.979   5.262
 1811   HH21  ARG 118          HH21      ARG 118  24.351 -17.776   1.857
 1812   HH22  ARG 118          HH22      ARG 118  24.975 -17.799   3.475
  Start of MODEL    4
    1    H1   SER   1           H1       SER   1  25.348 -10.545   5.906
    2    H2   SER   1           H2       SER   1  25.001  -8.941   6.305
    3    H3   SER   1           H3       SER   1  24.155  -9.703   5.054
    4    HA   SER   1           HA       SER   1  23.152 -11.232   6.587
    5    HB2  SER   1           HB3      SER   1  24.554  -9.638   8.748
    6    HB3  SER   1           HB2      SER   1  23.516 -11.043   8.976
    7    HG   SER   1           HG       SER   1  25.056 -12.331   8.022
    8    H    SER   2           H        SER   2  23.680  -8.001   8.027
    9    HA   SER   2           HA       SER   2  20.796  -7.515   7.718
   10    HB2  SER   2           HB3      SER   2  21.656  -7.592  10.056
   11    HB3  SER   2           HB2      SER   2  22.720  -6.239   9.681
   12    HG   SER   2           HG       SER   2  20.395  -5.417   8.925
   13    H    THR   3           H        THR   3  23.701  -6.732   6.373
   14    HA   THR   3           HA       THR   3  23.271  -3.926   5.924
   15    HB   THR   3           HB       THR   3  25.147  -4.362   4.174
   16    HG1  THR   3           HG1      THR   3  26.227  -6.284   4.417
   17   HG21  THR   3          HG21      THR   3  26.853  -4.307   5.938
   18   HG22  THR   3          HG22      THR   3  25.635  -4.777   7.124
   19   HG23  THR   3          HG23      THR   3  25.510  -3.223   6.301
   20    H    HIS   4           H        HIS   4  21.059  -4.232   5.112
   21    HA   HIS   4           HA       HIS   4  19.505  -4.247   3.453
   22    HB2  HIS   4           HB3      HIS   4  21.122  -2.629   2.446
   23    HB3  HIS   4           HB2      HIS   4  21.891  -3.965   1.607
   24    HD1  HIS   4           HD1      HIS   4  18.949  -1.706   1.478
   25    HD2  HIS   4           HD2      HIS   4  20.412  -5.007  -0.575
   26    HE1  HIS   4           HE1      HIS   4  17.629  -1.814  -0.659
   27    HE2  HIS   4           HE2      HIS   4  18.678  -3.689  -1.968
   28    HA   PRO   5           HA       PRO   5  20.298  -8.728   2.602
   29    HB2  PRO   5           HB3      PRO   5  18.020  -9.677   3.681
   30    HB3  PRO   5           HB2      PRO   5  19.431  -9.283   4.674
   31    HG2  PRO   5           HG3      PRO   5  16.954  -7.671   4.175
   32    HG3  PRO   5           HG2      PRO   5  17.810  -7.949   5.702
   33    HD2  PRO   5           HD3      PRO   5  18.090  -5.676   4.223
   34    HD3  PRO   5           HD2      PRO   5  19.380  -6.323   5.255
   35    H    VAL   6           H        VAL   6  19.153  -6.640   0.883
   36    HA   VAL   6           HA       VAL   6  18.033  -6.423  -1.076
   37    HB   VAL   6           HB       VAL   6  17.755  -9.426  -1.109
   38   HG11  VAL   6          HG11      VAL   6  17.987  -9.164  -3.526
   39   HG12  VAL   6          HG12      VAL   6  18.115  -7.417  -3.326
   40   HG13  VAL   6          HG13      VAL   6  16.615  -8.244  -2.907
   41   HG21  VAL   6          HG21      VAL   6  20.182  -7.811  -1.876
   42   HG22  VAL   6          HG22      VAL   6  19.969  -9.542  -2.135
   43   HG23  VAL   6          HG23      VAL   6  20.050  -8.901  -0.496
   44    H    PHE   7           H        PHE   7  16.601  -6.725   1.558
   45    HA   PHE   7           HA       PHE   7  14.513  -6.860   2.437
   46    HB2  PHE   7           HB3      PHE   7  14.285  -5.155   0.476
   47    HB3  PHE   7           HB2      PHE   7  13.397  -6.443  -0.326
   48    HD1  PHE   7           HD1      PHE   7  11.202  -7.114   0.468
   49    HD2  PHE   7           HD2      PHE   7  13.396  -4.030   2.409
   50    HE1  PHE   7           HE1      PHE   7   9.164  -6.409   1.643
   51    HE2  PHE   7           HE2      PHE   7  11.363  -3.320   3.593
   52    HZ   PHE   7           HZ       PHE   7   9.240  -4.508   3.215
   53    H    HIS   8           H        HIS   8  15.493  -9.260   2.215
   54    HA   HIS   8           HA       HIS   8  15.037 -11.484   2.126
   55    HB2  HIS   8           HB3      HIS   8  12.856 -10.679   3.157
   56    HB3  HIS   8           HB2      HIS   8  12.164 -10.719   1.542
   57    HD1  HIS   8           HD1      HIS   8  13.355 -12.958   4.300
   58    HD2  HIS   8           HD2      HIS   8  11.534 -13.275   0.580
   59    HE1  HIS   8           HE1      HIS   8  12.544 -15.332   4.144
   60    HE2  HIS   8           HE2      HIS   8  11.623 -15.549   1.807
   61    H    MET   9           H        MET   9  16.089 -10.358  -0.122
   62    HA   MET   9           HA       MET   9  16.535 -10.773  -2.316
   63    HB2  MET   9           HB3      MET   9  14.758 -13.184  -1.866
   64    HB3  MET   9           HB2      MET   9  15.757 -12.927  -3.287
   65    HG2  MET   9           HG3      MET   9  17.763 -13.054  -1.958
   66    HG3  MET   9           HG2      MET   9  16.814 -13.153  -0.479
   67    HE1  MET   9           HE1      MET   9  17.514 -14.967  -3.932
   68    HE2  MET   9           HE2      MET   9  15.758 -14.903  -3.795
   69    HE3  MET   9           HE3      MET   9  16.594 -16.453  -3.697
   70    H    GLY  10           H        GLY  10  14.218  -9.164  -1.512
   71    HA2  GLY  10           HA3      GLY  10  12.891  -7.866  -3.029
   72    HA3  GLY  10           HA2      GLY  10  12.707  -9.296  -4.035
   73    H    GLU  11           H        GLU  11  10.749  -7.430  -2.642
   74    HA   GLU  11           HA       GLU  11   9.436  -9.080  -0.714
   75    HB2  GLU  11           HB3      GLU  11   7.557  -7.373  -0.999
   76    HB3  GLU  11           HB2      GLU  11   9.097  -6.777  -0.394
   77    HG2  GLU  11           HG3      GLU  11   9.639  -6.010  -2.700
   78    HG3  GLU  11           HG2      GLU  11   8.010  -6.480  -3.186
   79    H    PHE  12           H        PHE  12   9.430 -10.979  -2.008
   80    HA   PHE  12           HA       PHE  12   8.225 -11.469  -4.405
   81    HB2  PHE  12           HB3      PHE  12   8.206 -13.228  -1.944
   82    HB3  PHE  12           HB2      PHE  12   7.763 -13.779  -3.558
   83    HD1  PHE  12           HD1      PHE  12  10.355 -13.572  -1.228
   84    HD2  PHE  12           HD2      PHE  12   9.589 -13.295  -5.405
   85    HE1  PHE  12           HE1      PHE  12  12.710 -14.101  -1.692
   86    HE2  PHE  12           HE2      PHE  12  11.945 -13.825  -5.876
   87    HZ   PHE  12           HZ       PHE  12  13.509 -14.231  -4.018
   88    H    SER  13           H        SER  13   6.223 -11.752  -5.186
   89    HA   SER  13           HA       SER  13   3.983 -11.372  -3.315
   90    HB2  SER  13           HB3      SER  13   4.122 -10.361  -6.165
   91    HB3  SER  13           HB2      SER  13   2.887  -9.993  -4.967
   92    HG   SER  13           HG       SER  13   5.257  -9.357  -3.942
   93    H    VAL  14           H        VAL  14   2.306 -12.775  -3.514
   94    HA   VAL  14           HA       VAL  14   2.525 -15.139  -5.027
   95    HB   VAL  14           HB       VAL  14   0.186 -15.586  -4.379
   96   HG11  VAL  14          HG11      VAL  14   1.899 -14.462  -2.166
   97   HG12  VAL  14          HG12      VAL  14   1.948 -16.107  -2.801
   98   HG13  VAL  14          HG13      VAL  14   0.518 -15.536  -1.941
   99   HG21  VAL  14          HG21      VAL  14  -1.049 -13.992  -3.000
  100   HG22  VAL  14          HG22      VAL  14  -0.711 -13.325  -4.597
  101   HG23  VAL  14          HG23      VAL  14   0.241 -12.806  -3.206
  102    H    CYS  15           H        CYS  15   1.225 -12.042  -5.736
  103    HA   CYS  15           HA       CYS  15   0.683 -12.919  -8.481
  104    HB2  CYS  15           HB3      CYS  15  -1.469 -12.504  -7.302
  105    HB3  CYS  15           HB2      CYS  15  -0.926 -10.869  -6.922
  106    H    ASP  16           H        ASP  16   1.626 -11.619 -10.008
  107    HA   ASP  16           HA       ASP  16   3.702  -9.909  -9.098
  108    HB2  ASP  16           HB3      ASP  16   2.659 -10.538 -11.857
  109    HB3  ASP  16           HB2      ASP  16   3.935  -9.354 -11.596
  110    H    SER  17           H        SER  17   3.789  -7.805  -8.822
  111    HA   SER  17           HA       SER  17   1.490  -6.205  -9.710
  112    HB2  SER  17           HB3      SER  17   1.838  -4.851  -7.608
  113    HB3  SER  17           HB2      SER  17   1.256  -6.493  -7.332
  114    HG   SER  17           HG       SER  17   3.426  -7.086  -6.866
  115    H    VAL  18           H        VAL  18   1.915  -4.097 -10.356
  116    HA   VAL  18           HA       VAL  18   4.769  -3.495 -10.727
  117    HB   VAL  18           HB       VAL  18   3.677  -3.925 -12.854
  118   HG11  VAL  18          HG11      VAL  18   1.899  -2.450 -13.703
  119   HG12  VAL  18          HG12      VAL  18   1.783  -1.708 -12.106
  120   HG13  VAL  18          HG13      VAL  18   1.389  -3.414 -12.317
  121   HG21  VAL  18          HG21      VAL  18   4.207  -1.815 -14.004
  122   HG22  VAL  18          HG22      VAL  18   5.446  -2.289 -12.844
  123   HG23  VAL  18          HG23      VAL  18   4.303  -1.009 -12.438
  124    H    SER  19           H        SER  19   5.437  -1.949  -9.439
  125    HA   SER  19           HA       SER  19   3.551   0.018  -8.401
  126    HB2  SER  19           HB3      SER  19   5.503   0.630  -6.901
  127    HB3  SER  19           HB2      SER  19   4.892  -1.019  -6.704
  128    HG   SER  19           HG       SER  19   7.148  -0.250  -8.261
  129    H    VAL  20           H        VAL  20   3.324   1.850  -9.462
  130    HA   VAL  20           HA       VAL  20   5.622   2.921 -10.961
  131    HB   VAL  20           HB       VAL  20   2.701   3.131 -11.704
  132   HG11  VAL  20          HG11      VAL  20   3.519   4.079 -13.809
  133   HG12  VAL  20          HG12      VAL  20   5.164   4.043 -13.174
  134   HG13  VAL  20          HG13      VAL  20   3.948   5.073 -12.417
  135   HG21  VAL  20          HG21      VAL  20   3.507   0.871 -12.029
  136   HG22  VAL  20          HG22      VAL  20   4.890   1.475 -12.942
  137   HG23  VAL  20          HG23      VAL  20   3.257   1.663 -13.584
  138    H    TRP  21           H        TRP  21   6.129   5.009 -10.597
  139    HA   TRP  21           HA       TRP  21   4.379   6.608  -8.907
  140    HB2  TRP  21           HB3      TRP  21   7.156   7.074 -10.016
  141    HB3  TRP  21           HB2      TRP  21   6.246   8.334  -9.187
  142    HD1  TRP  21           HD1      TRP  21   8.096   5.050  -8.530
  143    HE1  TRP  21           HE1      TRP  21   8.483   4.806  -5.996
  144    HE3  TRP  21           HE3      TRP  21   5.300   9.014  -6.894
  145    HZ2  TRP  21           HZ2      TRP  21   7.710   6.117  -3.626
  146    HZ3  TRP  21           HZ3      TRP  21   5.179   9.449  -4.473
  147    HH2  TRP  21           HH2      TRP  21   6.358   8.030  -2.877
  148    H    VAL  22           H        VAL  22   2.653   7.130 -10.105
  149    HA   VAL  22           HA       VAL  22   2.756   7.736 -12.882
  150    HB   VAL  22           HB       VAL  22   0.553   8.345 -10.899
  151   HG11  VAL  22          HG11      VAL  22   0.316   9.585 -12.977
  152   HG12  VAL  22          HG12      VAL  22  -0.916   8.327 -12.858
  153   HG13  VAL  22          HG13      VAL  22   0.484   8.092 -13.902
  154   HG21  VAL  22          HG21      VAL  22   0.977   5.911 -12.627
  155   HG22  VAL  22          HG22      VAL  22  -0.453   6.237 -11.649
  156   HG23  VAL  22          HG23      VAL  22   1.107   5.979 -10.869
  157    H    GLY  23           H        GLY  23   3.436   9.539 -13.755
  158    HA2  GLY  23           HA3      GLY  23   4.152  11.779 -12.139
  159    HA3  GLY  23           HA2      GLY  23   4.324  11.654 -13.886
  160    H    ASP  24           H        ASP  24   1.486  11.066 -14.314
  161    HA   ASP  24           HA       ASP  24   0.304  13.645 -13.589
  162    HB2  ASP  24           HB3      ASP  24   0.683  12.639 -16.413
  163    HB3  ASP  24           HB2      ASP  24  -0.472  13.901 -15.993
  164    H    LYS  25           H        LYS  25  -0.820  11.944 -12.218
  165    HA   LYS  25           HA       LYS  25  -2.818  10.334 -13.473
  166    HB2  LYS  25           HB3      LYS  25  -1.901  10.002 -11.140
  167    HB3  LYS  25           HB2      LYS  25  -2.829  11.411 -10.646
  168    HG2  LYS  25           HG3      LYS  25  -4.894  10.299 -11.220
  169    HG3  LYS  25           HG2      LYS  25  -4.002   8.901 -11.824
  170    HD2  LYS  25           HD3      LYS  25  -3.039   8.640  -9.529
  171    HD3  LYS  25           HD2      LYS  25  -4.142   9.905  -8.987
  172    HE2  LYS  25           HE3      LYS  25  -5.076   7.704  -8.514
  173    HE3  LYS  25           HE2      LYS  25  -6.051   8.548  -9.719
  174    HZ1  LYS  25           HZ1      LYS  25  -5.036   7.248 -11.447
  175    HZ2  LYS  25           HZ2      LYS  25  -5.652   6.203 -10.275
  176    HZ3  LYS  25           HZ3      LYS  25  -3.983   6.502 -10.347
  177    H    THR  26           H        THR  26  -4.905  10.893 -14.060
  178    HA   THR  26           HA       THR  26  -5.353  13.786 -14.041
  179    HB   THR  26           HB       THR  26  -5.129  12.798 -16.263
  180    HG1  THR  26           HG1      THR  26  -6.725  14.561 -15.688
  181   HG21  THR  26          HG21      THR  26  -7.588  11.205 -15.533
  182   HG22  THR  26          HG22      THR  26  -5.979  10.562 -15.863
  183   HG23  THR  26          HG23      THR  26  -6.905  11.328 -17.154
  184    H    THR  27           H        THR  27  -6.937  10.764 -13.163
  185    HA   THR  27           HA       THR  27  -9.042  12.348 -11.899
  186    HB   THR  27           HB       THR  27 -10.710  10.549 -12.689
  187    HG1  THR  27           HG1      THR  27  -8.687   9.478 -13.774
  188   HG21  THR  27          HG21      THR  27 -10.826  12.884 -13.386
  189   HG22  THR  27          HG22      THR  27 -11.218  11.811 -14.730
  190   HG23  THR  27          HG23      THR  27  -9.632  12.578 -14.649
  191    H    ALA  28           H        ALA  28  -9.892  11.502 -10.062
  192    HA   ALA  28           HA       ALA  28  -9.480   8.722  -9.379
  193    HB1  ALA  28           HB1      ALA  28  -7.351   9.753  -8.688
  194    HB2  ALA  28           HB2      ALA  28  -8.272   9.114  -7.328
  195    HB3  ALA  28           HB3      ALA  28  -8.248  10.851  -7.640
  196    H    THR  29           H        THR  29 -10.623   8.135  -7.403
  197    HA   THR  29           HA       THR  29 -12.969   9.830  -7.032
  198    HB   THR  29           HB       THR  29 -12.544   7.052  -5.940
  199    HG1  THR  29           HG1      THR  29 -13.273   7.917  -8.529
  200   HG21  THR  29          HG21      THR  29 -15.045   8.614  -6.581
  201   HG22  THR  29          HG22      THR  29 -14.393   8.331  -4.967
  202   HG23  THR  29          HG23      THR  29 -14.984   6.976  -5.928
  203    H    ASP  30           H        ASP  30 -13.038  11.159  -5.366
  204    HA   ASP  30           HA       ASP  30 -11.291  11.045  -3.125
  205    HB2  ASP  30           HB3      ASP  30 -12.248  13.172  -3.817
  206    HB3  ASP  30           HB2      ASP  30 -13.882  12.553  -3.580
  207    H    ILE  31           H        ILE  31 -12.049  10.791  -0.847
  208    HA   ILE  31           HA       ILE  31 -13.099   8.257  -0.428
  209    HB   ILE  31           HB       ILE  31 -11.720   9.364   1.241
  210   HG12  ILE  31          HG13      ILE  31 -14.481   8.806   2.356
  211   HG13  ILE  31          HG12      ILE  31 -13.275   7.578   1.981
  212   HG21  ILE  31          HG21      ILE  31 -12.566  11.168   2.644
  213   HG22  ILE  31          HG22      ILE  31 -14.060  11.205   1.710
  214   HG23  ILE  31          HG23      ILE  31 -12.533  11.645   0.946
  215   HD11  ILE  31          HD11      ILE  31 -13.017   9.751   4.045
  216   HD12  ILE  31          HD12      ILE  31 -11.784   8.552   3.660
  217   HD13  ILE  31          HD13      ILE  31 -13.323   8.043   4.353
  218    H    LYS  32           H        LYS  32 -14.757  11.319  -0.727
  219    HA   LYS  32           HA       LYS  32 -17.230  10.361   0.404
  220    HB2  LYS  32           HB3      LYS  32 -16.615  12.860  -1.173
  221    HB3  LYS  32           HB2      LYS  32 -18.113  12.545  -0.302
  222    HG2  LYS  32           HG3      LYS  32 -16.919  12.517   1.800
  223    HG3  LYS  32           HG2      LYS  32 -15.385  12.726   0.955
  224    HD2  LYS  32           HD3      LYS  32 -16.178  14.877   0.096
  225    HD3  LYS  32           HD2      LYS  32 -17.676  14.682   1.007
  226    HE2  LYS  32           HE3      LYS  32 -16.409  14.640   3.089
  227    HE3  LYS  32           HE2      LYS  32 -14.905  14.791   2.182
  228    HZ1  LYS  32           HZ1      LYS  32 -15.607  16.916   3.074
  229    HZ2  LYS  32           HZ2      LYS  32 -17.084  16.805   2.262
  230    HZ3  LYS  32           HZ3      LYS  32 -15.647  16.946   1.385
  231    H    GLY  33           H        GLY  33 -15.753   9.610  -2.394
  232    HA2  GLY  33           HA3      GLY  33 -16.657   8.289  -4.096
  233    HA3  GLY  33           HA2      GLY  33 -18.271   8.772  -3.586
  234    H    LYS  34           H        LYS  34 -15.756  11.101  -4.156
  235    HA   LYS  34           HA       LYS  34 -17.294  12.136  -6.426
  236    HB2  LYS  34           HB3      LYS  34 -15.140  13.463  -4.777
  237    HB3  LYS  34           HB2      LYS  34 -16.078  14.235  -6.042
  238    HG2  LYS  34           HG3      LYS  34 -17.205  13.125  -3.484
  239    HG3  LYS  34           HG2      LYS  34 -16.841  14.821  -3.788
  240    HD2  LYS  34           HD3      LYS  34 -18.423  14.765  -5.695
  241    HD3  LYS  34           HD2      LYS  34 -18.856  13.116  -5.241
  242    HE2  LYS  34           HE3      LYS  34 -19.642  13.896  -3.080
  243    HE3  LYS  34           HE2      LYS  34 -19.130  15.535  -3.468
  244    HZ1  LYS  34           HZ1      LYS  34 -20.736  15.568  -5.274
  245    HZ2  LYS  34           HZ2      LYS  34 -21.499  15.250  -3.799
  246    HZ3  LYS  34           HZ3      LYS  34 -21.224  13.993  -4.896
  247    H    GLU  35           H        GLU  35 -16.563  11.428  -8.344
  248    HA   GLU  35           HA       GLU  35 -13.794  10.814  -8.815
  249    HB2  GLU  35           HB3      GLU  35 -15.724   9.729 -10.018
  250    HB3  GLU  35           HB2      GLU  35 -15.998  11.259 -10.836
  251    HG2  GLU  35           HG3      GLU  35 -14.783   9.814 -12.294
  252    HG3  GLU  35           HG2      GLU  35 -13.713  11.113 -11.775
  253    H    VAL  36           H        VAL  36 -12.297  12.340  -9.056
  254    HA   VAL  36           HA       VAL  36 -13.129  14.953 -10.116
  255    HB   VAL  36           HB       VAL  36 -11.581  16.006  -8.422
  256   HG11  VAL  36          HG11      VAL  36 -14.007  14.549  -7.384
  257   HG12  VAL  36          HG12      VAL  36 -13.992  16.130  -8.166
  258   HG13  VAL  36          HG13      VAL  36 -13.222  15.914  -6.594
  259   HG21  VAL  36          HG21      VAL  36 -11.784  13.282  -7.143
  260   HG22  VAL  36          HG22      VAL  36 -11.115  14.725  -6.382
  261   HG23  VAL  36          HG23      VAL  36 -10.321  14.024  -7.793
  262    H    THR  37           H        THR  37 -11.404  16.296 -10.863
  263    HA   THR  37           HA       THR  37  -9.397  14.818 -12.306
  264    HB   THR  37           HB       THR  37  -9.817  17.808 -12.190
  265    HG1  THR  37           HG1      THR  37 -11.460  15.982 -13.147
  266   HG21  THR  37          HG21      THR  37  -8.677  17.811 -14.352
  267   HG22  THR  37          HG22      THR  37  -8.473  16.063 -14.255
  268   HG23  THR  37          HG23      THR  37  -7.649  17.112 -13.102
  269    H    VAL  38           H        VAL  38  -7.521  14.335 -11.448
  270    HA   VAL  38           HA       VAL  38  -6.618  15.639  -9.026
  271    HB   VAL  38           HB       VAL  38  -5.414  13.324 -10.562
  272   HG11  VAL  38          HG11      VAL  38  -4.182  12.866  -8.494
  273   HG12  VAL  38          HG12      VAL  38  -4.837  14.342  -7.783
  274   HG13  VAL  38          HG13      VAL  38  -3.759  14.436  -9.176
  275   HG21  VAL  38          HG21      VAL  38  -7.638  12.806  -9.721
  276   HG22  VAL  38          HG22      VAL  38  -7.166  13.342  -8.109
  277   HG23  VAL  38          HG23      VAL  38  -6.407  11.920  -8.823
  278    H    LEU  39           H        LEU  39  -4.812  16.887  -8.826
  279    HA   LEU  39           HA       LEU  39  -3.513  17.714 -11.329
  280    HB2  LEU  39           HB3      LEU  39  -3.537  19.126  -8.655
  281    HB3  LEU  39           HB2      LEU  39  -2.886  19.753 -10.159
  282    HG   LEU  39           HG       LEU  39  -5.793  19.224  -9.563
  283   HD11  LEU  39          HD11      LEU  39  -4.947  21.176  -8.415
  284   HD12  LEU  39          HD12      LEU  39  -5.996  21.664  -9.744
  285   HD13  LEU  39          HD13      LEU  39  -4.246  21.782  -9.915
  286   HD21  LEU  39          HD21      LEU  39  -6.217  20.293 -11.733
  287   HD22  LEU  39          HD22      LEU  39  -5.330  18.777 -11.894
  288   HD23  LEU  39          HD23      LEU  39  -4.481  20.316 -12.042
  289    H    ALA  40           H        ALA  40  -1.508  17.074 -11.664
  290    HA   ALA  40           HA       ALA  40  -0.089  15.551  -9.691
  291    HB1  ALA  40           HB1      ALA  40   0.806  16.494 -12.407
  292    HB2  ALA  40           HB2      ALA  40  -0.030  14.979 -12.075
  293    HB3  ALA  40           HB3      ALA  40   1.585  15.256 -11.424
  294    H    GLU  41           H        GLU  41  -0.219  18.806 -10.667
  295    HA   GLU  41           HA       GLU  41   2.289  19.442  -9.275
  296    HB2  GLU  41           HB3      GLU  41   0.634  21.430 -10.805
  297    HB3  GLU  41           HB2      GLU  41   2.357  21.461 -10.469
  298    HG2  GLU  41           HG3      GLU  41   0.969  19.617 -12.389
  299    HG3  GLU  41           HG2      GLU  41   1.892  21.051 -12.821
  300    H    VAL  42           H        VAL  42   2.010  20.021  -7.189
  301    HA   VAL  42           HA       VAL  42  -0.656  20.921  -6.403
  302    HB   VAL  42           HB       VAL  42  -0.078  20.376  -4.114
  303   HG11  VAL  42          HG11      VAL  42  -0.956  18.591  -5.484
  304   HG12  VAL  42          HG12      VAL  42   0.223  17.953  -4.338
  305   HG13  VAL  42          HG13      VAL  42   0.669  18.177  -6.030
  306   HG21  VAL  42          HG21      VAL  42   2.639  19.600  -5.162
  307   HG22  VAL  42          HG22      VAL  42   2.049  19.332  -3.522
  308   HG23  VAL  42          HG23      VAL  42   2.277  20.977  -4.119
  309    H    ASN  43           H        ASN  43  -1.056  22.935  -5.799
  310    HA   ASN  43           HA       ASN  43   1.232  24.723  -5.430
  311    HB2  ASN  43           HB3      ASN  43  -0.327  26.591  -5.881
  312    HB3  ASN  43           HB2      ASN  43  -0.251  25.454  -7.221
  313   HD21  ASN  43          HD21      ASN  43  -2.075  24.299  -7.782
  314   HD22  ASN  43          HD22      ASN  43  -3.634  24.640  -7.118
  315    H    ILE  44           H        ILE  44   1.778  25.072  -3.437
  316    HA   ILE  44           HA       ILE  44  -0.336  25.301  -1.398
  317    HB   ILE  44           HB       ILE  44   2.632  24.841  -0.989
  318   HG12  ILE  44          HG13      ILE  44   0.304  22.942  -0.597
  319   HG13  ILE  44          HG12      ILE  44   1.429  22.888  -1.951
  320   HG21  ILE  44          HG21      ILE  44   1.598  26.108   0.834
  321   HG22  ILE  44          HG22      ILE  44   2.055  24.489   1.358
  322   HG23  ILE  44          HG23      ILE  44   0.367  24.856   1.008
  323   HD11  ILE  44          HD11      ILE  44   1.982  21.215  -0.284
  324   HD12  ILE  44          HD12      ILE  44   2.126  22.467   0.949
  325   HD13  ILE  44          HD13      ILE  44   3.261  22.424  -0.399
  326    H    ASN  45           H        ASN  45  -0.947  27.367  -1.656
  327    HA   ASN  45           HA       ASN  45  -0.962  29.615  -1.453
  328    HB2  ASN  45           HB3      ASN  45   1.784  29.262  -0.223
  329    HB3  ASN  45           HB2      ASN  45   0.881  30.771  -0.249
  330   HD21  ASN  45          HD21      ASN  45  -1.696  29.479   0.235
  331   HD22  ASN  45          HD22      ASN  45  -1.685  29.001   1.898
  332    H    ASN  46           H        ASN  46   2.527  29.406  -1.970
  333    HA   ASN  46           HA       ASN  46   2.134  30.250  -4.751
  334    HB2  ASN  46           HB3      ASN  46   3.787  31.678  -2.674
  335    HB3  ASN  46           HB2      ASN  46   4.119  31.850  -4.393
  336   HD21  ASN  46          HD21      ASN  46   1.359  31.756  -5.227
  337   HD22  ASN  46          HD22      ASN  46   0.649  33.254  -4.739
  338    H    SER  47           H        SER  47   2.969  27.764  -3.347
  339    HA   SER  47           HA       SER  47   5.575  27.454  -4.679
  340    HB2  SER  47           HB3      SER  47   5.835  27.357  -2.227
  341    HB3  SER  47           HB2      SER  47   4.617  26.086  -2.144
  342    HG   SER  47           HG       SER  47   6.623  25.125  -2.121
  343    H    VAL  48           H        VAL  48   5.316  26.259  -6.433
  344    HA   VAL  48           HA       VAL  48   3.266  24.145  -6.423
  345    HB   VAL  48           HB       VAL  48   4.446  25.543  -8.830
  346   HG11  VAL  48          HG11      VAL  48   2.627  24.464 -10.056
  347   HG12  VAL  48          HG12      VAL  48   2.113  23.650  -8.580
  348   HG13  VAL  48          HG13      VAL  48   3.683  23.277  -9.292
  349   HG21  VAL  48          HG21      VAL  48   1.754  25.943  -7.535
  350   HG22  VAL  48          HG22      VAL  48   2.308  26.696  -9.030
  351   HG23  VAL  48          HG23      VAL  48   3.095  27.086  -7.501
  352    H    PHE  49           H        PHE  49   4.000  22.128  -6.447
  353    HA   PHE  49           HA       PHE  49   6.388  21.464  -7.945
  354    HB2  PHE  49           HB3      PHE  49   7.447  20.273  -6.038
  355    HB3  PHE  49           HB2      PHE  49   7.371  22.013  -5.795
  356    HD1  PHE  49           HD1      PHE  49   5.720  22.959  -4.183
  357    HD2  PHE  49           HD2      PHE  49   6.364  18.767  -4.582
  358    HE1  PHE  49           HE1      PHE  49   4.654  22.587  -1.998
  359    HE2  PHE  49           HE2      PHE  49   5.296  18.393  -2.399
  360    HZ   PHE  49           HZ       PHE  49   4.441  20.303  -1.105
  361    H    ARG  50           H        ARG  50   6.607  19.226  -8.375
  362    HA   ARG  50           HA       ARG  50   4.093  17.743  -7.979
  363    HB2  ARG  50           HB3      ARG  50   4.426  16.688 -10.078
  364    HB3  ARG  50           HB2      ARG  50   4.766  18.386 -10.352
  365    HG2  ARG  50           HG3      ARG  50   7.210  17.808 -10.060
  366    HG3  ARG  50           HG2      ARG  50   6.716  16.118 -10.147
  367    HD2  ARG  50           HD3      ARG  50   6.632  18.233 -12.257
  368    HD3  ARG  50           HD2      ARG  50   7.258  16.590 -12.350
  369    HE   ARG  50           HE       ARG  50   4.364  17.165 -12.168
  370   HH11  ARG  50          HH11      ARG  50   7.063  15.554 -13.743
  371   HH12  ARG  50          HH12      ARG  50   6.050  14.689 -14.851
  372   HH21  ARG  50          HH21      ARG  50   3.061  16.031 -13.605
  373   HH22  ARG  50          HH22      ARG  50   3.761  14.950 -14.775
  374    H    GLN  51           H        GLN  51   4.225  15.535  -7.397
  375    HA   GLN  51           HA       GLN  51   6.893  14.567  -6.670
  376    HB2  GLN  51           HB3      GLN  51   6.118  13.817  -4.468
  377    HB3  GLN  51           HB2      GLN  51   5.986  15.559  -4.635
  378    HG2  GLN  51           HG3      GLN  51   3.651  13.728  -5.084
  379    HG3  GLN  51           HG2      GLN  51   4.082  14.328  -3.488
  380   HE21  GLN  51          HE21      GLN  51   4.950  16.933  -4.552
  381   HE22  GLN  51          HE22      GLN  51   3.496  17.791  -4.943
  382    H    TYR  52           H        TYR  52   4.178  14.017  -8.324
  383    HA   TYR  52           HA       TYR  52   3.362  12.246  -9.471
  384    HB2  TYR  52           HB3      TYR  52   5.565  10.569  -8.251
  385    HB3  TYR  52           HB2      TYR  52   4.666  10.237  -9.725
  386    HD1  TYR  52           HD1      TYR  52   4.836  13.149 -10.792
  387    HD2  TYR  52           HD2      TYR  52   7.733  10.459  -9.217
  388    HE1  TYR  52           HE1      TYR  52   6.586  14.281 -12.087
  389    HE2  TYR  52           HE2      TYR  52   9.491  11.592 -10.508
  390    HH   TYR  52           HH       TYR  52   9.633  12.991 -12.589
  391    H    PHE  53           H        PHE  53   2.589   9.849  -9.089
  392    HA   PHE  53           HA       PHE  53   1.597   9.634  -6.319
  393    HB2  PHE  53           HB3      PHE  53   0.028   9.022  -8.841
  394    HB3  PHE  53           HB2      PHE  53  -0.566   8.887  -7.188
  395    HD1  PHE  53           HD1      PHE  53  -1.008  10.893  -5.862
  396    HD2  PHE  53           HD2      PHE  53   0.190  11.137  -9.934
  397    HE1  PHE  53           HE1      PHE  53  -1.733  13.244  -5.929
  398    HE2  PHE  53           HE2      PHE  53  -0.534  13.485 -10.013
  399    HZ   PHE  53           HZ       PHE  53  -1.492  14.543  -8.008
  400    H    PHE  54           H        PHE  54   2.007   7.725  -5.389
  401    HA   PHE  54           HA       PHE  54   3.291   5.661  -6.965
  402    HB2  PHE  54           HB3      PHE  54   4.236   6.292  -4.782
  403    HB3  PHE  54           HB2      PHE  54   2.736   5.827  -3.989
  404    HD1  PHE  54           HD1      PHE  54   2.381   3.615  -3.295
  405    HD2  PHE  54           HD2      PHE  54   5.572   4.506  -5.970
  406    HE1  PHE  54           HE1      PHE  54   3.248   1.331  -3.016
  407    HE2  PHE  54           HE2      PHE  54   6.445   2.223  -5.695
  408    HZ   PHE  54           HZ       PHE  54   5.284   0.630  -4.220
  409    H    GLU  55           H        GLU  55   2.000   4.335  -8.067
  410    HA   GLU  55           HA       GLU  55  -0.266   3.131  -6.615
  411    HB2  GLU  55           HB3      GLU  55  -0.111   3.753  -9.575
  412    HB3  GLU  55           HB2      GLU  55  -1.416   2.869  -8.796
  413    HG2  GLU  55           HG3      GLU  55  -1.790   4.939  -7.380
  414    HG3  GLU  55           HG2      GLU  55  -0.696   5.771  -8.492
  415    H    THR  56           H        THR  56  -0.408   0.971  -6.636
  416    HA   THR  56           HA       THR  56   1.589  -0.506  -8.219
  417    HB   THR  56           HB       THR  56   0.410  -1.332  -5.557
  418    HG1  THR  56           HG1      THR  56   1.930  -0.143  -4.713
  419   HG21  THR  56          HG21      THR  56   2.200  -3.029  -5.597
  420   HG22  THR  56          HG22      THR  56   2.651  -2.495  -7.217
  421   HG23  THR  56          HG23      THR  56   1.067  -3.220  -6.935
  422    H    LYS  57           H        LYS  57   0.609  -1.500  -9.848
  423    HA   LYS  57           HA       LYS  57  -2.229  -2.222  -9.551
  424    HB2  LYS  57           HB3      LYS  57  -1.619  -0.606 -11.340
  425    HB3  LYS  57           HB2      LYS  57  -0.584  -1.831 -12.062
  426    HG2  LYS  57           HG3      LYS  57  -2.501  -3.226 -12.524
  427    HG3  LYS  57           HG2      LYS  57  -3.561  -2.083 -11.703
  428    HD2  LYS  57           HD3      LYS  57  -1.904  -1.424 -14.126
  429    HD3  LYS  57           HD2      LYS  57  -3.603  -1.894 -14.180
  430    HE2  LYS  57           HE3      LYS  57  -2.480   0.505 -12.746
  431    HE3  LYS  57           HE2      LYS  57  -3.330   0.532 -14.287
  432    HZ1  LYS  57           HZ1      LYS  57  -4.494  -0.367 -11.709
  433    HZ2  LYS  57           HZ2      LYS  57  -5.306  -0.295 -13.187
  434    HZ3  LYS  57           HZ3      LYS  57  -4.780   1.128 -12.442
  435    H    CYS  58           H        CYS  58  -2.968  -4.262 -10.117
  436    HA   CYS  58           HA       CYS  58  -1.117  -6.421  -9.883
  437    HB2  CYS  58           HB3      CYS  58  -4.031  -6.463 -10.715
  438    HB3  CYS  58           HB2      CYS  58  -3.079  -7.869 -10.257
  439    H    ARG  59           H        ARG  59   0.077  -7.270 -11.427
  440    HA   ARG  59           HA       ARG  59  -0.342  -6.615 -14.205
  441    HB2  ARG  59           HB3      ARG  59   1.661  -8.371 -12.778
  442    HB3  ARG  59           HB2      ARG  59   1.644  -8.158 -14.519
  443    HG2  ARG  59           HG3      ARG  59   2.171  -5.851 -14.324
  444    HG3  ARG  59           HG2      ARG  59   1.919  -5.879 -12.580
  445    HD2  ARG  59           HD3      ARG  59   4.317  -5.905 -13.284
  446    HD3  ARG  59           HD2      ARG  59   3.840  -7.245 -12.246
  447    HE   ARG  59           HE       ARG  59   3.661  -7.864 -15.040
  448   HH11  ARG  59          HH11      ARG  59   5.853  -7.694 -12.310
  449   HH12  ARG  59          HH12      ARG  59   6.943  -8.876 -12.959
  450   HH21  ARG  59          HH21      ARG  59   5.080  -9.431 -15.878
  451   HH22  ARG  59          HH22      ARG  59   6.497  -9.875 -14.978
  452    H    ALA  60           H        ALA  60  -2.323  -7.509 -14.680
  453    HA   ALA  60           HA       ALA  60  -3.832  -9.054 -15.372
  454    HB1  ALA  60           HB1      ALA  60  -1.988 -10.227 -16.495
  455    HB2  ALA  60           HB2      ALA  60  -3.182 -11.351 -15.843
  456    HB3  ALA  60           HB3      ALA  60  -1.650 -11.108 -15.005
  457    H    SER  61           H        SER  61  -5.438 -10.196 -14.378
  458    HA   SER  61           HA       SER  61  -5.375 -10.061 -11.527
  459    HB2  SER  61           HB3      SER  61  -7.530 -11.094 -13.378
  460    HB3  SER  61           HB2      SER  61  -7.733 -10.719 -11.667
  461    HG   SER  61           HG       SER  61  -6.982  -8.537 -12.279
  462    H    ASN  62           H        ASN  62  -4.327 -12.405 -13.608
  463    HA   ASN  62           HA       ASN  62  -4.224 -14.362 -11.467
  464    HB2  ASN  62           HB3      ASN  62  -5.623 -14.840 -14.083
  465    HB3  ASN  62           HB2      ASN  62  -4.794 -16.167 -13.282
  466   HD21  ASN  62          HD21      ASN  62  -5.431 -15.279 -10.600
  467   HD22  ASN  62          HD22      ASN  62  -7.116 -15.588 -10.368
  468    HA   PRO  63           HA       PRO  63  -0.147 -14.255 -13.536
  469    HB2  PRO  63           HB3      PRO  63   1.091 -15.659 -11.514
  470    HB3  PRO  63           HB2      PRO  63   0.914 -13.898 -11.531
  471    HG2  PRO  63           HG3      PRO  63  -0.717 -15.966 -10.119
  472    HG3  PRO  63           HG2      PRO  63  -0.175 -14.384  -9.538
  473    HD2  PRO  63           HD3      PRO  63  -2.704 -14.789 -10.381
  474    HD3  PRO  63           HD2      PRO  63  -1.862 -13.245 -10.670
  475    H    VAL  64           H        VAL  64  -1.781 -16.959 -11.967
  476    HA   VAL  64           HA       VAL  64  -0.773 -18.718 -14.099
  477    HB   VAL  64           HB       VAL  64  -1.045 -20.631 -12.547
  478   HG11  VAL  64          HG11      VAL  64   0.814 -18.465 -11.584
  479   HG12  VAL  64          HG12      VAL  64   1.156 -19.678 -12.818
  480   HG13  VAL  64          HG13      VAL  64   0.925 -20.168 -11.140
  481   HG21  VAL  64          HG21      VAL  64  -1.532 -18.503 -10.471
  482   HG22  VAL  64          HG22      VAL  64  -1.249 -20.209 -10.134
  483   HG23  VAL  64          HG23      VAL  64  -2.688 -19.714 -11.025
  484    H    GLU  65           H        GLU  65  -2.286 -20.384 -14.786
  485    HA   GLU  65           HA       GLU  65  -4.919 -19.251 -15.050
  486    HB2  GLU  65           HB3      GLU  65  -3.631 -20.362 -16.913
  487    HB3  GLU  65           HB2      GLU  65  -3.937 -21.898 -16.112
  488    HG2  GLU  65           HG3      GLU  65  -6.348 -21.504 -16.317
  489    HG3  GLU  65           HG2      GLU  65  -6.015 -20.004 -17.181
  490    H    SER  66           H        SER  66  -5.096 -19.512 -12.633
  491    HA   SER  66           HA       SER  66  -7.071 -21.385 -12.012
  492    HB2  SER  66           HB3      SER  66  -5.849 -22.784 -10.357
  493    HB3  SER  66           HB2      SER  66  -5.262 -23.043 -12.001
  494    HG   SER  66           HG       SER  66  -3.909 -22.237  -9.833
  495    H    GLY  67           H        GLY  67  -4.592 -19.159 -11.062
  496    HA2  GLY  67           HA3      GLY  67  -6.126 -17.420  -9.655
  497    HA3  GLY  67           HA2      GLY  67  -5.673 -18.629  -8.457
  498    H    CYS  68           H        CYS  68  -3.880 -18.238  -7.364
  499    HA   CYS  68           HA       CYS  68  -1.875 -16.438  -8.557
  500    HB2  CYS  68           HB3      CYS  68  -2.657 -16.783  -5.649
  501    HB3  CYS  68           HB2      CYS  68  -1.309 -15.789  -6.209
  502    H    ARG  69           H        ARG  69   0.355 -16.773  -7.567
  503    HA   ARG  69           HA       ARG  69   1.067 -19.513  -8.000
  504    HB2  ARG  69           HB3      ARG  69   2.725 -17.140  -7.104
  505    HB3  ARG  69           HB2      ARG  69   3.389 -18.728  -7.470
  506    HG2  ARG  69           HG3      ARG  69   2.588 -18.517  -9.779
  507    HG3  ARG  69           HG2      ARG  69   1.949 -16.919  -9.396
  508    HD2  ARG  69           HD3      ARG  69   4.849 -17.708  -9.149
  509    HD3  ARG  69           HD2      ARG  69   4.158 -16.843 -10.524
  510    HE   ARG  69           HE       ARG  69   4.229 -15.768  -7.772
  511   HH11  ARG  69          HH11      ARG  69   4.416 -15.356 -11.239
  512   HH12  ARG  69          HH12      ARG  69   4.745 -13.649 -11.154
  513   HH21  ARG  69          HH21      ARG  69   4.688 -13.511  -7.649
  514   HH22  ARG  69          HH22      ARG  69   4.929 -12.613  -9.127
  515    H    GLY  70           H        GLY  70   1.409 -21.087  -6.549
  516    HA2  GLY  70           HA3      GLY  70   2.187 -21.960  -4.489
  517    HA3  GLY  70           HA2      GLY  70   1.965 -20.373  -3.763
  518    H    ILE  71           H        ILE  71  -0.712 -20.024  -4.803
  519    HA   ILE  71           HA       ILE  71  -2.146 -21.076  -2.624
  520    HB   ILE  71           HB       ILE  71  -3.199 -19.923  -5.208
  521   HG12  ILE  71          HG13      ILE  71  -1.748 -18.361  -3.994
  522   HG13  ILE  71          HG12      ILE  71  -3.426 -17.834  -3.935
  523   HG21  ILE  71          HG21      ILE  71  -4.592 -20.313  -2.563
  524   HG22  ILE  71          HG22      ILE  71  -4.886 -21.239  -4.035
  525   HG23  ILE  71          HG23      ILE  71  -5.267 -19.517  -3.985
  526   HD11  ILE  71          HD11      ILE  71  -2.341 -17.515  -1.798
  527   HD12  ILE  71          HD12      ILE  71  -1.928 -19.227  -1.728
  528   HD13  ILE  71          HD13      ILE  71  -3.616 -18.724  -1.664
  529    H    ASP  72           H        ASP  72  -3.204 -22.916  -2.334
  530    HA   ASP  72           HA       ASP  72  -3.275 -24.999  -4.254
  531    HB2  ASP  72           HB3      ASP  72  -3.355 -25.365  -1.784
  532    HB3  ASP  72           HB2      ASP  72  -4.979 -24.682  -1.767
  533    H    SER  73           H        SER  73  -4.401 -24.800  -6.070
  534    HA   SER  73           HA       SER  73  -6.635 -23.002  -6.245
  535    HB2  SER  73           HB3      SER  73  -5.477 -24.845  -8.350
  536    HB3  SER  73           HB2      SER  73  -6.567 -23.484  -8.631
  537    HG   SER  73           HG       SER  73  -4.369 -22.775  -7.185
  538    H    LYS  74           H        LYS  74  -6.460 -26.060  -5.126
  539    HA   LYS  74           HA       LYS  74  -8.938 -27.003  -6.331
  540    HB2  LYS  74           HB3      LYS  74  -7.243 -28.255  -4.158
  541    HB3  LYS  74           HB2      LYS  74  -8.584 -29.022  -4.987
  542    HG2  LYS  74           HG3      LYS  74  -7.303 -28.836  -7.111
  543    HG3  LYS  74           HG2      LYS  74  -5.939 -28.222  -6.176
  544    HD2  LYS  74           HD3      LYS  74  -7.259 -30.908  -5.831
  545    HD3  LYS  74           HD2      LYS  74  -5.703 -30.613  -6.603
  546    HE2  LYS  74           HE3      LYS  74  -4.847 -29.721  -4.479
  547    HE3  LYS  74           HE2      LYS  74  -6.397 -30.065  -3.722
  548    HZ1  LYS  74           HZ1      LYS  74  -4.558 -32.074  -4.898
  549    HZ2  LYS  74           HZ2      LYS  74  -6.062 -32.413  -4.209
  550    HZ3  LYS  74           HZ3      LYS  74  -4.812 -31.805  -3.247
  551    H    HIS  75           H        HIS  75  -7.650 -25.918  -3.245
  552    HA   HIS  75           HA       HIS  75 -10.254 -26.026  -1.970
  553    HB2  HIS  75           HB3      HIS  75  -7.515 -25.172  -1.039
  554    HB3  HIS  75           HB2      HIS  75  -8.950 -24.919  -0.055
  555    HD1  HIS  75           HD1      HIS  75  -9.504 -26.759   1.488
  556    HD2  HIS  75           HD2      HIS  75  -7.172 -28.061  -1.696
  557    HE1  HIS  75           HE1      HIS  75  -8.994 -29.175   1.968
  558    HE2  HIS  75           HE2      HIS  75  -7.488 -29.909   0.086
  559    H    TRP  76           H        TRP  76  -8.185 -23.653  -3.492
  560    HA   TRP  76           HA       TRP  76 -10.220 -21.600  -2.948
  561    HB2  TRP  76           HB3      TRP  76  -7.234 -21.204  -2.643
  562    HB3  TRP  76           HB2      TRP  76  -8.460 -19.949  -2.468
  563    HD1  TRP  76           HD1      TRP  76  -6.517 -22.390  -0.506
  564    HE1  TRP  76           HE1      TRP  76  -7.426 -22.556   1.893
  565    HE3  TRP  76           HE3      TRP  76 -10.954 -19.934  -1.136
  566    HZ2  TRP  76           HZ2      TRP  76  -9.714 -21.758   3.332
  567    HZ3  TRP  76           HZ3      TRP  76 -12.449 -19.680   0.801
  568    HH2  TRP  76           HH2      TRP  76 -11.841 -20.575   2.991
  569    H    ASN  77           H        ASN  77 -10.823 -20.551  -4.792
  570    HA   ASN  77           HA       ASN  77  -8.947 -20.486  -7.033
  571    HB2  ASN  77           HB3      ASN  77 -11.298 -20.920  -7.596
  572    HB3  ASN  77           HB2      ASN  77 -11.781 -19.435  -6.789
  573   HD21  ASN  77          HD21      ASN  77 -10.161 -20.788  -9.567
  574   HD22  ASN  77          HD22      ASN  77 -10.220 -19.357 -10.538
  575    H    SER  78           H        SER  78  -7.906 -18.606  -7.653
  576    HA   SER  78           HA       SER  78  -7.963 -16.565  -5.539
  577    HB2  SER  78           HB3      SER  78  -5.582 -16.986  -7.292
  578    HB3  SER  78           HB2      SER  78  -5.660 -16.430  -5.622
  579    HG   SER  78           HG       SER  78  -6.626 -18.812  -5.513
  580    H    TYR  79           H        TYR  79  -7.661 -14.411  -6.062
  581    HA   TYR  79           HA       TYR  79  -7.584 -13.615  -8.860
  582    HB2  TYR  79           HB3      TYR  79  -9.988 -13.835  -8.382
  583    HB3  TYR  79           HB2      TYR  79  -9.815 -12.808  -6.963
  584    HD1  TYR  79           HD1      TYR  79  -9.693 -10.407  -7.184
  585    HD2  TYR  79           HD2      TYR  79  -9.876 -12.884 -10.638
  586    HE1  TYR  79           HE1      TYR  79 -10.207  -8.438  -8.558
  587    HE2  TYR  79           HE2      TYR  79 -10.382 -10.917 -12.023
  588    HH   TYR  79           HH       TYR  79 -11.367  -8.656 -11.716
  589    H    CYS  80           H        CYS  80  -6.407 -11.779  -9.108
  590    HA   CYS  80           HA       CYS  80  -5.127 -10.690  -6.762
  591    HB2  CYS  80           HB3      CYS  80  -4.835  -9.804  -9.641
  592    HB3  CYS  80           HB2      CYS  80  -3.720  -9.478  -8.312
  593    H    THR  81           H        THR  81  -5.754  -8.954  -5.676
  594    HA   THR  81           HA       THR  81  -7.559  -7.036  -6.992
  595    HB   THR  81           HB       THR  81  -7.810  -7.976  -4.123
  596    HG1  THR  81           HG1      THR  81  -8.473  -9.333  -6.199
  597   HG21  THR  81          HG21      THR  81  -9.648  -6.288  -5.827
  598   HG22  THR  81          HG22      THR  81  -8.617  -5.691  -4.528
  599   HG23  THR  81          HG23      THR  81  -9.944  -6.791  -4.165
  600    H    THR  82           H        THR  82  -6.903  -4.968  -6.784
  601    HA   THR  82           HA       THR  82  -4.498  -4.417  -5.319
  602    HB   THR  82           HB       THR  82  -5.121  -2.010  -6.174
  603    HG1  THR  82           HG1      THR  82  -6.728  -1.920  -7.543
  604   HG21  THR  82          HG21      THR  82  -3.222  -3.296  -6.978
  605   HG22  THR  82          HG22      THR  82  -4.058  -2.537  -8.333
  606   HG23  THR  82          HG23      THR  82  -4.284  -4.255  -8.008
  607    H    THR  83           H        THR  83  -4.274  -3.372  -3.427
  608    HA   THR  83           HA       THR  83  -6.607  -3.002  -1.808
  609    HB   THR  83           HB       THR  83  -4.853  -2.098  -0.143
  610    HG1  THR  83           HG1      THR  83  -2.761  -2.379  -0.670
  611   HG21  THR  83          HG21      THR  83  -4.682  -4.933  -1.168
  612   HG22  THR  83          HG22      THR  83  -5.829  -4.322   0.025
  613   HG23  THR  83          HG23      THR  83  -4.107  -4.378   0.405
  614    H    HIS  84           H        HIS  84  -7.481  -1.157  -1.077
  615    HA   HIS  84           HA       HIS  84  -6.862   1.202  -2.707
  616    HB2  HIS  84           HB3      HIS  84  -9.268   1.858  -1.992
  617    HB3  HIS  84           HB2      HIS  84  -9.076   0.580  -3.190
  618    HD1  HIS  84           HD1      HIS  84 -10.438   1.259   0.184
  619    HD2  HIS  84           HD2      HIS  84  -9.618  -2.056  -2.185
  620    HE1  HIS  84           HE1      HIS  84 -11.638  -0.660   1.267
  621    HE2  HIS  84           HE2      HIS  84 -10.885  -2.692  -0.021
  622    H    THR  85           H        THR  85  -5.884   2.836  -1.737
  623    HA   THR  85           HA       THR  85  -6.564   3.357   1.089
  624    HB   THR  85           HB       THR  85  -4.225   2.457   0.829
  625    HG1  THR  85           HG1      THR  85  -3.436   3.902   2.303
  626   HG21  THR  85          HG21      THR  85  -2.510   3.925  -0.119
  627   HG22  THR  85          HG22      THR  85  -3.757   5.073  -0.608
  628   HG23  THR  85          HG23      THR  85  -3.699   3.470  -1.339
  629    H    PHE  86           H        PHE  86  -6.191   5.699   1.684
  630    HA   PHE  86           HA       PHE  86  -7.012   7.361  -0.602
  631    HB2  PHE  86           HB3      PHE  86  -7.711   7.660   2.333
  632    HB3  PHE  86           HB2      PHE  86  -8.134   8.830   1.080
  633    HD1  PHE  86           HD1      PHE  86  -9.618   8.061  -0.821
  634    HD2  PHE  86           HD2      PHE  86  -9.070   5.811   2.750
  635    HE1  PHE  86           HE1      PHE  86 -11.688   6.820  -1.293
  636    HE2  PHE  86           HE2      PHE  86 -11.139   4.565   2.287
  637    HZ   PHE  86           HZ       PHE  86 -12.450   5.067   0.264
  638    H    VAL  87           H        VAL  87  -5.601   8.817  -1.238
  639    HA   VAL  87           HA       VAL  87  -3.574   9.723   0.700
  640    HB   VAL  87           HB       VAL  87  -2.121  10.196  -1.277
  641   HG11  VAL  87          HG11      VAL  87  -1.804   8.188   0.046
  642   HG12  VAL  87          HG12      VAL  87  -1.497   7.854  -1.658
  643   HG13  VAL  87          HG13      VAL  87  -3.013   7.340  -0.919
  644   HG21  VAL  87          HG21      VAL  87  -2.644   9.157  -3.415
  645   HG22  VAL  87          HG22      VAL  87  -3.879  10.338  -2.977
  646   HG23  VAL  87          HG23      VAL  87  -4.199   8.614  -2.783
  647    H    LYS  88           H        LYS  88  -2.839  11.868   0.563
  648    HA   LYS  88           HA       LYS  88  -4.937  13.766   0.022
  649    HB2  LYS  88           HB3      LYS  88  -2.099  14.254   0.969
  650    HB3  LYS  88           HB2      LYS  88  -3.433  15.398   1.032
  651    HG2  LYS  88           HG3      LYS  88  -4.570  14.085   2.670
  652    HG3  LYS  88           HG2      LYS  88  -3.408  12.774   2.497
  653    HD2  LYS  88           HD3      LYS  88  -1.634  14.287   3.318
  654    HD3  LYS  88           HD2      LYS  88  -2.857  15.535   3.572
  655    HE2  LYS  88           HE3      LYS  88  -3.983  14.190   5.199
  656    HE3  LYS  88           HE2      LYS  88  -2.954  12.806   4.839
  657    HZ1  LYS  88           HZ1      LYS  88  -2.291  13.915   6.878
  658    HZ2  LYS  88           HZ2      LYS  88  -2.041  15.363   6.037
  659    HZ3  LYS  88           HZ3      LYS  88  -1.066  14.020   5.710
  660    H    ALA  89           H        ALA  89  -5.259  14.321  -2.033
  661    HA   ALA  89           HA       ALA  89  -2.895  15.072  -3.628
  662    HB1  ALA  89           HB1      ALA  89  -5.328  13.610  -4.653
  663    HB2  ALA  89           HB2      ALA  89  -3.732  12.901  -4.396
  664    HB3  ALA  89           HB3      ALA  89  -3.955  14.154  -5.619
  665    H    LEU  90           H        LEU  90  -3.132  16.849  -4.942
  666    HA   LEU  90           HA       LEU  90  -5.287  18.628  -4.247
  667    HB2  LEU  90           HB3      LEU  90  -2.927  19.402  -4.545
  668    HB3  LEU  90           HB2      LEU  90  -3.055  19.006  -6.253
  669    HG   LEU  90           HG       LEU  90  -4.967  20.662  -6.381
  670   HD11  LEU  90          HD11      LEU  90  -5.538  20.802  -4.043
  671   HD12  LEU  90          HD12      LEU  90  -5.015  22.385  -4.617
  672   HD13  LEU  90          HD13      LEU  90  -3.924  21.393  -3.650
  673   HD21  LEU  90          HD21      LEU  90  -2.258  21.711  -5.583
  674   HD22  LEU  90          HD22      LEU  90  -3.480  22.582  -6.511
  675   HD23  LEU  90          HD23      LEU  90  -2.712  21.147  -7.192
  676    H    THR  91           H        THR  91  -7.032  19.069  -5.461
  677    HA   THR  91           HA       THR  91  -7.165  17.914  -8.167
  678    HB   THR  91           HB       THR  91  -9.529  17.331  -7.753
  679    HG1  THR  91           HG1      THR  91  -8.910  18.474  -5.251
  680   HG21  THR  91          HG21      THR  91  -7.882  15.582  -7.430
  681   HG22  THR  91          HG22      THR  91  -9.140  15.431  -6.204
  682   HG23  THR  91          HG23      THR  91  -7.577  16.130  -5.783
  683    H    THR  92           H        THR  92  -8.775  18.978  -9.551
  684    HA   THR  92           HA       THR  92  -9.144  21.771  -8.752
  685    HB   THR  92           HB       THR  92  -8.042  21.607 -10.871
  686    HG1  THR  92           HG1      THR  92  -9.268  23.075 -11.783
  687   HG21  THR  92          HG21      THR  92  -9.074  20.495 -12.815
  688   HG22  THR  92          HG22      THR  92 -10.331  19.855 -11.756
  689   HG23  THR  92          HG23      THR  92  -8.653  19.364 -11.529
  690    H    ASP  93           H        ASP  93 -10.963  22.164  -7.771
  691    HA   ASP  93           HA       ASP  93 -13.219  20.435  -7.886
  692    HB2  ASP  93           HB3      ASP  93 -12.701  21.754  -5.877
  693    HB3  ASP  93           HB2      ASP  93 -12.969  23.244  -6.777
  694    H    GLU  94           H        GLU  94 -12.312  23.412  -9.432
  695    HA   GLU  94           HA       GLU  94 -13.894  22.972 -11.695
  696    HB2  GLU  94           HB3      GLU  94 -15.737  23.640 -10.134
  697    HB3  GLU  94           HB2      GLU  94 -14.939  25.190  -9.914
  698    HG2  GLU  94           HG3      GLU  94 -15.190  25.626 -12.324
  699    HG3  GLU  94           HG2      GLU  94 -16.056  24.102 -12.483
  700    H    LYS  95           H        LYS  95 -13.290  26.007  -9.959
  701    HA   LYS  95           HA       LYS  95 -11.288  26.696 -12.003
  702    HB2  LYS  95           HB3      LYS  95 -12.705  28.558 -10.085
  703    HB3  LYS  95           HB2      LYS  95 -11.671  29.021 -11.426
  704    HG2  LYS  95           HG3      LYS  95 -13.326  28.021 -12.980
  705    HG3  LYS  95           HG2      LYS  95 -14.379  27.719 -11.596
  706    HD2  LYS  95           HD3      LYS  95 -14.295  30.159 -11.095
  707    HD3  LYS  95           HD2      LYS  95 -13.422  30.388 -12.611
  708    HE2  LYS  95           HE3      LYS  95 -15.686  30.848 -13.094
  709    HE3  LYS  95           HE2      LYS  95 -15.363  29.246 -13.750
  710    HZ1  LYS  95           HZ1      LYS  95 -17.480  29.366 -12.565
  711    HZ2  LYS  95           HZ2      LYS  95 -16.670  29.782 -11.140
  712    HZ3  LYS  95           HZ3      LYS  95 -16.430  28.257 -11.835
  713    H    GLN  96           H        GLN  96 -11.829  26.045  -8.681
  714    HA   GLN  96           HA       GLN  96  -9.224  27.125  -7.900
  715    HB2  GLN  96           HB3      GLN  96 -11.506  26.146  -6.166
  716    HB3  GLN  96           HB2      GLN  96 -10.015  26.865  -5.586
  717    HG2  GLN  96           HG3      GLN  96 -11.648  28.542  -5.457
  718    HG3  GLN  96           HG2      GLN  96 -10.652  28.941  -6.855
  719   HE21  GLN  96          HE21      GLN  96 -12.233  30.157  -7.835
  720   HE22  GLN  96          HE22      GLN  96 -13.658  29.466  -8.523
  721    H    ALA  97           H        ALA  97  -7.755  25.837  -6.733
  722    HA   ALA  97           HA       ALA  97  -8.064  22.959  -7.176
  723    HB1  ALA  97           HB1      ALA  97  -6.010  24.023  -8.013
  724    HB2  ALA  97           HB2      ALA  97  -5.674  22.801  -6.787
  725    HB3  ALA  97           HB3      ALA  97  -5.606  24.513  -6.368
  726    H    ALA  98           H        ALA  98  -8.506  21.632  -5.548
  727    HA   ALA  98           HA       ALA  98  -8.114  22.588  -2.795
  728    HB1  ALA  98           HB1      ALA  98 -10.473  22.850  -3.400
  729    HB2  ALA  98           HB2      ALA  98 -10.263  21.612  -2.162
  730    HB3  ALA  98           HB3      ALA  98 -10.551  21.142  -3.836
  731    H    TRP  99           H        TRP  99  -7.474  21.067  -1.329
  732    HA   TRP  99           HA       TRP  99  -6.311  18.659  -2.386
  733    HB2  TRP  99           HB3      TRP  99  -6.482  19.753   0.431
  734    HB3  TRP  99           HB2      TRP  99  -5.620  18.282   0.000
  735    HD1  TRP  99           HD1      TRP  99  -5.443  22.090  -0.478
  736    HE1  TRP  99           HE1      TRP  99  -3.026  22.715  -1.109
  737    HE3  TRP  99           HE3      TRP  99  -3.503  17.393  -0.994
  738    HZ2  TRP  99           HZ2      TRP  99  -0.615  21.387  -1.734
  739    HZ3  TRP  99           HZ3      TRP  99  -1.129  17.155  -1.606
  740    HH2  TRP  99           HH2      TRP  99   0.282  19.113  -1.969
  741    H    ARG 100           H        ARG 100  -7.209  16.720  -2.469
  742    HA   ARG 100           HA       ARG 100  -9.527  16.161  -0.736
  743    HB2  ARG 100           HB3      ARG 100  -9.051  15.155  -3.556
  744    HB3  ARG 100           HB2      ARG 100 -10.415  14.723  -2.536
  745    HG2  ARG 100           HG3      ARG 100  -9.806  17.482  -3.570
  746    HG3  ARG 100           HG2      ARG 100 -10.997  16.374  -4.239
  747    HD2  ARG 100           HD3      ARG 100 -12.157  16.392  -2.038
  748    HD3  ARG 100           HD2      ARG 100 -11.020  17.630  -1.502
  749    HE   ARG 100           HE       ARG 100 -12.521  18.186  -3.935
  750   HH11  ARG 100          HH11      ARG 100 -12.164  18.715  -0.486
  751   HH12  ARG 100          HH12      ARG 100 -13.185  20.118  -0.474
  752   HH21  ARG 100          HH21      ARG 100 -13.854  20.021  -3.914
  753   HH22  ARG 100          HH22      ARG 100 -14.140  20.864  -2.425
  754    H    PHE 101           H        PHE 101  -9.908  13.729  -0.632
  755    HA   PHE 101           HA       PHE 101  -7.313  12.360  -0.302
  756    HB2  PHE 101           HB3      PHE 101  -9.915  11.893   1.198
  757    HB3  PHE 101           HB2      PHE 101  -8.431  10.977   1.426
  758    HD1  PHE 101           HD1      PHE 101 -10.135  14.151   2.058
  759    HD2  PHE 101           HD2      PHE 101  -6.543  11.931   2.583
  760    HE1  PHE 101           HE1      PHE 101  -9.392  15.763   3.762
  761    HE2  PHE 101           HE2      PHE 101  -5.795  13.538   4.283
  762    HZ   PHE 101           HZ       PHE 101  -7.219  15.456   4.876
  763    H    ILE 102           H        ILE 102  -7.040  11.006  -1.984
  764    HA   ILE 102           HA       ILE 102  -9.493   9.948  -3.235
  765    HB   ILE 102           HB       ILE 102  -8.197   9.809  -5.348
  766   HG12  ILE 102          HG13      ILE 102  -6.127  11.481  -3.918
  767   HG13  ILE 102          HG12      ILE 102  -5.946   9.758  -4.222
  768   HG21  ILE 102          HG21      ILE 102  -8.222  12.220  -5.831
  769   HG22  ILE 102          HG22      ILE 102  -8.384  12.548  -4.105
  770   HG23  ILE 102          HG23      ILE 102  -9.664  11.690  -4.965
  771   HD11  ILE 102          HD11      ILE 102  -4.740  11.057  -5.867
  772   HD12  ILE 102          HD12      ILE 102  -6.220  11.911  -6.307
  773   HD13  ILE 102          HD13      ILE 102  -6.069  10.183  -6.629
  774    H    ARG 103           H        ARG 103  -9.604   7.871  -3.887
  775    HA   ARG 103           HA       ARG 103  -7.944   6.012  -2.454
  776    HB2  ARG 103           HB3      ARG 103  -9.402   4.282  -3.441
  777    HB3  ARG 103           HB2      ARG 103 -10.341   5.570  -2.694
  778    HG2  ARG 103           HG3      ARG 103 -10.828   6.527  -4.848
  779    HG3  ARG 103           HG2      ARG 103  -9.767   5.367  -5.640
  780    HD2  ARG 103           HD3      ARG 103 -11.247   3.539  -4.868
  781    HD3  ARG 103           HD2      ARG 103 -12.332   4.749  -4.173
  782    HE   ARG 103           HE       ARG 103 -11.906   5.403  -6.857
  783   HH11  ARG 103          HH11      ARG 103 -13.432   2.876  -4.978
  784   HH12  ARG 103          HH12      ARG 103 -14.630   2.536  -6.180
  785   HH21  ARG 103          HH21      ARG 103 -13.473   4.973  -8.431
  786   HH22  ARG 103          HH22      ARG 103 -14.645   3.721  -8.165
  787    H    ILE 104           H        ILE 104  -6.125   5.181  -3.157
  788    HA   ILE 104           HA       ILE 104  -5.788   4.820  -6.055
  789    HB   ILE 104           HB       ILE 104  -3.353   5.043  -5.765
  790   HG12  ILE 104          HG13      ILE 104  -3.964   6.011  -2.972
  791   HG13  ILE 104          HG12      ILE 104  -3.355   4.403  -3.335
  792   HG21  ILE 104          HG21      ILE 104  -4.617   6.983  -6.471
  793   HG22  ILE 104          HG22      ILE 104  -3.285   7.475  -5.423
  794   HG23  ILE 104          HG23      ILE 104  -4.931   7.415  -4.792
  795   HD11  ILE 104          HD11      ILE 104  -1.334   5.361  -4.265
  796   HD12  ILE 104          HD12      ILE 104  -1.586   5.907  -2.608
  797   HD13  ILE 104          HD13      ILE 104  -1.947   6.985  -3.956
  798    H    ASP 105           H        ASP 105  -4.717   2.977  -6.728
  799    HA   ASP 105           HA       ASP 105  -4.971   0.654  -5.042
  800    HB2  ASP 105           HB3      ASP 105  -3.731   0.938  -7.803
  801    HB3  ASP 105           HB2      ASP 105  -4.178  -0.576  -7.019
  802    H    THR 106           H        THR 106  -3.470   0.528  -3.438
  803    HA   THR 106           HA       THR 106  -0.833   1.677  -3.974
  804    HB   THR 106           HB       THR 106  -1.979   2.488  -1.986
  805    HG1  THR 106           HG1      THR 106   0.463   1.210  -1.923
  806   HG21  THR 106          HG21      THR 106  -3.310   0.531  -1.430
  807   HG22  THR 106          HG22      THR 106  -2.323   1.001  -0.048
  808   HG23  THR 106          HG23      THR 106  -1.850  -0.378  -1.039
  809    H    ALA 107           H        ALA 107  -2.281  -1.408  -3.649
  810    HA   ALA 107           HA       ALA 107   0.231  -2.710  -4.111
  811    HB1  ALA 107           HB1      ALA 107  -1.224  -3.310  -1.535
  812    HB2  ALA 107           HB2      ALA 107   0.321  -2.469  -1.667
  813    HB3  ALA 107           HB3      ALA 107   0.192  -4.160  -2.152
  814    H    CYS 108           H        CYS 108  -0.179  -5.186  -4.159
  815    HA   CYS 108           HA       CYS 108  -2.922  -5.676  -5.109
  816    HB2  CYS 108           HB3      CYS 108  -1.390  -5.477  -7.033
  817    HB3  CYS 108           HB2      CYS 108  -0.364  -6.733  -6.340
  818    H    VAL 109           H        VAL 109  -3.888  -7.190  -3.976
  819    HA   VAL 109           HA       VAL 109  -2.236  -9.217  -2.625
  820    HB   VAL 109           HB       VAL 109  -3.982  -9.428  -0.949
  821   HG11  VAL 109          HG11      VAL 109  -3.849  -7.203   0.088
  822   HG12  VAL 109          HG12      VAL 109  -3.228  -6.551  -1.430
  823   HG13  VAL 109          HG13      VAL 109  -2.293  -7.751  -0.535
  824   HG21  VAL 109          HG21      VAL 109  -5.468  -7.295  -2.484
  825   HG22  VAL 109          HG22      VAL 109  -5.945  -7.962  -0.923
  826   HG23  VAL 109          HG23      VAL 109  -5.930  -8.993  -2.356
  827    H    CYS 110           H        CYS 110  -3.745 -11.234  -2.139
  828    HA   CYS 110           HA       CYS 110  -5.173 -11.869  -4.627
  829    HB2  CYS 110           HB3      CYS 110  -2.945 -12.950  -4.579
  830    HB3  CYS 110           HB2      CYS 110  -3.370 -13.733  -3.065
  831    H    VAL 111           H        VAL 111  -7.232 -12.257  -4.224
  832    HA   VAL 111           HA       VAL 111  -8.083 -12.998  -1.548
  833    HB   VAL 111           HB       VAL 111 -10.363 -12.733  -2.356
  834   HG11  VAL 111          HG11      VAL 111  -9.202 -10.714  -1.677
  835   HG12  VAL 111          HG12      VAL 111 -10.311 -10.370  -3.007
  836   HG13  VAL 111          HG13      VAL 111  -8.579 -10.503  -3.314
  837   HG21  VAL 111          HG21      VAL 111 -10.863 -12.099  -4.656
  838   HG22  VAL 111          HG22      VAL 111 -10.090 -13.684  -4.583
  839   HG23  VAL 111          HG23      VAL 111  -9.158 -12.270  -5.077
  840    H    LEU 112           H        LEU 112  -9.263 -14.921  -1.074
  841    HA   LEU 112           HA       LEU 112  -8.783 -17.068  -3.033
  842    HB2  LEU 112           HB3      LEU 112  -8.715 -17.244  -0.013
  843    HB3  LEU 112           HB2      LEU 112  -8.486 -18.589  -1.113
  844    HG   LEU 112           HG       LEU 112  -6.643 -16.227  -0.733
  845   HD11  LEU 112          HD11      LEU 112  -6.466 -17.874   1.021
  846   HD12  LEU 112          HD12      LEU 112  -5.053 -17.975  -0.030
  847   HD13  LEU 112          HD13      LEU 112  -6.340 -19.171  -0.166
  848   HD21  LEU 112          HD21      LEU 112  -6.496 -18.493  -2.712
  849   HD22  LEU 112          HD22      LEU 112  -5.171 -17.393  -2.346
  850   HD23  LEU 112          HD23      LEU 112  -6.651 -16.773  -3.071
  851    H    SER 113           H        SER 113 -10.448 -18.352  -3.545
  852    HA   SER 113           HA       SER 113 -12.561 -19.068  -1.835
  853    HB2  SER 113           HB3      SER 113 -14.413 -17.845  -3.044
  854    HB3  SER 113           HB2      SER 113 -13.387 -16.822  -2.040
  855    HG   SER 113           HG       SER 113 -12.852 -17.186  -4.795
  856    H    ARG 114           H        ARG 114 -12.182 -21.147  -2.704
  857    HA   ARG 114           HA       ARG 114 -13.075 -21.481  -5.491
  858    HB2  ARG 114           HB3      ARG 114 -11.051 -22.742  -4.674
  859    HB3  ARG 114           HB2      ARG 114 -12.111 -23.623  -3.584
  860    HG2  ARG 114           HG3      ARG 114 -11.637 -24.930  -5.565
  861    HG3  ARG 114           HG2      ARG 114 -13.348 -24.501  -5.503
  862    HD2  ARG 114           HD3      ARG 114 -13.048 -22.781  -7.130
  863    HD3  ARG 114           HD2      ARG 114 -11.296 -22.955  -7.070
  864    HE   ARG 114           HE       ARG 114 -12.038 -25.395  -7.855
  865   HH11  ARG 114          HH11      ARG 114 -13.118 -22.248  -8.952
  866   HH12  ARG 114          HH12      ARG 114 -13.339 -22.758 -10.594
  867   HH21  ARG 114          HH21      ARG 114 -12.325 -26.065 -10.018
  868   HH22  ARG 114          HH22      ARG 114 -12.884 -24.930 -11.203
  869    H    LYS 115           H        LYS 115 -13.797 -22.290  -2.193
  870    HA   LYS 115           HA       LYS 115 -16.536 -23.019  -2.960
  871    HB2  LYS 115           HB3      LYS 115 -16.491 -24.529  -0.935
  872    HB3  LYS 115           HB2      LYS 115 -15.426 -25.036  -2.238
  873    HG2  LYS 115           HG3      LYS 115 -13.523 -24.021  -1.065
  874    HG3  LYS 115           HG2      LYS 115 -14.598 -23.582   0.267
  875    HD2  LYS 115           HD3      LYS 115 -14.077 -26.389  -0.711
  876    HD3  LYS 115           HD2      LYS 115 -13.328 -25.653   0.704
  877    HE2  LYS 115           HE3      LYS 115 -16.279 -26.110   0.308
  878    HE3  LYS 115           HE2      LYS 115 -15.216 -27.097   1.303
  879    HZ1  LYS 115           HZ1      LYS 115 -14.770 -25.118   2.665
  880    HZ2  LYS 115           HZ2      LYS 115 -16.401 -25.554   2.678
  881    HZ3  LYS 115           HZ3      LYS 115 -15.888 -24.241   1.747
  882    H    ALA 116           H        ALA 116 -18.169 -22.212  -1.621
  883    HA   ALA 116           HA       ALA 116 -17.278 -20.237   0.374
  884    HB1  ALA 116           HB1      ALA 116 -19.517 -19.870  -1.610
  885    HB2  ALA 116           HB2      ALA 116 -17.932 -19.102  -1.694
  886    HB3  ALA 116           HB3      ALA 116 -19.028 -18.721  -0.366
  887    H    THR 117           H        THR 117 -18.126 -20.544   2.299
  888    HA   THR 117           HA       THR 117 -20.402 -22.311   2.648
  889    HB   THR 117           HB       THR 117 -19.963 -21.946   5.089
  890    HG1  THR 117           HG1      THR 117 -18.519 -20.510   5.708
  891   HG21  THR 117          HG21      THR 117 -17.605 -22.856   3.439
  892   HG22  THR 117          HG22      THR 117 -18.970 -23.853   3.939
  893   HG23  THR 117          HG23      THR 117 -17.856 -23.217   5.147
  894    H    ARG 118           H        ARG 118 -21.858 -21.404   4.633
  895    HA   ARG 118           HA       ARG 118 -23.540 -19.998   5.237
  896    HB2  ARG 118           HB3      ARG 118 -21.711 -17.901   4.045
  897    HB3  ARG 118           HB2      ARG 118 -23.193 -17.526   4.905
  898    HG2  ARG 118           HG3      ARG 118 -20.989 -19.122   6.169
  899    HG3  ARG 118           HG2      ARG 118 -20.992 -17.360   6.177
  900    HD2  ARG 118           HD3      ARG 118 -23.238 -19.069   7.246
  901    HD3  ARG 118           HD2      ARG 118 -21.946 -18.391   8.236
  902    HE   ARG 118           HE       ARG 118 -23.245 -16.382   6.693
  903   HH11  ARG 118          HH11      ARG 118 -23.620 -18.343   9.567
  904   HH12  ARG 118          HH12      ARG 118 -24.620 -17.182  10.378
  905   HH21  ARG 118          HH21      ARG 118 -24.537 -14.851   7.759
  906   HH22  ARG 118          HH22      ARG 118 -25.137 -15.189   9.352
  907    H1   SER   1           H1       SER   1 -27.164  -9.326  -7.536
  908    H2   SER   1           H2       SER   1 -26.808  -7.681  -7.616
  909    H3   SER   1           H3       SER   1 -25.966  -8.673  -6.542
  910    HA   SER   1           HA       SER   1 -24.960  -9.868  -8.335
  911    HB2  SER   1           HB3      SER   1 -26.385  -7.910 -10.153
  912    HB3  SER   1           HB2      SER   1 -25.340  -9.243 -10.644
  913    HG   SER   1           HG       SER   1 -26.867 -10.694  -9.965
  914    H    SER   2           H        SER   2 -25.507  -6.424  -9.163
  915    HA   SER   2           HA       SER   2 -22.620  -6.014  -8.762
  916    HB2  SER   2           HB3      SER   2 -23.475  -5.649 -11.072
  917    HB3  SER   2           HB2      SER   2 -24.529  -4.379 -10.454
  918    HG   SER   2           HG       SER   2 -22.217  -3.704  -9.561
  919    H    THR   3           H        THR   3 -25.530  -5.467  -7.302
  920    HA   THR   3           HA       THR   3 -25.080  -2.803  -6.329
  921    HB   THR   3           HB       THR   3 -26.952  -3.543  -4.689
  922    HG1  THR   3           HG1      THR   3 -28.052  -5.388  -5.303
  923   HG21  THR   3          HG21      THR   3 -28.667  -3.190  -6.416
  924   HG22  THR   3          HG22      THR   3 -27.449  -3.433  -7.667
  925   HG23  THR   3          HG23      THR   3 -27.333  -2.049  -6.580
  926    H    HIS   4           H        HIS   4 -22.874  -3.255  -5.591
  927    HA   HIS   4           HA       HIS   4 -21.315  -3.574  -3.968
  928    HB2  HIS   4           HB3      HIS   4 -22.928  -2.167  -2.683
  929    HB3  HIS   4           HB2      HIS   4 -23.699  -3.632  -2.103
  930    HD1  HIS   4           HD1      HIS   4 -20.758  -1.438  -1.556
  931    HD2  HIS   4           HD2      HIS   4 -22.225  -5.057  -0.142
  932    HE1  HIS   4           HE1      HIS   4 -19.450  -1.925   0.534
  933    HE2  HIS   4           HE2      HIS   4 -20.482  -4.024   1.467
  934    HA   PRO   5           HA       PRO   5 -22.110  -8.141  -3.956
  935    HB2  PRO   5           HB3      PRO   5 -19.829  -8.867  -5.188
  936    HB3  PRO   5           HB2      PRO   5 -21.241  -8.301  -6.093
  937    HG2  PRO   5           HG3      PRO   5 -18.766  -6.804  -5.302
  938    HG3  PRO   5           HG2      PRO   5 -19.622  -6.799  -6.856
  939    HD2  PRO   5           HD3      PRO   5 -19.911  -4.838  -4.986
  940    HD3  PRO   5           HD2      PRO   5 -21.198  -5.288  -6.119
  941    H    VAL   6           H        VAL   6 -20.956  -6.398  -1.881
  942    HA   VAL   6           HA       VAL   6 -19.846  -6.547   0.089
  943    HB   VAL   6           HB       VAL   6 -19.568  -9.506  -0.429
  944   HG11  VAL   6          HG11      VAL   6 -19.799  -9.689   1.997
  945   HG12  VAL   6          HG12      VAL   6 -19.926  -7.934   2.118
  946   HG13  VAL   6          HG13      VAL   6 -18.427  -8.674   1.554
  947   HG21  VAL   6          HG21      VAL   6 -21.994  -8.055   0.619
  948   HG22  VAL   6          HG22      VAL   6 -21.785  -9.804   0.561
  949   HG23  VAL   6          HG23      VAL   6 -21.863  -8.876  -0.936
  950    H    PHE   7           H        PHE   7 -18.417  -6.366  -2.556
  951    HA   PHE   7           HA       PHE   7 -16.331  -6.331  -3.449
  952    HB2  PHE   7           HB3      PHE   7 -16.100  -5.013  -1.210
  953    HB3  PHE   7           HB2      PHE   7 -15.212  -6.424  -0.657
  954    HD1  PHE   7           HD1      PHE   7 -13.015  -6.939  -1.562
  955    HD2  PHE   7           HD2      PHE   7 -15.212  -3.551  -2.900
  956    HE1  PHE   7           HE1      PHE   7 -10.978  -6.029  -2.589
  957    HE2  PHE   7           HE2      PHE   7 -13.178  -2.635  -3.935
  958    HZ   PHE   7           HZ       PHE   7 -11.056  -3.872  -3.783
  959    H    HIS   8           H        HIS   8 -17.308  -8.733  -3.668
  960    HA   HIS   8           HA       HIS   8 -16.848 -10.931  -3.988
  961    HB2  HIS   8           HB3      HIS   8 -14.673  -9.950  -4.863
  962    HB3  HIS   8           HB2      HIS   8 -13.974 -10.284  -3.285
  963    HD1  HIS   8           HD1      HIS   8 -15.168 -11.986  -6.402
  964    HD2  HIS   8           HD2      HIS   8 -13.346 -12.974  -2.805
  965    HE1  HIS   8           HE1      HIS   8 -14.356 -14.345  -6.685
  966    HE2  HIS   8           HE2      HIS   8 -13.422 -14.984  -4.437
  967    H    MET   9           H        MET   9 -17.897 -10.233  -1.570
  968    HA   MET   9           HA       MET   9 -18.340 -11.049   0.510
  969    HB2  MET   9           HB3      MET   9 -16.564 -13.333  -0.378
  970    HB3  MET   9           HB2      MET   9 -17.566 -13.346   1.064
  971    HG2  MET   9           HG3      MET   9 -19.569 -13.228  -0.269
  972    HG3  MET   9           HG2      MET   9 -18.618 -13.047  -1.738
  973    HE1  MET   9           HE1      MET   9 -19.319 -15.465   1.314
  974    HE2  MET   9           HE2      MET   9 -17.561 -15.377   1.196
  975    HE3  MET   9           HE3      MET   9 -18.397 -16.882   0.814
  976    H    GLY  10           H        GLY  10 -16.032  -9.318   0.013
  977    HA2  GLY  10           HA3      GLY  10 -14.708  -8.320   1.744
  978    HA3  GLY  10           HA2      GLY  10 -14.516  -9.910   2.465
  979    H    GLU  11           H        GLU  11 -12.558  -7.819   1.452
  980    HA   GLU  11           HA       GLU  11 -11.249  -9.091  -0.754
  981    HB2  GLU  11           HB3      GLU  11  -9.367  -7.464  -0.172
  982    HB3  GLU  11           HB2      GLU  11 -10.910  -6.768  -0.652
  983    HG2  GLU  11           HG3      GLU  11 -11.441  -6.439   1.759
  984    HG3  GLU  11           HG2      GLU  11  -9.803  -6.977   2.139
  985    H    PHE  12           H        PHE  12 -11.237 -11.189   0.161
  986    HA   PHE  12           HA       PHE  12 -10.027 -12.112   2.427
  987    HB2  PHE  12           HB3      PHE  12 -10.014 -13.386  -0.315
  988    HB3  PHE  12           HB2      PHE  12  -9.568 -14.224   1.168
  989    HD1  PHE  12           HD1      PHE  12 -12.164 -13.594  -1.080
  990    HD2  PHE  12           HD2      PHE  12 -11.392 -14.095   3.075
  991    HE1  PHE  12           HE1      PHE  12 -14.517 -14.201  -0.720
  992    HE2  PHE  12           HE2      PHE  12 -13.748 -14.706   3.441
  993    HZ   PHE  12           HZ       PHE  12 -15.312 -14.761   1.541
  994    H    SER  13           H        SER  13  -8.032 -12.530   3.138
  995    HA   SER  13           HA       SER  13  -5.791 -11.811   1.373
  996    HB2  SER  13           HB3      SER  13  -5.924 -11.344   4.360
  997    HB3  SER  13           HB2      SER  13  -4.697 -10.754   3.247
  998    HG   SER  13           HG       SER  13  -7.063  -9.933   2.359
  999    H    VAL  14           H        VAL  14  -4.114 -13.228   1.307
 1000    HA   VAL  14           HA       VAL  14  -4.332 -15.829   2.363
 1001    HB   VAL  14           HB       VAL  14  -1.994 -16.148   1.642
 1002   HG11  VAL  14          HG11      VAL  14  -3.707 -14.639  -0.328
 1003   HG12  VAL  14          HG12      VAL  14  -3.754 -16.371  -0.004
 1004   HG13  VAL  14          HG13      VAL  14  -2.326 -15.652  -0.745
 1005   HG21  VAL  14          HG21      VAL  14  -0.758 -14.328   0.581
 1006   HG22  VAL  14          HG22      VAL  14  -1.100 -13.964   2.273
 1007   HG23  VAL  14          HG23      VAL  14  -2.048 -13.200   0.999
 1008    H    CYS  15           H        CYS  15  -3.033 -12.914   3.628
 1009    HA   CYS  15           HA       CYS  15  -2.488 -14.279   6.163
 1010    HB2  CYS  15           HB3      CYS  15  -0.338 -13.656   5.082
 1011    HB3  CYS  15           HB2      CYS  15  -0.882 -11.978   5.007
 1012    H    ASP  16           H        ASP  16  -3.428 -13.279   7.911
 1013    HA   ASP  16           HA       ASP  16  -5.507 -11.433   7.320
 1014    HB2  ASP  16           HB3      ASP  16  -4.467 -12.546   9.924
 1015    HB3  ASP  16           HB2      ASP  16  -5.751 -11.344   9.873
 1016    H    SER  17           H        SER  17  -5.597  -9.311   7.445
 1017    HA   SER  17           HA       SER  17  -3.294  -7.906   8.602
 1018    HB2  SER  17           HB3      SER  17  -3.653  -6.189   6.786
 1019    HB3  SER  17           HB2      SER  17  -3.073  -7.755   6.212
 1020    HG   SER  17           HG       SER  17  -5.212  -8.252   5.617
 1021    H    VAL  18           H        VAL  18  -3.720  -5.951   9.630
 1022    HA   VAL  18           HA       VAL  18  -6.575  -5.434  10.105
 1023    HB   VAL  18           HB       VAL  18  -5.483  -6.244  12.119
 1024   HG11  VAL  18          HG11      VAL  18  -3.707  -4.947  13.221
 1025   HG12  VAL  18          HG12      VAL  18  -3.592  -3.927  11.787
 1026   HG13  VAL  18          HG13      VAL  18  -3.196  -5.641  11.682
 1027   HG21  VAL  18          HG21      VAL  18  -6.014  -4.380  13.635
 1028   HG22  VAL  18          HG22      VAL  18  -7.256  -4.635  12.408
 1029   HG23  VAL  18          HG23      VAL  18  -6.112  -3.302  12.242
 1030    H    SER  19           H        SER  19  -7.247  -3.677   9.123
 1031    HA   SER  19           HA       SER  19  -5.361  -1.551   8.468
 1032    HB2  SER  19           HB3      SER  19  -7.328  -0.679   7.108
 1033    HB3  SER  19           HB2      SER  19  -6.682  -2.239   6.601
 1034    HG   SER  19           HG       SER  19  -8.971  -1.822   8.238
 1035    H    VAL  20           H        VAL  20  -5.142   0.067   9.831
 1036    HA   VAL  20           HA       VAL  20  -7.432   0.831  11.515
 1037    HB   VAL  20           HB       VAL  20  -4.510   0.899  12.280
 1038   HG11  VAL  20          HG11      VAL  20  -5.323   1.447  14.525
 1039   HG12  VAL  20          HG12      VAL  20  -6.969   1.526  13.899
 1040   HG13  VAL  20          HG13      VAL  20  -5.757   2.679  13.340
 1041   HG21  VAL  20          HG21      VAL  20  -5.319  -1.382  12.186
 1042   HG22  VAL  20          HG22      VAL  20  -6.700  -0.953  13.196
 1043   HG23  VAL  20          HG23      VAL  20  -5.067  -0.889  13.860
 1044    H    TRP  21           H        TRP  21  -7.935   2.949  11.547
 1045    HA   TRP  21           HA       TRP  21  -6.192   4.834  10.172
 1046    HB2  TRP  21           HB3      TRP  21  -8.968   5.083  11.349
 1047    HB3  TRP  21           HB2      TRP  21  -8.063   6.474  10.764
 1048    HD1  TRP  21           HD1      TRP  21  -9.912   3.363   9.517
 1049    HE1  TRP  21           HE1      TRP  21 -10.302   3.590   6.980
 1050    HE3  TRP  21           HE3      TRP  21  -7.117   7.561   8.636
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.527   5.320   4.890
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.997   8.437   6.338
 1053    HH2  TRP  21           HH2      TRP  21  -8.175   7.339   4.506
 1054    H    VAL  22           H        VAL  22  -4.468   5.126  11.445
 1055    HA   VAL  22           HA       VAL  22  -4.570   5.215  14.285
 1056    HB   VAL  22           HB       VAL  22  -2.369   6.180  12.447
 1057   HG11  VAL  22          HG11      VAL  22  -2.133   7.017  14.718
 1058   HG12  VAL  22          HG12      VAL  22  -0.898   5.805  14.368
 1059   HG13  VAL  22          HG13      VAL  22  -2.299   5.381  15.351
 1060   HG21  VAL  22          HG21      VAL  22  -2.793   3.468  13.698
 1061   HG22  VAL  22          HG22      VAL  22  -1.359   3.970  12.801
 1062   HG23  VAL  22          HG23      VAL  22  -2.917   3.859  11.982
 1063    H    GLY  23           H        GLY  23  -5.246   6.826  15.478
 1064    HA2  GLY  23           HA3      GLY  23  -5.975   9.326  14.298
 1065    HA3  GLY  23           HA2      GLY  23  -6.139   8.878  15.992
 1066    H    ASP  24           H        ASP  24  -3.300   8.226  16.300
 1067    HA   ASP  24           HA       ASP  24  -2.119  10.896  16.061
 1068    HB2  ASP  24           HB3      ASP  24  -2.494   9.389  18.650
 1069    HB3  ASP  24           HB2      ASP  24  -1.344  10.707  18.470
 1070    H    LYS  25           H        LYS  25  -0.995   9.468  14.405
 1071    HA   LYS  25           HA       LYS  25   1.002   7.657  15.345
 1072    HB2  LYS  25           HB3      LYS  25   0.088   7.758  12.991
 1073    HB3  LYS  25           HB2      LYS  25   1.012   9.234  12.764
 1074    HG2  LYS  25           HG3      LYS  25   3.081   8.042  13.122
 1075    HG3  LYS  25           HG2      LYS  25   2.192   6.555  13.458
 1076    HD2  LYS  25           HD3      LYS  25   1.224   6.720  11.155
 1077    HD3  LYS  25           HD2      LYS  25   2.327   8.064  10.855
 1078    HE2  LYS  25           HE3      LYS  25   3.260   5.988   9.984
 1079    HE3  LYS  25           HE2      LYS  25   4.235   6.595  11.324
 1080    HZ1  LYS  25           HZ1      LYS  25   3.215   5.000  12.785
 1081    HZ2  LYS  25           HZ2      LYS  25   3.837   4.192  11.438
 1082    HZ3  LYS  25           HZ3      LYS  25   2.168   4.468  11.560
 1083    H    THR  26           H        THR  26   3.097   8.102  16.024
 1084    HA   THR  26           HA       THR  26   3.535  10.952  16.533
 1085    HB   THR  26           HB       THR  26   3.321   9.582  18.541
 1086    HG1  THR  26           HG1      THR  26   4.907  11.415  18.312
 1087   HG21  THR  26          HG21      THR  26   5.773   8.143  17.527
 1088   HG22  THR  26          HG22      THR  26   4.162   7.456  17.735
 1089   HG23  THR  26          HG23      THR  26   5.090   7.970  19.143
 1090    H    THR  27           H        THR  27   5.125   8.152  15.111
 1091    HA   THR  27           HA       THR  27   7.229   9.941  14.157
 1092    HB   THR  27           HB       THR  27   8.894   8.031  14.596
 1093    HG1  THR  27           HG1      THR  27   6.834   6.798  15.471
 1094   HG21  THR  27          HG21      THR  27   9.009  10.185  15.726
 1095   HG22  THR  27          HG22      THR  27   9.399   8.876  16.843
 1096   HG23  THR  27          HG23      THR  27   7.812   9.646  16.905
 1097    H    ALA  28           H        ALA  28   8.077   9.445  12.197
 1098    HA   ALA  28           HA       ALA  28   7.663   6.835  11.017
 1099    HB1  ALA  28           HB1      ALA  28   5.534   7.977  10.527
 1100    HB2  ALA  28           HB2      ALA  28   6.453   7.599   9.071
 1101    HB3  ALA  28           HB3      ALA  28   6.430   9.248   9.698
 1102    H    THR  29           H        THR  29   8.805   6.615   8.973
 1103    HA   THR  29           HA       THR  29  11.150   8.352   8.911
 1104    HB   THR  29           HB       THR  29  10.727   5.821   7.327
 1105    HG1  THR  29           HG1      THR  29  11.449   6.189  10.035
 1106   HG21  THR  29          HG21      THR  29  13.223   7.241   8.253
 1107   HG22  THR  29          HG22      THR  29  12.576   7.259   6.613
 1108   HG23  THR  29          HG23      THR  29  13.169   5.752   7.310
 1109    H    ASP  30           H        ASP  30  11.215   9.963   7.520
 1110    HA   ASP  30           HA       ASP  30   9.469  10.261   5.297
 1111    HB2  ASP  30           HB3      ASP  30  10.420  12.226   6.368
 1112    HB3  ASP  30           HB2      ASP  30  12.057  11.664   6.026
 1113    H    ILE  31           H        ILE  31  10.224  10.431   3.008
 1114    HA   ILE  31           HA       ILE  31  11.280   8.020   2.129
 1115    HB   ILE  31           HB       ILE  31   9.903   9.411   0.693
 1116   HG12  ILE  31          HG13      ILE  31  12.665   9.071  -0.502
 1117   HG13  ILE  31          HG12      ILE  31  11.458   7.797  -0.362
 1118   HG21  ILE  31          HG21      ILE  31  10.745  11.444  -0.353
 1119   HG22  ILE  31          HG22      ILE  31  12.237  11.315   0.574
 1120   HG23  ILE  31          HG23      ILE  31  10.709  11.602   1.404
 1121   HD11  ILE  31          HD11      ILE  31  11.204  10.314  -1.988
 1122   HD12  ILE  31          HD12      ILE  31   9.970   9.066  -1.833
 1123   HD13  ILE  31          HD13      ILE  31  11.509   8.690  -2.606
 1124    H    LYS  32           H        LYS  32  12.939  10.977   2.980
 1125    HA   LYS  32           HA       LYS  32  15.414  10.242   1.701
 1126    HB2  LYS  32           HB3      LYS  32  14.793  12.410   3.707
 1127    HB3  LYS  32           HB2      LYS  32  16.292  12.263   2.798
 1128    HG2  LYS  32           HG3      LYS  32  15.103  12.619   0.724
 1129    HG3  LYS  32           HG2      LYS  32  13.567  12.668   1.587
 1130    HD2  LYS  32           HD3      LYS  32  14.362  14.625   2.829
 1131    HD3  LYS  32           HD2      LYS  32  15.854  14.606   1.889
 1132    HE2  LYS  32           HE3      LYS  32  14.570  14.938  -0.156
 1133    HE3  LYS  32           HE2      LYS  32  13.074  14.924   0.773
 1134    HZ1  LYS  32           HZ1      LYS  32  13.777  17.177   0.275
 1135    HZ2  LYS  32           HZ2      LYS  32  15.258  16.915   1.042
 1136    HZ3  LYS  32           HZ3      LYS  32  13.829  16.902   1.942
 1137    H    GLY  33           H        GLY  33  13.933   8.988   4.306
 1138    HA2  GLY  33           HA3      GLY  33  14.833   7.379   5.743
 1139    HA3  GLY  33           HA2      GLY  33  16.447   7.947   5.331
 1140    H    LYS  34           H        LYS  34  13.936  10.136   6.317
 1141    HA   LYS  34           HA       LYS  34  15.478  10.732   8.736
 1142    HB2  LYS  34           HB3      LYS  34  13.322  12.339   7.362
 1143    HB3  LYS  34           HB2      LYS  34  14.259  12.867   8.747
 1144    HG2  LYS  34           HG3      LYS  34  15.385  12.247   6.027
 1145    HG3  LYS  34           HG2      LYS  34  15.021  13.856   6.639
 1146    HD2  LYS  34           HD3      LYS  34  16.602  13.453   8.501
 1147    HD3  LYS  34           HD2      LYS  34  17.037  11.916   7.751
 1148    HE2  LYS  34           HE3      LYS  34  17.818  13.081   5.770
 1149    HE3  LYS  34           HE2      LYS  34  17.313  14.621   6.456
 1150    HZ1  LYS  34           HZ1      LYS  34  18.924  14.320   8.230
 1151    HZ2  LYS  34           HZ2      LYS  34  19.686  14.268   6.721
 1152    HZ3  LYS  34           HZ3      LYS  34  19.402  12.838   7.576
 1153    H    GLU  35           H        GLU  35  14.749   9.689  10.495
 1154    HA   GLU  35           HA       GLU  35  11.978   9.002  10.847
 1155    HB2  GLU  35           HB3      GLU  35  13.906   7.709  11.826
 1156    HB3  GLU  35           HB2      GLU  35  14.187   9.060  12.912
 1157    HG2  GLU  35           HG3      GLU  35  12.972   7.381  14.086
 1158    HG3  GLU  35           HG2      GLU  35  11.901   8.751  13.812
 1159    H    VAL  36           H        VAL  36  10.483  10.453  11.371
 1160    HA   VAL  36           HA       VAL  36  11.311  12.831  12.887
 1161    HB   VAL  36           HB       VAL  36   9.760  14.172  11.413
 1162   HG11  VAL  36          HG11      VAL  36  12.185  12.928  10.127
 1163   HG12  VAL  36          HG12      VAL  36  12.170  14.341  11.185
 1164   HG13  VAL  36          HG13      VAL  36  11.400  14.417   9.601
 1165   HG21  VAL  36          HG21      VAL  36   9.971  11.726   9.662
 1166   HG22  VAL  36          HG22      VAL  36   9.301  13.283   9.173
 1167   HG23  VAL  36          HG23      VAL  36   8.504  12.337  10.432
 1168    H    THR  37           H        THR  37   9.590  14.009  13.872
 1169    HA   THR  37           HA       THR  37   7.583  12.294  15.017
 1170    HB   THR  37           HB       THR  37   7.981  15.257  15.440
 1171    HG1  THR  37           HG1      THR  37   9.604  13.236  16.096
 1172   HG21  THR  37          HG21      THR  37   6.864  14.850  17.580
 1173   HG22  THR  37          HG22      THR  37   6.666  13.149  17.157
 1174   HG23  THR  37          HG23      THR  37   5.830  14.392  16.227
 1175    H    VAL  38           H        VAL  38   5.704  11.972  14.084
 1176    HA   VAL  38           HA       VAL  38   4.801  13.695  11.938
 1177    HB   VAL  38           HB       VAL  38   3.600  11.138  13.027
 1178   HG11  VAL  38          HG11      VAL  38   2.362  11.065  10.911
 1179   HG12  VAL  38          HG12      VAL  38   3.018  12.644  10.481
 1180   HG13  VAL  38          HG13      VAL  38   1.941  12.485  11.871
 1181   HG21  VAL  38          HG21      VAL  38   5.822  10.783  12.103
 1182   HG22  VAL  38          HG22      VAL  38   5.349  11.608  10.618
 1183   HG23  VAL  38          HG23      VAL  38   4.592  10.076  11.056
 1184    H    LEU  39           H        LEU  39   2.993  14.960  11.974
 1185    HA   LEU  39           HA       LEU  39   1.699  15.311  14.593
 1186    HB2  LEU  39           HB3      LEU  39   1.716  17.189  12.221
 1187    HB3  LEU  39           HB2      LEU  39   1.066  17.530  13.815
 1188    HG   LEU  39           HG       LEU  39   3.974  17.123  13.130
 1189   HD11  LEU  39          HD11      LEU  39   3.126  19.253  12.363
 1190   HD12  LEU  39          HD12      LEU  39   4.176  19.485  13.759
 1191   HD13  LEU  39          HD13      LEU  39   2.427  19.570  13.950
 1192   HD21  LEU  39          HD21      LEU  39   4.398  17.775  15.458
 1193   HD22  LEU  39          HD22      LEU  39   3.511  16.255  15.341
 1194   HD23  LEU  39          HD23      LEU  39   2.663  17.740  15.770
 1195    H    ALA  40           H        ALA  40  -0.303  14.605  14.805
 1196    HA   ALA  40           HA       ALA  40  -1.727  13.484  12.587
 1197    HB1  ALA  40           HB1      ALA  40  -2.623  13.912  15.431
 1198    HB2  ALA  40           HB2      ALA  40  -1.787  12.483  14.824
 1199    HB3  ALA  40           HB3      ALA  40  -3.404  12.876  14.237
 1200    H    GLU  41           H        GLU  41  -1.595  16.506  14.133
 1201    HA   GLU  41           HA       GLU  41  -4.109  17.382  12.891
 1202    HB2  GLU  41           HB3      GLU  41  -2.450  19.059  14.752
 1203    HB3  GLU  41           HB2      GLU  41  -4.174  19.148  14.436
 1204    HG2  GLU  41           HG3      GLU  41  -2.773  16.980  15.977
 1205    HG3  GLU  41           HG2      GLU  41  -3.692  18.310  16.672
 1206    H    VAL  42           H        VAL  42  -3.832  18.330  10.942
 1207    HA   VAL  42           HA       VAL  42  -1.167  19.368  10.333
 1208    HB   VAL  42           HB       VAL  42  -1.746  19.250   7.985
 1209   HG11  VAL  42          HG11      VAL  42  -0.865  17.247   9.005
 1210   HG12  VAL  42          HG12      VAL  42  -2.044  16.825   7.763
 1211   HG13  VAL  42          HG13      VAL  42  -2.489  16.737   9.468
 1212   HG21  VAL  42          HG21      VAL  42  -4.463  18.292   8.875
 1213   HG22  VAL  42          HG22      VAL  42  -3.874  18.328   7.212
 1214   HG23  VAL  42          HG23      VAL  42  -4.104  19.837   8.099
 1215    H    ASN  43           H        ASN  43  -0.771  21.457  10.110
 1216    HA   ASN  43           HA       ASN  43  -3.059  23.281  10.078
 1217    HB2  ASN  43           HB3      ASN  43  -1.500  25.034  10.866
 1218    HB3  ASN  43           HB2      ASN  43  -1.573  23.668  11.972
 1219   HD21  ASN  43          HD21      ASN  43   0.256  22.435  12.315
 1220   HD22  ASN  43          HD22      ASN  43   1.811  22.888  11.710
 1221    H    ILE  44           H        ILE  44  -3.605  23.989   8.182
 1222    HA   ILE  44           HA       ILE  44  -1.489  24.589   6.221
 1223    HB   ILE  44           HB       ILE  44  -4.457  24.212   5.736
 1224   HG12  ILE  44          HG13      ILE  44  -2.129  22.419   5.001
 1225   HG13  ILE  44          HG12      ILE  44  -3.255  22.118   6.323
 1226   HG21  ILE  44          HG21      ILE  44  -3.429  25.792   4.175
 1227   HG22  ILE  44          HG22      ILE  44  -3.882  24.296   3.363
 1228   HG23  ILE  44          HG23      ILE  44  -2.195  24.598   3.775
 1229   HD11  ILE  44          HD11      ILE  44  -3.807  20.778   4.376
 1230   HD12  ILE  44          HD12      ILE  44  -3.953  22.236   3.396
 1231   HD13  ILE  44          HD13      ILE  44  -5.087  21.943   4.714
 1232    H    ASN  45           H        ASN  45  -0.878  26.572   6.852
 1233    HA   ASN  45           HA       ASN  45  -0.863  28.819   7.073
 1234    HB2  ASN  45           HB3      ASN  45  -3.608  28.700   5.793
 1235    HB3  ASN  45           HB2      ASN  45  -2.709  30.180   6.103
 1236   HD21  ASN  45          HD21      ASN  45  -0.128  28.999   5.390
 1237   HD22  ASN  45          HD22      ASN  45  -0.136  28.845   3.668
 1238    H    ASN  46           H        ASN  46  -4.354  28.517   7.542
 1239    HA   ASN  46           HA       ASN  46  -3.966  28.832  10.431
 1240    HB2  ASN  46           HB3      ASN  46  -5.610  30.621   8.652
 1241    HB3  ASN  46           HB2      ASN  46  -5.948  30.470  10.370
 1242   HD21  ASN  46          HD21      ASN  46  -3.177  30.223  11.166
 1243   HD22  ASN  46          HD22      ASN  46  -2.465  31.785  10.965
 1244    H    SER  47           H        SER  47  -4.797  26.645   8.597
 1245    HA   SER  47           HA       SER  47  -7.404  26.100   9.845
 1246    HB2  SER  47           HB3      SER  47  -7.666  26.457   7.417
 1247    HB3  SER  47           HB2      SER  47  -6.448  25.222   7.101
 1248    HG   SER  47           HG       SER  47  -8.443  24.274   6.897
 1249    H    VAL  48           H        VAL  48  -7.140  24.609  11.352
 1250    HA   VAL  48           HA       VAL  48  -5.091  22.531  10.950
 1251    HB   VAL  48           HB       VAL  48  -6.270  23.464  13.575
 1252   HG11  VAL  48          HG11      VAL  48  -4.450  22.180  14.585
 1253   HG12  VAL  48          HG12      VAL  48  -3.934  21.650  12.983
 1254   HG13  VAL  48          HG13      VAL  48  -5.505  21.153  13.616
 1255   HG21  VAL  48          HG21      VAL  48  -3.579  24.093  12.372
 1256   HG22  VAL  48          HG22      VAL  48  -4.131  24.560  13.981
 1257   HG23  VAL  48          HG23      VAL  48  -4.921  25.223  12.550
 1258    H    PHE  49           H        PHE  49  -5.820  20.543  10.610
 1259    HA   PHE  49           HA       PHE  49  -8.210  19.620  11.958
 1260    HB2  PHE  49           HB3      PHE  49  -9.265  18.790   9.864
 1261    HB3  PHE  49           HB2      PHE  49  -9.198  20.546   9.943
 1262    HD1  PHE  49           HD1      PHE  49  -7.544  21.775   8.532
 1263    HD2  PHE  49           HD2      PHE  49  -8.186  17.580   8.155
 1264    HE1  PHE  49           HE1      PHE  49  -6.478  21.811   6.316
 1265    HE2  PHE  49           HE2      PHE  49  -7.117  17.614   5.941
 1266    HZ   PHE  49           HZ       PHE  49  -6.263  19.730   5.019
 1267    H    ARG  50           H        ARG  50  -8.432  17.339  11.964
 1268    HA   ARG  50           HA       ARG  50  -5.916  15.952  11.302
 1269    HB2  ARG  50           HB3      ARG  50  -6.242  14.528  13.174
 1270    HB3  ARG  50           HB2      ARG  50  -6.586  16.149  13.756
 1271    HG2  ARG  50           HG3      ARG  50  -9.028  15.629  13.364
 1272    HG3  ARG  50           HG2      ARG  50  -8.533  13.953  13.137
 1273    HD2  ARG  50           HD3      ARG  50  -8.451  15.643  15.601
 1274    HD3  ARG  50           HD2      ARG  50  -9.077  14.010  15.388
 1275    HE   ARG  50           HE       ARG  50  -6.183  14.605  15.312
 1276   HH11  ARG  50          HH11      ARG  50  -8.884  12.740  16.575
 1277   HH12  ARG  50          HH12      ARG  50  -7.870  11.690  17.508
 1278   HH21  ARG  50          HH21      ARG  50  -4.879  13.230  16.525
 1279   HH22  ARG  50          HH22      ARG  50  -5.578  11.957  17.478
 1280    H    GLN  51           H        GLN  51  -6.046  13.892  10.324
 1281    HA   GLN  51           HA       GLN  51  -8.714  13.066   9.432
 1282    HB2  GLN  51           HB3      GLN  51  -7.939  12.738   7.132
 1283    HB3  GLN  51           HB2      GLN  51  -7.806  14.420   7.616
 1284    HG2  GLN  51           HG3      GLN  51  -5.470  12.540   7.722
 1285    HG3  GLN  51           HG2      GLN  51  -5.900  13.420   6.261
 1286   HE21  GLN  51          HE21      GLN  51  -6.775  15.785   7.779
 1287   HE22  GLN  51          HE22      GLN  51  -5.324  16.558   8.327
 1288    H    TYR  52           H        TYR  52  -6.002  12.226  10.962
 1289    HA   TYR  52           HA       TYR  52  -5.177  10.274  11.759
 1290    HB2  TYR  52           HB3      TYR  52  -7.378   8.849  10.252
 1291    HB3  TYR  52           HB2      TYR  52  -6.480   8.253  11.641
 1292    HD1  TYR  52           HD1      TYR  52  -6.657  10.918  13.229
 1293    HD2  TYR  52           HD2      TYR  52  -9.547   8.563  11.177
 1294    HE1  TYR  52           HE1      TYR  52  -8.412  11.791  14.708
 1295    HE2  TYR  52           HE2      TYR  52 -11.309   9.435  12.651
 1296    HH   TYR  52           HH       TYR  52 -11.435  10.414  14.982
 1297    H    PHE  53           H        PHE  53  -4.407   7.987  10.941
 1298    HA   PHE  53           HA       PHE  53  -3.413   8.284   8.180
 1299    HB2  PHE  53           HB3      PHE  53  -1.844   7.223  10.546
 1300    HB3  PHE  53           HB2      PHE  53  -1.247   7.393   8.897
 1301    HD1  PHE  53           HD1      PHE  53  -0.803   9.605   7.965
 1302    HD2  PHE  53           HD2      PHE  53  -2.011   9.099  12.012
 1303    HE1  PHE  53           HE1      PHE  53  -0.077  11.905   8.464
 1304    HE2  PHE  53           HE2      PHE  53  -1.287  11.394  12.521
 1305    HZ   PHE  53           HZ       PHE  53  -0.325  12.802  10.747
 1306    H    PHE  54           H        PHE  54  -3.824   6.579   6.918
 1307    HA   PHE  54           HA       PHE  54  -5.108   4.261   8.089
 1308    HB2  PHE  54           HB3      PHE  54  -6.052   5.281   6.058
 1309    HB3  PHE  54           HB2      PHE  54  -4.550   4.971   5.194
 1310    HD1  PHE  54           HD1      PHE  54  -4.195   2.923   4.104
 1311    HD2  PHE  54           HD2      PHE  54  -7.384   3.306   6.900
 1312    HE1  PHE  54           HE1      PHE  54  -5.061   0.729   3.413
 1313    HE2  PHE  54           HE2      PHE  54  -8.252   1.111   6.215
 1314    HZ   PHE  54           HZ       PHE  54  -7.091  -0.182   4.468
 1315    H    GLU  55           H        GLU  55  -3.812   2.756   8.931
 1316    HA   GLU  55           HA       GLU  55  -1.547   1.843   7.275
 1317    HB2  GLU  55           HB3      GLU  55  -1.701   1.908  10.300
 1318    HB3  GLU  55           HB2      GLU  55  -0.398   1.179   9.371
 1319    HG2  GLU  55           HG3      GLU  55  -0.023   3.476   8.357
 1320    HG3  GLU  55           HG2      GLU  55  -1.109   4.088   9.609
 1321    H    THR  56           H        THR  56  -1.402  -0.285   6.899
 1322    HA   THR  56           HA       THR  56  -3.397  -2.029   8.187
 1323    HB   THR  56           HB       THR  56  -2.220  -2.353   5.419
 1324    HG1  THR  56           HG1      THR  56  -3.739  -1.028   4.808
 1325   HG21  THR  56          HG21      THR  56  -4.007  -4.030   5.145
 1326   HG22  THR  56          HG22      THR  56  -4.462  -3.802   6.834
 1327   HG23  THR  56          HG23      THR  56  -2.877  -4.462   6.429
 1328    H    LYS  57           H        LYS  57  -2.418  -3.312   9.604
 1329    HA   LYS  57           HA       LYS  57   0.420  -3.963   9.178
 1330    HB2  LYS  57           HB3      LYS  57  -0.190  -2.703  11.235
 1331    HB3  LYS  57           HB2      LYS  57  -1.220  -4.042  11.723
 1332    HG2  LYS  57           HG3      LYS  57   0.702  -5.495  11.912
 1333    HG3  LYS  57           HG2      LYS  57   1.757  -4.214  11.316
 1334    HD2  LYS  57           HD3      LYS  57   0.101  -4.021  13.820
 1335    HD3  LYS  57           HD2      LYS  57   1.800  -4.490  13.788
 1336    HE2  LYS  57           HE3      LYS  57   0.671  -1.869  12.820
 1337    HE3  LYS  57           HE2      LYS  57   1.518  -2.123  14.341
 1338    HZ1  LYS  57           HZ1      LYS  57   2.687  -2.522  11.643
 1339    HZ2  LYS  57           HZ2      LYS  57   3.498  -2.723  13.112
 1340    HZ3  LYS  57           HZ3      LYS  57   2.963  -1.188  12.642
 1341    H    CYS  58           H        CYS  58   1.156  -6.073   9.356
 1342    HA   CYS  58           HA       CYS  58  -0.691  -8.149   8.732
 1343    HB2  CYS  58           HB3      CYS  58   2.221  -8.341   9.542
 1344    HB3  CYS  58           HB2      CYS  58   1.274  -9.640   8.833
 1345    H    ARG  59           H        ARG  59  -1.891  -9.259  10.103
 1346    HA   ARG  59           HA       ARG  59  -1.465  -9.131  12.952
 1347    HB2  ARG  59           HB3      ARG  59  -3.465 -10.599  11.227
 1348    HB3  ARG  59           HB2      ARG  59  -3.448 -10.711  12.979
 1349    HG2  ARG  59           HG3      ARG  59  -3.980  -8.409  13.214
 1350    HG3  ARG  59           HG2      ARG  59  -3.726  -8.113  11.494
 1351    HD2  ARG  59           HD3      ARG  59  -6.125  -8.268  12.177
 1352    HD3  ARG  59           HD2      ARG  59  -5.646  -9.396  10.911
 1353    HE   ARG  59           HE       ARG  59  -5.471 -10.517  13.547
 1354   HH11  ARG  59          HH11      ARG  59  -7.667  -9.840  10.899
 1355   HH12  ARG  59          HH12      ARG  59  -8.747 -11.135  11.303
 1356   HH21  ARG  59          HH21      ARG  59  -6.885 -12.213  14.073
 1357   HH22  ARG  59          HH22      ARG  59  -8.305 -12.485  13.111
 1358    H    ALA  60           H        ALA  60   0.520 -10.094  13.254
 1359    HA   ALA  60           HA       ALA  60   2.031 -11.739  13.650
 1360    HB1  ALA  60           HB1      ALA  60   0.187 -13.102  14.538
 1361    HB2  ALA  60           HB2      ALA  60   1.384 -14.084  13.694
 1362    HB3  ALA  60           HB3      ALA  60  -0.147 -13.695  12.910
 1363    H    SER  61           H        SER  61   3.639 -12.689  12.461
 1364    HA   SER  61           HA       SER  61   3.569 -12.027   9.682
 1365    HB2  SER  61           HB3      SER  61   5.728 -13.368  11.316
 1366    HB3  SER  61           HB2      SER  61   5.928 -12.701   9.694
 1367    HG   SER  61           HG       SER  61   5.147 -10.665  10.689
 1368    H    ASN  62           H        ASN  62   2.538 -14.717  11.304
 1369    HA   ASN  62           HA       ASN  62   2.421 -16.243   8.838
 1370    HB2  ASN  62           HB3      ASN  62   3.830 -17.198  11.315
 1371    HB3  ASN  62           HB2      ASN  62   2.992 -18.354  10.290
 1372   HD21  ASN  62          HD21      ASN  62   3.610 -16.980   7.812
 1373   HD22  ASN  62          HD22      ASN  62   5.294 -17.243   7.512
 1374    HA   PRO  63           HA       PRO  63  -1.658 -16.523  10.885
 1375    HB2  PRO  63           HB3      PRO  63  -2.889 -17.540   8.639
 1376    HB3  PRO  63           HB2      PRO  63  -2.716 -15.811   8.976
 1377    HG2  PRO  63           HG3      PRO  63  -1.079 -17.581   7.211
 1378    HG3  PRO  63           HG2      PRO  63  -1.624 -15.919   6.932
 1379    HD2  PRO  63           HD3      PRO  63   0.904 -16.470   7.689
 1380    HD3  PRO  63           HD2      PRO  63   0.060 -15.005   8.253
 1381    H    VAL  64           H        VAL  64  -0.019 -18.891   8.847
 1382    HA   VAL  64           HA       VAL  64  -1.025 -21.011  10.622
 1383    HB   VAL  64           HB       VAL  64  -0.755 -22.605   8.744
 1384   HG11  VAL  64          HG11      VAL  64  -2.617 -20.300   8.197
 1385   HG12  VAL  64          HG12      VAL  64  -2.953 -21.718   9.192
 1386   HG13  VAL  64          HG13      VAL  64  -2.729 -21.895   7.452
 1387   HG21  VAL  64          HG21      VAL  64  -0.270 -20.132   7.093
 1388   HG22  VAL  64          HG22      VAL  64  -0.550 -21.749   6.449
 1389   HG23  VAL  64          HG23      VAL  64   0.886 -21.422   7.418
 1390    H    GLU  65           H        GLU  65   0.489 -22.773  10.995
 1391    HA   GLU  65           HA       GLU  65   3.120 -21.711  11.464
 1392    HB2  GLU  65           HB3      GLU  65   1.837 -23.151  13.085
 1393    HB3  GLU  65           HB2      GLU  65   2.135 -24.509  12.008
 1394    HG2  GLU  65           HG3      GLU  65   4.544 -24.184  12.284
 1395    HG3  GLU  65           HG2      GLU  65   4.226 -22.856  13.395
 1396    H    SER  66           H        SER  66   3.296 -21.516   9.033
 1397    HA   SER  66           HA       SER  66   5.269 -23.247   8.074
 1398    HB2  SER  66           HB3      SER  66   4.041 -24.315   6.190
 1399    HB3  SER  66           HB2      SER  66   3.464 -24.874   7.760
 1400    HG   SER  66           HG       SER  66   2.091 -23.694   5.790
 1401    H    GLY  67           H        GLY  67   2.793 -20.880   7.557
 1402    HA2  GLY  67           HA3      GLY  67   4.328 -18.916   6.487
 1403    HA3  GLY  67           HA2      GLY  67   3.870 -19.886   5.091
 1404    H    CYS  68           H        CYS  68   2.076 -19.304   4.088
 1405    HA   CYS  68           HA       CYS  68   0.071 -17.751   5.592
 1406    HB2  CYS  68           HB3      CYS  68   0.852 -17.555   2.670
 1407    HB3  CYS  68           HB2      CYS  68  -0.496 -16.681   3.403
 1408    H    ARG  69           H        ARG  69  -2.160 -17.901   4.563
 1409    HA   ARG  69           HA       ARG  69  -2.868 -20.672   4.478
 1410    HB2  ARG  69           HB3      ARG  69  -4.527 -18.177   4.038
 1411    HB3  ARG  69           HB2      ARG  69  -5.191 -19.804   4.103
 1412    HG2  ARG  69           HG3      ARG  69  -4.390 -20.024   6.414
 1413    HG3  ARG  69           HG2      ARG  69  -3.751 -18.382   6.330
 1414    HD2  ARG  69           HD3      ARG  69  -6.650 -19.114   5.944
 1415    HD3  ARG  69           HD2      ARG  69  -5.959 -18.517   7.452
 1416    HE   ARG  69           HE       ARG  69  -6.037 -16.954   4.947
 1417   HH11  ARG  69          HH11      ARG  69  -6.208 -17.191   8.429
 1418   HH12  ARG  69          HH12      ARG  69  -6.539 -15.500   8.665
 1419   HH21  ARG  69          HH21      ARG  69  -6.498 -14.714   5.243
 1420   HH22  ARG  69          HH22      ARG  69  -6.736 -14.104   6.861
 1421    H    GLY  70           H        GLY  70  -3.208 -21.950   2.765
 1422    HA2  GLY  70           HA3      GLY  70  -3.990 -22.428   0.581
 1423    HA3  GLY  70           HA2      GLY  70  -3.769 -20.737   0.159
 1424    H    ILE  71           H        ILE  71  -1.091 -20.592   1.253
 1425    HA   ILE  71           HA       ILE  71   0.341 -21.223  -1.087
 1426    HB   ILE  71           HB       ILE  71   1.397 -20.560   1.661
 1427   HG12  ILE  71          HG13      ILE  71  -0.058 -18.807   0.752
 1428   HG13  ILE  71          HG12      ILE  71   1.618 -18.274   0.793
 1429   HG21  ILE  71          HG21      ILE  71   2.787 -20.459  -1.012
 1430   HG22  ILE  71          HG22      ILE  71   3.085 -21.638   0.265
 1431   HG23  ILE  71          HG23      ILE  71   3.463 -19.937   0.531
 1432   HD11  ILE  71          HD11      ILE  71   0.533 -17.570  -1.251
 1433   HD12  ILE  71          HD12      ILE  71   0.125 -19.241  -1.633
 1434   HD13  ILE  71          HD13      ILE  71   1.812 -18.733  -1.603
 1435    H    ASP  72           H        ASP  72   1.394 -22.980  -1.709
 1436    HA   ASP  72           HA       ASP  72   1.470 -25.384  -0.214
 1437    HB2  ASP  72           HB3      ASP  72   1.552 -25.277  -2.706
 1438    HB3  ASP  72           HB2      ASP  72   3.168 -24.587  -2.599
 1439    H    SER  73           H        SER  73   2.604 -25.520   1.610
 1440    HA   SER  73           HA       SER  73   4.833 -23.779   2.111
 1441    HB2  SER  73           HB3      SER  73   3.674 -25.976   3.842
 1442    HB3  SER  73           HB2      SER  73   4.769 -24.694   4.368
 1443    HG   SER  73           HG       SER  73   2.568 -23.726   3.083
 1444    H    LYS  74           H        LYS  74   4.665 -26.579   0.449
 1445    HA   LYS  74           HA       LYS  74   7.143 -27.723   1.464
 1446    HB2  LYS  74           HB3      LYS  74   5.451 -28.561  -0.900
 1447    HB3  LYS  74           HB2      LYS  74   6.796 -29.464  -0.226
 1448    HG2  LYS  74           HG3      LYS  74   5.518 -29.676   1.897
 1449    HG3  LYS  74           HG2      LYS  74   4.152 -28.898   1.095
 1450    HD2  LYS  74           HD3      LYS  74   5.469 -31.472   0.249
 1451    HD3  LYS  74           HD2      LYS  74   3.920 -31.328   1.076
 1452    HE2  LYS  74           HE3      LYS  74   3.047 -30.055  -0.839
 1453    HE3  LYS  74           HE2      LYS  74   4.592 -30.261  -1.659
 1454    HZ1  LYS  74           HZ1      LYS  74   2.742 -32.440  -0.860
 1455    HZ2  LYS  74           HZ2      LYS  74   4.248 -32.662  -1.596
 1456    HZ3  LYS  74           HZ3      LYS  74   3.005 -31.883  -2.435
 1457    H    HIS  75           H        HIS  75   5.850 -26.092  -1.369
 1458    HA   HIS  75           HA       HIS  75   8.452 -25.965  -2.647
 1459    HB2  HIS  75           HB3      HIS  75   5.715 -24.949  -3.409
 1460    HB3  HIS  75           HB2      HIS  75   7.153 -24.526  -4.330
 1461    HD1  HIS  75           HD1      HIS  75   7.703 -26.055  -6.182
 1462    HD2  HIS  75           HD2      HIS  75   5.368 -27.914  -3.289
 1463    HE1  HIS  75           HE1      HIS  75   7.184 -28.338  -7.099
 1464    HE2  HIS  75           HE2      HIS  75   5.665 -29.396  -5.388
 1465    H    TRP  76           H        TRP  76   6.382 -23.912  -0.716
 1466    HA   TRP  76           HA       TRP  76   8.415 -21.795  -0.874
 1467    HB2  TRP  76           HB3      TRP  76   5.426 -21.346  -1.100
 1468    HB3  TRP  76           HB2      TRP  76   6.655 -20.084  -1.043
 1469    HD1  TRP  76           HD1      TRP  76   4.712 -22.124  -3.422
 1470    HE1  TRP  76           HE1      TRP  76   5.623 -21.848  -5.813
 1471    HE3  TRP  76           HE3      TRP  76   9.148 -19.820  -2.349
 1472    HZ2  TRP  76           HZ2      TRP  76   7.909 -20.795  -7.076
 1473    HZ3  TRP  76           HZ3      TRP  76  10.641 -19.214  -4.207
 1474    HH2  TRP  76           HH2      TRP  76  10.032 -19.692  -6.524
 1475    H    ASN  77           H        ASN  77   9.019 -21.100   1.130
 1476    HA   ASN  77           HA       ASN  77   7.148 -21.444   3.350
 1477    HB2  ASN  77           HB3      ASN  77   9.501 -21.973   3.824
 1478    HB3  ASN  77           HB2      ASN  77   9.983 -20.365   3.297
 1479   HD21  ASN  77          HD21      ASN  77   8.355 -22.197   5.779
 1480   HD22  ASN  77          HD22      ASN  77   8.411 -20.963   6.994
 1481    H    SER  78           H        SER  78   6.107 -19.715   4.302
 1482    HA   SER  78           HA       SER  78   6.160 -17.318   2.600
 1483    HB2  SER  78           HB3      SER  78   3.777 -18.058   4.245
 1484    HB3  SER  78           HB2      SER  78   3.857 -17.200   2.706
 1485    HG   SER  78           HG       SER  78   4.828 -19.529   2.171
 1486    H    TYR  79           H        TYR  79   5.855 -15.299   3.512
 1487    HA   TYR  79           HA       TYR  79   5.776 -15.029   6.407
 1488    HB2  TYR  79           HB3      TYR  79   8.180 -15.159   5.896
 1489    HB3  TYR  79           HB2      TYR  79   8.006 -13.888   4.691
 1490    HD1  TYR  79           HD1      TYR  79   7.879 -11.570   5.345
 1491    HD2  TYR  79           HD2      TYR  79   8.070 -14.634   8.289
 1492    HE1  TYR  79           HE1      TYR  79   8.403  -9.885   7.052
 1493    HE2  TYR  79           HE2      TYR  79   8.590 -12.954  10.007
 1494    HH   TYR  79           HH       TYR  79   9.555 -10.701  10.140
 1495    H    CYS  80           H        CYS  80   4.602 -13.271   6.988
 1496    HA   CYS  80           HA       CYS  80   3.320 -11.770   4.883
 1497    HB2  CYS  80           HB3      CYS  80   3.030 -11.428   7.876
 1498    HB3  CYS  80           HB2      CYS  80   1.916 -10.862   6.629
 1499    H    THR  81           H        THR  81   3.953  -9.870   4.129
 1500    HA   THR  81           HA       THR  81   5.747  -8.220   5.781
 1501    HB   THR  81           HB       THR  81   6.006  -8.617   2.789
 1502    HG1  THR  81           HG1      THR  81   6.658 -10.332   4.571
 1503   HG21  THR  81          HG21      THR  81   7.837  -7.268   4.777
 1504   HG22  THR  81          HG22      THR  81   6.807  -6.441   3.609
 1505   HG23  THR  81          HG23      THR  81   8.137  -7.457   3.051
 1506    H    THR  82           H        THR  82   5.094  -6.147   5.952
 1507    HA   THR  82           HA       THR  82   2.686  -5.338   4.621
 1508    HB   THR  82           HB       THR  82   3.310  -3.128   5.907
 1509    HG1  THR  82           HG1      THR  82   4.920  -3.291   7.269
 1510   HG21  THR  82          HG21      THR  82   1.407  -4.538   6.448
 1511   HG22  THR  82          HG22      THR  82   2.237  -4.047   7.925
 1512   HG23  THR  82          HG23      THR  82   2.463  -5.675   7.287
 1513    H    THR  83           H        THR  83   2.460  -3.970   2.947
 1514    HA   THR  83           HA       THR  83   4.793  -3.305   1.425
 1515    HB   THR  83           HB       THR  83   3.041  -2.110  -0.046
 1516    HG1  THR  83           HG1      THR  83   0.949  -2.484   0.416
 1517   HG21  THR  83          HG21      THR  83   2.870  -5.087   0.438
 1518   HG22  THR  83          HG22      THR  83   4.013  -4.264  -0.624
 1519   HG23  THR  83          HG23      THR  83   2.292  -4.251  -1.003
 1520    H    HIS  84           H        HIS  84   5.661  -1.354   1.037
 1521    HA   HIS  84           HA       HIS  84   5.043   0.662   3.079
 1522    HB2  HIS  84           HB3      HIS  84   7.449   1.442   2.498
 1523    HB3  HIS  84           HB2      HIS  84   7.258  -0.035   3.433
 1524    HD1  HIS  84           HD1      HIS  84   8.609   1.256   0.238
 1525    HD2  HIS  84           HD2      HIS  84   7.807  -2.440   1.964
 1526    HE1  HIS  84           HE1      HIS  84   9.829  -0.428  -1.169
 1527    HE2  HIS  84           HE2      HIS  84   9.074  -2.662  -0.280
 1528    H    THR  85           H        THR  85   4.073   2.453   2.428
 1529    HA   THR  85           HA       THR  85   4.745   3.481  -0.258
 1530    HB   THR  85           HB       THR  85   2.405   2.550  -0.167
 1531    HG1  THR  85           HG1      THR  85   1.623   4.231  -1.359
 1532   HG21  THR  85          HG21      THR  85   0.693   3.813   1.038
 1533   HG22  THR  85          HG22      THR  85   1.938   4.854   1.730
 1534   HG23  THR  85          HG23      THR  85   1.884   3.142   2.152
 1535    H    PHE  86           H        PHE  86   4.370   5.892  -0.411
 1536    HA   PHE  86           HA       PHE  86   5.192   7.107   2.141
 1537    HB2  PHE  86           HB3      PHE  86   5.890   7.938  -0.689
 1538    HB3  PHE  86           HB2      PHE  86   6.312   8.859   0.754
 1539    HD1  PHE  86           HD1      PHE  86   7.800   7.757   2.483
 1540    HD2  PHE  86           HD2      PHE  86   7.252   6.199  -1.439
 1541    HE1  PHE  86           HE1      PHE  86   9.870   6.450   2.720
 1542    HE2  PHE  86           HE2      PHE  86   9.319   4.889  -1.210
 1543    HZ   PHE  86           HZ       PHE  86  10.632   5.010   0.868
 1544    H    VAL  87           H        VAL  87   3.780   8.422   3.035
 1545    HA   VAL  87           HA       VAL  87   1.752   9.666   1.296
 1546    HB   VAL  87           HB       VAL  87   0.299   9.767   3.329
 1547   HG11  VAL  87          HG11      VAL  87  -0.013   8.035   1.657
 1548   HG12  VAL  87          HG12      VAL  87  -0.322   7.395   3.272
 1549   HG13  VAL  87          HG13      VAL  87   1.195   7.026   2.453
 1550   HG21  VAL  87          HG21      VAL  87   0.826   8.352   5.236
 1551   HG22  VAL  87          HG22      VAL  87   2.061   9.594   5.023
 1552   HG23  VAL  87          HG23      VAL  87   2.380   7.934   4.515
 1553    H    LYS  88           H        LYS  88   1.015  11.748   1.829
 1554    HA   LYS  88           HA       LYS  88   3.114  13.515   2.706
 1555    HB2  LYS  88           HB3      LYS  88   0.275  14.165   1.863
 1556    HB3  LYS  88           HB2      LYS  88   1.605  15.305   2.008
 1557    HG2  LYS  88           HG3      LYS  88   2.745  14.313   0.159
 1558    HG3  LYS  88           HG2      LYS  88   1.585  12.992   0.089
 1559    HD2  LYS  88           HD3      LYS  88  -0.188  14.631  -0.440
 1560    HD3  LYS  88           HD2      LYS  88   1.034  15.904  -0.463
 1561    HE2  LYS  88           HE3      LYS  88   2.158  14.880  -2.313
 1562    HE3  LYS  88           HE2      LYS  88   1.125  13.456  -2.216
 1563    HZ1  LYS  88           HZ1      LYS  88   0.461  14.938  -4.008
 1564    HZ2  LYS  88           HZ2      LYS  88   0.213  16.195  -2.904
 1565    HZ3  LYS  88           HZ3      LYS  88  -0.762  14.811  -2.839
 1566    H    ALA  89           H        ALA  89   3.437  13.679   4.823
 1567    HA   ALA  89           HA       ALA  89   1.075  14.130   6.534
 1568    HB1  ALA  89           HB1      ALA  89   3.506  12.503   7.271
 1569    HB2  ALA  89           HB2      ALA  89   1.910  11.855   6.889
 1570    HB3  ALA  89           HB3      ALA  89   2.135  12.859   8.321
 1571    H    LEU  90           H        LEU  90   1.312  15.633   8.155
 1572    HA   LEU  90           HA       LEU  90   3.467  17.512   7.796
 1573    HB2  LEU  90           HB3      LEU  90   1.106  18.215   8.232
 1574    HB3  LEU  90           HB2      LEU  90   1.236  17.512   9.838
 1575    HG   LEU  90           HG       LEU  90   3.144  19.119  10.268
 1576   HD11  LEU  90          HD11      LEU  90   3.718  19.686   7.995
 1577   HD12  LEU  90          HD12      LEU  90   3.192  21.135   8.851
 1578   HD13  LEU  90          HD13      LEU  90   2.103  20.337   7.717
 1579   HD21  LEU  90          HD21      LEU  90   0.435  20.289   9.676
 1580   HD22  LEU  90          HD22      LEU  90   1.655  20.983  10.742
 1581   HD23  LEU  90          HD23      LEU  90   0.893  19.447  11.155
 1582    H    THR  91           H        THR  91   5.210  17.722   9.066
 1583    HA   THR  91           HA       THR  91   5.345  16.089  11.514
 1584    HB   THR  91           HB       THR  91   7.708  15.595  10.999
 1585    HG1  THR  91           HG1      THR  91   7.094  17.181   8.753
 1586   HG21  THR  91          HG21      THR  91   6.063  13.933  10.362
 1587   HG22  THR  91          HG22      THR  91   7.320  14.011   9.128
 1588   HG23  THR  91          HG23      THR  91   5.757  14.774   8.842
 1589    H    THR  92           H        THR  92   6.954  16.884  13.071
 1590    HA   THR  92           HA       THR  92   7.325  19.774  12.794
 1591    HB   THR  92           HB       THR  92   6.222  19.222  14.848
 1592    HG1  THR  92           HG1      THR  92   7.443  20.517  16.000
 1593   HG21  THR  92          HG21      THR  92   7.257  17.775  16.554
 1594   HG22  THR  92          HG22      THR  92   8.519  17.348  15.399
 1595   HG23  THR  92          HG23      THR  92   6.842  16.900  15.083
 1596    H    ASP  93           H        ASP  93   9.143  20.340  11.907
 1597    HA   ASP  93           HA       ASP  93  11.406  18.626  11.697
 1598    HB2  ASP  93           HB3      ASP  93  10.886  20.294   9.969
 1599    HB3  ASP  93           HB2      ASP  93  11.137  21.593  11.131
 1600    H    GLU  94           H        GLU  94  10.491  21.266  13.764
 1601    HA   GLU  94           HA       GLU  94  12.071  20.423  15.911
 1602    HB2  GLU  94           HB3      GLU  94  13.912  21.363  14.499
 1603    HB3  GLU  94           HB2      GLU  94  13.115  22.926  14.566
 1604    HG2  GLU  94           HG3      GLU  94  13.366  22.921  17.012
 1605    HG3  GLU  94           HG2      GLU  94  14.220  21.387  16.898
 1606    H    LYS  95           H        LYS  95  11.463  23.723  14.755
 1607    HA   LYS  95           HA       LYS  95   9.464  24.023  16.893
 1608    HB2  LYS  95           HB3      LYS  95  10.886  26.208  15.356
 1609    HB3  LYS  95           HB2      LYS  95   9.851  26.411  16.759
 1610    HG2  LYS  95           HG3      LYS  95  11.501  25.146  18.104
 1611    HG3  LYS  95           HG2      LYS  95  12.554  25.097  16.689
 1612    HD2  LYS  95           HD3      LYS  95  12.478  27.584  16.635
 1613    HD3  LYS  95           HD2      LYS  95  11.601  27.541  18.164
 1614    HE2  LYS  95           HE3      LYS  95  13.859  27.900  18.728
 1615    HE3  LYS  95           HE2      LYS  95  13.536  26.205  19.082
 1616    HZ1  LYS  95           HZ1      LYS  95  15.656  26.546  17.936
 1617    HZ2  LYS  95           HZ2      LYS  95  14.841  27.201  16.612
 1618    HZ3  LYS  95           HZ3      LYS  95  14.608  25.578  17.028
 1619    H    GLN  96           H        GLN  96   9.997  23.982  13.512
 1620    HA   GLN  96           HA       GLN  96   7.394  25.196  12.942
 1621    HB2  GLN  96           HB3      GLN  96   9.677  24.552  11.059
 1622    HB3  GLN  96           HB2      GLN  96   8.187  25.364  10.616
 1623    HG2  GLN  96           HG3      GLN  96   9.814  27.037  10.800
 1624    HG3  GLN  96           HG2      GLN  96   8.821  27.170  12.249
 1625   HE21  GLN  96          HE21      GLN  96  10.410  28.189  13.433
 1626   HE22  GLN  96          HE22      GLN  96  11.837  27.380  13.977
 1627    H    ALA  97           H        ALA  97   5.930  24.146  11.553
 1628    HA   ALA  97           HA       ALA  97   6.236  21.236  11.466
 1629    HB1  ALA  97           HB1      ALA  97   4.185  22.125  12.486
 1630    HB2  ALA  97           HB2      ALA  97   3.847  21.151  11.055
 1631    HB3  ALA  97           HB3      ALA  97   3.780  22.910  10.959
 1632    H    ALA  98           H        ALA  98   6.686  20.228   9.624
 1633    HA   ALA  98           HA       ALA  98   6.290  21.672   7.092
 1634    HB1  ALA  98           HB1      ALA  98   8.649  21.818   7.733
 1635    HB2  ALA  98           HB2      ALA  98   8.440  20.828   6.289
 1636    HB3  ALA  98           HB3      ALA  98   8.728  20.061   7.850
 1637    H    TRP  99           H        TRP  99   5.639  20.447   5.371
 1638    HA   TRP  99           HA       TRP  99   4.490  17.882   5.968
 1639    HB2  TRP  99           HB3      TRP  99   4.657  19.474   3.399
 1640    HB3  TRP  99           HB2      TRP  99   3.797  17.949   3.554
 1641    HD1  TRP  99           HD1      TRP  99   3.614  21.604   4.721
 1642    HE1  TRP  99           HE1      TRP  99   1.199  22.105   5.457
 1643    HE3  TRP  99           HE3      TRP  99   1.679  16.890   4.371
 1644    HZ2  TRP  99           HZ2      TRP  99  -1.209  20.683   5.831
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.695  16.545   4.934
 1646    HH2  TRP  99           HH2      TRP  99  -2.105  18.404   5.648
 1647    H    ARG 100           H        ARG 100   5.386  15.967   5.691
 1648    HA   ARG 100           HA       ARG 100   7.704  15.734   3.886
 1649    HB2  ARG 100           HB3      ARG 100   7.228  14.231   6.473
 1650    HB3  ARG 100           HB2      ARG 100   8.591  13.993   5.393
 1651    HG2  ARG 100           HG3      ARG 100   7.985  16.515   6.915
 1652    HG3  ARG 100           HG2      ARG 100   9.175  15.304   7.368
 1653    HD2  ARG 100           HD3      ARG 100  10.335  15.726   5.206
 1654    HD3  ARG 100           HD2      ARG 100   9.198  17.040   4.906
 1655    HE   ARG 100           HE       ARG 100  10.708  17.135   7.395
 1656   HH11  ARG 100          HH11      ARG 100  10.341  18.284   4.111
 1657   HH12  ARG 100          HH12      ARG 100  11.344  19.678   4.351
 1658   HH21  ARG 100          HH21      ARG 100  12.043  18.952   7.710
 1659   HH22  ARG 100          HH22      ARG 100  12.311  20.062   6.403
 1660    H    PHE 101           H        PHE 101   8.084  13.365   3.337
 1661    HA   PHE 101           HA       PHE 101   5.493  12.077   2.765
 1662    HB2  PHE 101           HB3      PHE 101   8.093  11.893   1.201
 1663    HB3  PHE 101           HB2      PHE 101   6.609  11.034   0.810
 1664    HD1  PHE 101           HD1      PHE 101   8.309  14.269   0.768
 1665    HD2  PHE 101           HD2      PHE 101   4.716  12.184  -0.148
 1666    HE1  PHE 101           HE1      PHE 101   7.566  16.166  -0.607
 1667    HE2  PHE 101           HE2      PHE 101   3.967  14.075  -1.523
 1668    HZ   PHE 101           HZ       PHE 101   5.390  16.070  -1.756
 1669    H    ILE 102           H        ILE 102   5.221  10.436   4.169
 1670    HA   ILE 102           HA       ILE 102   7.676   9.167   5.203
 1671    HB   ILE 102           HB       ILE 102   6.381   8.643   7.256
 1672   HG12  ILE 102          HG13      ILE 102   4.307  10.543   6.158
 1673   HG13  ILE 102          HG12      ILE 102   4.129   8.794   6.143
 1674   HG21  ILE 102          HG21      ILE 102   6.405  10.924   8.172
 1675   HG22  ILE 102          HG22      ILE 102   6.564  11.563   6.535
 1676   HG23  ILE 102          HG23      ILE 102   7.847  10.563   7.221
 1677   HD11  ILE 102          HD11      ILE 102   2.923   9.771   7.995
 1678   HD12  ILE 102          HD12      ILE 102   4.402  10.530   8.585
 1679   HD13  ILE 102          HD13      ILE 102   4.250   8.772   8.585
 1680    H    ARG 103           H        ARG 103   7.788   7.005   5.463
 1681    HA   ARG 103           HA       ARG 103   6.128   5.443   3.710
 1682    HB2  ARG 103           HB3      ARG 103   7.588   3.560   4.365
 1683    HB3  ARG 103           HB2      ARG 103   8.525   4.963   3.865
 1684    HG2  ARG 103           HG3      ARG 103   9.012   5.511   6.159
 1685    HG3  ARG 103           HG2      ARG 103   7.955   4.224   6.724
 1686    HD2  ARG 103           HD3      ARG 103   9.436   2.572   5.631
 1687    HD3  ARG 103           HD2      ARG 103  10.517   3.888   5.168
 1688    HE   ARG 103           HE       ARG 103  10.101   4.042   7.924
 1689   HH11  ARG 103          HH11      ARG 103  11.619   1.903   5.612
 1690   HH12  ARG 103          HH12      ARG 103  12.806   1.327   6.736
 1691   HH21  ARG 103          HH21      ARG 103  11.670   3.321   9.393
 1692   HH22  ARG 103          HH22      ARG 103  12.837   2.135   8.898
 1693    H    ILE 104           H        ILE 104   4.302   4.496   4.251
 1694    HA   ILE 104           HA       ILE 104   3.973   3.607   7.037
 1695    HB   ILE 104           HB       ILE 104   1.539   3.879   6.795
 1696   HG12  ILE 104          HG13      ILE 104   2.143   5.342   4.223
 1697   HG13  ILE 104          HG12      ILE 104   1.539   3.693   4.287
 1698   HG21  ILE 104          HG21      ILE 104   2.804   5.657   7.840
 1699   HG22  ILE 104          HG22      ILE 104   1.471   6.332   6.902
 1700   HG23  ILE 104          HG23      ILE 104   3.116   6.392   6.268
 1701   HD11  ILE 104          HD11      ILE 104  -0.487   4.462   5.380
 1702   HD12  ILE 104          HD12      ILE 104  -0.234   5.304   3.851
 1703   HD13  ILE 104          HD13      ILE 104   0.129   6.115   5.374
 1704    H    ASP 105           H        ASP 105   2.908   1.669   7.360
 1705    HA   ASP 105           HA       ASP 105   3.159  -0.303   5.273
 1706    HB2  ASP 105           HB3      ASP 105   1.923  -0.536   8.043
 1707    HB3  ASP 105           HB2      ASP 105   2.363  -1.879   6.989
 1708    H    THR 106           H        THR 106   1.659  -0.132   3.675
 1709    HA   THR 106           HA       THR 106  -0.978   0.896   4.416
 1710    HB   THR 106           HB       THR 106   0.163   2.059   2.609
 1711    HG1  THR 106           HG1      THR 106  -2.277   0.813   2.320
 1712   HG21  THR 106          HG21      THR 106   1.496   0.238   1.703
 1713   HG22  THR 106          HG22      THR 106   0.509   0.955   0.430
 1714   HG23  THR 106          HG23      THR 106   0.036  -0.584   1.151
 1715    H    ALA 107           H        ALA 107   0.474  -2.074   3.525
 1716    HA   ALA 107           HA       ALA 107  -2.039  -3.440   3.747
 1717    HB1  ALA 107           HB1      ALA 107  -0.588  -3.556   1.104
 1718    HB2  ALA 107           HB2      ALA 107  -2.135  -2.759   1.390
 1719    HB3  ALA 107           HB3      ALA 107  -2.001  -4.511   1.556
 1720    H    CYS 108           H        CYS 108  -1.628  -5.884   3.338
 1721    HA   CYS 108           HA       CYS 108   1.112  -6.540   4.179
 1722    HB2  CYS 108           HB3      CYS 108  -0.422  -6.700   6.107
 1723    HB3  CYS 108           HB2      CYS 108  -1.445  -7.809   5.193
 1724    H    VAL 109           H        VAL 109   2.083  -7.819   2.787
 1725    HA   VAL 109           HA       VAL 109   0.427  -9.565   1.085
 1726    HB   VAL 109           HB       VAL 109   2.174  -9.463  -0.603
 1727   HG11  VAL 109          HG11      VAL 109   2.034  -7.087  -1.211
 1728   HG12  VAL 109          HG12      VAL 109   1.417  -6.727   0.402
 1729   HG13  VAL 109          HG13      VAL 109   0.481  -7.742  -0.695
 1730   HG21  VAL 109          HG21      VAL 109   3.657  -7.647   1.300
 1731   HG22  VAL 109          HG22      VAL 109   4.134  -8.014  -0.358
 1732   HG23  VAL 109          HG23      VAL 109   4.122  -9.291   0.861
 1733    H    CYS 110           H        CYS 110   1.934 -11.457   0.235
 1734    HA   CYS 110           HA       CYS 110   3.367 -12.534   2.563
 1735    HB2  CYS 110           HB3      CYS 110   1.140 -13.591   2.323
 1736    HB3  CYS 110           HB2      CYS 110   1.562 -14.084   0.691
 1737    H    VAL 111           H        VAL 111   5.423 -12.847   2.098
 1738    HA   VAL 111           HA       VAL 111   6.276 -13.079  -0.671
 1739    HB   VAL 111           HB       VAL 111   8.556 -12.966   0.171
 1740   HG11  VAL 111          HG11      VAL 111   7.392 -10.858  -0.122
 1741   HG12  VAL 111          HG12      VAL 111   8.502 -10.762   1.246
 1742   HG13  VAL 111          HG13      VAL 111   6.770 -10.950   1.527
 1743   HG21  VAL 111          HG21      VAL 111   9.056 -12.766   2.549
 1744   HG22  VAL 111          HG22      VAL 111   8.285 -14.313   2.187
 1745   HG23  VAL 111          HG23      VAL 111   7.353 -13.014   2.933
 1746    H    LEU 112           H        LEU 112   7.447 -14.881  -1.491
 1747    HA   LEU 112           HA       LEU 112   6.976 -17.353   0.042
 1748    HB2  LEU 112           HB3      LEU 112   6.909 -16.969  -2.956
 1749    HB3  LEU 112           HB2      LEU 112   6.682 -18.493  -2.124
 1750    HG   LEU 112           HG       LEU 112   4.836 -16.103  -2.060
 1751   HD11  LEU 112          HD11      LEU 112   4.657 -17.399  -4.089
 1752   HD12  LEU 112          HD12      LEU 112   3.245 -17.693  -3.071
 1753   HD13  LEU 112          HD13      LEU 112   4.535 -18.893  -3.160
 1754   HD21  LEU 112          HD21      LEU 112   4.694 -18.697  -0.532
 1755   HD22  LEU 112          HD22      LEU 112   3.364 -17.551  -0.689
 1756   HD23  LEU 112          HD23      LEU 112   4.847 -17.072   0.136
 1757    H    SER 113           H        SER 113   8.643 -18.713   0.306
 1758    HA   SER 113           HA       SER 113  10.761 -19.090  -1.504
 1759    HB2  SER 113           HB3      SER 113  12.610 -18.107  -0.093
 1760    HB3  SER 113           HB2      SER 113  11.572 -16.911  -0.869
 1761    HG   SER 113           HG       SER 113  11.033 -17.822   1.750
 1762    H    ARG 114           H        ARG 114  10.382 -21.299  -1.030
 1763    HA   ARG 114           HA       ARG 114  11.272 -22.138   1.649
 1764    HB2  ARG 114           HB3      ARG 114   9.250 -23.230   0.614
 1765    HB3  ARG 114           HB2      ARG 114  10.311 -23.895  -0.618
 1766    HG2  ARG 114           HG3      ARG 114   9.839 -25.543   1.089
 1767    HG3  ARG 114           HG2      ARG 114  11.550 -25.108   1.107
 1768    HD2  ARG 114           HD3      ARG 114  11.251 -23.720   3.023
 1769    HD3  ARG 114           HD2      ARG 114   9.499 -23.876   2.929
 1770    HE   ARG 114           HE       ARG 114  10.223 -26.418   3.257
 1771   HH11  ARG 114          HH11      ARG 114  11.309 -23.530   4.915
 1772   HH12  ARG 114          HH12      ARG 114  11.549 -24.336   6.430
 1773   HH21  ARG 114          HH21      ARG 114  10.518 -27.481   5.258
 1774   HH22  ARG 114          HH22      ARG 114  11.079 -26.581   6.632
 1775    H    LYS 115           H        LYS 115  11.991 -22.328  -1.740
 1776    HA   LYS 115           HA       LYS 115  14.730 -23.183  -1.125
 1777    HB2  LYS 115           HB3      LYS 115  14.684 -24.300  -3.390
 1778    HB3  LYS 115           HB2      LYS 115  13.619 -25.034  -2.200
 1779    HG2  LYS 115           HG3      LYS 115  11.717 -23.824  -3.171
 1780    HG3  LYS 115           HG2      LYS 115  12.793 -23.150  -4.400
 1781    HD2  LYS 115           HD3      LYS 115  12.275 -26.089  -3.951
 1782    HD3  LYS 115           HD2      LYS 115  11.519 -25.107  -5.202
 1783    HE2  LYS 115           HE3      LYS 115  14.473 -25.622  -4.911
 1784    HE3  LYS 115           HE2      LYS 115  13.406 -26.416  -6.065
 1785    HZ1  LYS 115           HZ1      LYS 115  12.944 -24.224  -7.035
 1786    HZ2  LYS 115           HZ2      LYS 115  14.580 -24.638  -7.137
 1787    HZ3  LYS 115           HZ3      LYS 115  14.065 -23.521  -5.979
 1788    H    ALA 116           H        ALA 116  16.360 -22.140  -2.284
 1789    HA   ALA 116           HA       ALA 116  15.469 -19.837  -3.890
 1790    HB1  ALA 116           HB1      ALA 116  17.715 -19.843  -1.877
 1791    HB2  ALA 116           HB2      ALA 116  16.132 -19.100  -1.650
 1792    HB3  ALA 116           HB3      ALA 116  17.227 -18.484  -2.889
 1793    H    THR 117           H        THR 117  16.324 -19.768  -5.840
 1794    HA   THR 117           HA       THR 117  18.592 -21.459  -6.503
 1795    HB   THR 117           HB       THR 117  18.162 -20.656  -8.839
 1796    HG1  THR 117           HG1      THR 117  16.718 -19.134  -9.197
 1797   HG21  THR 117          HG21      THR 117  15.797 -21.841  -7.382
 1798   HG22  THR 117          HG22      THR 117  17.158 -22.734  -8.057
 1799   HG23  THR 117          HG23      THR 117  16.045 -21.883  -9.127
 1800    H    ARG 118           H        ARG 118  20.057 -20.203  -8.290
 1801    HA   ARG 118           HA       ARG 118  21.726 -18.702  -8.634
 1802    HB2  ARG 118           HB3      ARG 118  19.896 -16.866  -7.070
 1803    HB3  ARG 118           HB2      ARG 118  21.375 -16.337  -7.850
 1804    HG2  ARG 118           HG3      ARG 118  19.171 -17.673  -9.385
 1805    HG3  ARG 118           HG2      ARG 118  19.174 -15.939  -9.066
 1806    HD2  ARG 118           HD3      ARG 118  21.425 -17.418 -10.429
 1807    HD3  ARG 118           HD2      ARG 118  20.133 -16.572 -11.280
 1808    HE   ARG 118           HE       ARG 118  21.431 -14.877  -9.393
 1809   HH11  ARG 118          HH11      ARG 118  21.808 -16.293 -12.572
 1810   HH12  ARG 118          HH12      ARG 118  22.788 -14.996 -13.172
 1811   HH21  ARG 118          HH21      ARG 118  22.718 -13.161 -10.183
 1812   HH22  ARG 118          HH22      ARG 118  23.310 -13.219 -11.815
  Start of MODEL    5
    1    H1   SER   1           H1       SER   1  22.157  -2.666  -3.202
    2    H2   SER   1           H2       SER   1  22.154  -4.232  -3.837
    3    H3   SER   1           H3       SER   1  23.532  -3.640  -3.064
    4    HA   SER   1           HA       SER   1  22.364  -3.525  -0.979
    5    HB2  SER   1           HB3      SER   1  20.117  -3.130  -1.906
    6    HB3  SER   1           HB2      SER   1  20.095  -4.763  -2.566
    7    HG   SER   1           HG       SER   1  19.662  -3.883   0.016
    8    H    SER   2           H        SER   2  23.920  -4.896  -0.302
    9    HA   SER   2           HA       SER   2  23.927  -7.652  -1.263
   10    HB2  SER   2           HB3      SER   2  26.072  -7.772   0.104
   11    HB3  SER   2           HB2      SER   2  26.094  -6.655  -1.262
   12    HG   SER   2           HG       SER   2  26.010  -4.958   0.092
   13    H    THR   3           H        THR   3  23.771  -5.847   1.785
   14    HA   THR   3           HA       THR   3  23.240  -8.161   3.370
   15    HB   THR   3           HB       THR   3  22.460  -6.311   5.041
   16    HG1  THR   3           HG1      THR   3  23.712  -4.307   4.364
   17   HG21  THR   3          HG21      THR   3  25.319  -6.458   4.078
   18   HG22  THR   3          HG22      THR   3  24.559  -7.554   5.232
   19   HG23  THR   3          HG23      THR   3  24.791  -5.855   5.648
   20    H    HIS   4           H        HIS   4  21.392  -9.214   3.520
   21    HA   HIS   4           HA       HIS   4  18.902  -7.788   2.913
   22    HB2  HIS   4           HB3      HIS   4  18.116  -9.928   1.772
   23    HB3  HIS   4           HB2      HIS   4  19.301  -8.963   0.904
   24    HD1  HIS   4           HD1      HIS   4  21.650  -9.972   0.574
   25    HD2  HIS   4           HD2      HIS   4  19.017 -12.456   2.615
   26    HE1  HIS   4           HE1      HIS   4  22.729 -12.237   0.586
   27    HE2  HIS   4           HE2      HIS   4  21.208 -13.672   1.988
   28    HA   PRO   5           HA       PRO   5  18.113  -9.845   6.896
   29    HB2  PRO   5           HB3      PRO   5  16.096  -7.754   7.172
   30    HB3  PRO   5           HB2      PRO   5  17.494  -8.090   8.194
   31    HG2  PRO   5           HG3      PRO   5  17.323  -5.893   6.616
   32    HG3  PRO   5           HG2      PRO   5  18.864  -6.675   7.007
   33    HD2  PRO   5           HD3      PRO   5  17.221  -6.863   4.508
   34    HD3  PRO   5           HD2      PRO   5  18.985  -6.756   4.698
   35    H    VAL   6           H        VAL   6  17.239 -11.345   5.078
   36    HA   VAL   6           HA       VAL   6  15.619 -12.872   4.625
   37    HB   VAL   6           HB       VAL   6  13.839 -11.240   6.436
   38   HG11  VAL   6          HG11      VAL   6  12.537 -12.609   4.897
   39   HG12  VAL   6          HG12      VAL   6  12.437 -13.248   6.538
   40   HG13  VAL   6          HG13      VAL   6  13.478 -14.031   5.349
   41   HG21  VAL   6          HG21      VAL   6  15.766 -12.115   7.610
   42   HG22  VAL   6          HG22      VAL   6  15.462 -13.726   6.959
   43   HG23  VAL   6          HG23      VAL   6  14.317 -12.999   8.087
   44    H    PHE   7           H        PHE   7  14.897  -9.495   4.264
   45    HA   PHE   7           HA       PHE   7  12.597  -9.580   2.724
   46    HB2  PHE   7           HB3      PHE   7  13.717  -7.524   3.664
   47    HB3  PHE   7           HB2      PHE   7  14.868  -7.624   2.339
   48    HD1  PHE   7           HD1      PHE   7  11.244  -7.309   3.066
   49    HD2  PHE   7           HD2      PHE   7  14.400  -6.614   0.297
   50    HE1  PHE   7           HE1      PHE   7   9.718  -5.991   1.664
   51    HE2  PHE   7           HE2      PHE   7  12.876  -5.295  -1.111
   52    HZ   PHE   7           HZ       PHE   7  10.533  -4.979  -0.432
   53    H    HIS   8           H        HIS   8  15.889  -9.149   1.390
   54    HA   HIS   8           HA       HIS   8  14.981 -10.155  -1.170
   55    HB2  HIS   8           HB3      HIS   8  16.571  -8.242  -0.996
   56    HB3  HIS   8           HB2      HIS   8  17.768  -9.339  -0.328
   57    HD1  HIS   8           HD1      HIS   8  15.754  -8.898  -3.526
   58    HD2  HIS   8           HD2      HIS   8  19.337 -10.547  -2.203
   59    HE1  HIS   8           HE1      HIS   8  17.005  -9.568  -5.600
   60    HE2  HIS   8           HE2      HIS   8  19.238 -10.383  -4.785
   61    H    MET   9           H        MET   9  14.466 -12.175   0.251
   62    HA   MET   9           HA       MET   9  16.573 -14.098  -0.476
   63    HB2  MET   9           HB3      MET   9  14.862 -14.155   2.021
   64    HB3  MET   9           HB2      MET   9  15.813 -15.521   1.458
   65    HG2  MET   9           HG3      MET   9  17.853 -14.165   1.686
   66    HG3  MET   9           HG2      MET   9  16.877 -12.835   2.299
   67    HE1  MET   9           HE1      MET   9  16.243 -16.632   3.052
   68    HE2  MET   9           HE2      MET   9  17.239 -16.882   4.485
   69    HE3  MET   9           HE3      MET   9  17.999 -16.552   2.927
   70    H    GLY  10           H        GLY  10  13.936 -12.932  -1.492
   71    HA2  GLY  10           HA3      GLY  10  12.960 -15.219  -2.802
   72    HA3  GLY  10           HA2      GLY  10  11.920 -14.872  -1.427
   73    H    GLU  11           H        GLU  11  10.995 -12.710  -1.286
   74    HA   GLU  11           HA       GLU  11   9.683 -11.058  -2.137
   75    HB2  GLU  11           HB3      GLU  11  11.904 -10.931  -4.185
   76    HB3  GLU  11           HB2      GLU  11  10.613  -9.742  -4.057
   77    HG2  GLU  11           HG3      GLU  11  11.361  -9.122  -1.839
   78    HG3  GLU  11           HG2      GLU  11  12.595 -10.384  -1.878
   79    H    PHE  12           H        PHE  12   9.521 -13.916  -3.218
   80    HA   PHE  12           HA       PHE  12   8.402 -13.555  -5.852
   81    HB2  PHE  12           HB3      PHE  12   8.422 -15.961  -4.010
   82    HB3  PHE  12           HB2      PHE  12   7.801 -15.972  -5.658
   83    HD1  PHE  12           HD1      PHE  12  10.571 -16.689  -3.659
   84    HD2  PHE  12           HD2      PHE  12   9.529 -15.074  -7.453
   85    HE1  PHE  12           HE1      PHE  12  12.819 -17.224  -4.503
   86    HE2  PHE  12           HE2      PHE  12  11.772 -15.608  -8.300
   87    HZ   PHE  12           HZ       PHE  12  13.422 -16.684  -6.825
   88    H    SER  13           H        SER  13   6.787 -12.012  -5.389
   89    HA   SER  13           HA       SER  13   4.803 -12.284  -3.437
   90    HB2  SER  13           HB3      SER  13   3.532 -10.672  -4.984
   91    HB3  SER  13           HB2      SER  13   5.110 -10.139  -4.412
   92    HG   SER  13           HG       SER  13   4.267 -10.530  -6.932
   93    H    VAL  14           H        VAL  14   2.956 -13.393  -3.330
   94    HA   VAL  14           HA       VAL  14   2.485 -15.624  -4.922
   95    HB   VAL  14           HB       VAL  14   0.225 -15.711  -3.878
   96   HG11  VAL  14          HG11      VAL  14   1.023 -15.977  -1.573
   97   HG12  VAL  14          HG12      VAL  14   2.510 -15.129  -1.999
   98   HG13  VAL  14          HG13      VAL  14   2.137 -16.685  -2.743
   99   HG21  VAL  14          HG21      VAL  14  -0.228 -13.309  -3.783
  100   HG22  VAL  14          HG22      VAL  14   1.046 -13.114  -2.580
  101   HG23  VAL  14          HG23      VAL  14  -0.392 -14.057  -2.195
  102    H    CYS  15           H        CYS  15   1.483 -12.344  -5.369
  103    HA   CYS  15           HA       CYS  15   0.289 -13.135  -7.923
  104    HB2  CYS  15           HB3      CYS  15  -1.506 -12.489  -6.324
  105    HB3  CYS  15           HB2      CYS  15  -0.738 -10.911  -6.137
  106    H    ASP  16           H        ASP  16   0.914 -11.907  -9.648
  107    HA   ASP  16           HA       ASP  16   3.264 -10.331  -9.328
  108    HB2  ASP  16           HB3      ASP  16   1.512 -10.885 -11.736
  109    HB3  ASP  16           HB2      ASP  16   2.968  -9.896 -11.814
  110    H    SER  17           H        SER  17   3.344  -8.301  -8.717
  111    HA   SER  17           HA       SER  17   1.017  -6.572  -9.245
  112    HB2  SER  17           HB3      SER  17   2.840  -6.504  -6.826
  113    HB3  SER  17           HB2      SER  17   1.414  -5.495  -7.096
  114    HG   SER  17           HG       SER  17   1.103  -8.271  -7.210
  115    H    VAL  18           H        VAL  18   1.406  -4.614 -10.122
  116    HA   VAL  18           HA       VAL  18   4.228  -3.899 -10.556
  117    HB   VAL  18           HB       VAL  18   3.086  -4.318 -12.647
  118   HG11  VAL  18          HG11      VAL  18   1.186  -2.955 -13.391
  119   HG12  VAL  18          HG12      VAL  18   1.103  -2.222 -11.788
  120   HG13  VAL  18          HG13      VAL  18   0.797  -3.948 -11.986
  121   HG21  VAL  18          HG21      VAL  18   3.536  -1.374 -12.202
  122   HG22  VAL  18          HG22      VAL  18   3.449  -2.168 -13.774
  123   HG23  VAL  18          HG23      VAL  18   4.753  -2.565 -12.655
  124    H    SER  19           H        SER  19   4.939  -2.283  -9.359
  125    HA   SER  19           HA       SER  19   3.011  -0.383  -8.237
  126    HB2  SER  19           HB3      SER  19   4.934   0.220  -6.711
  127    HB3  SER  19           HB2      SER  19   4.357  -1.443  -6.556
  128    HG   SER  19           HG       SER  19   6.372  -1.056  -8.414
  129    H    VAL  20           H        VAL  20   2.849   1.581  -9.087
  130    HA   VAL  20           HA       VAL  20   5.113   2.595 -10.678
  131    HB   VAL  20           HB       VAL  20   2.181   3.161 -11.128
  132   HG11  VAL  20          HG11      VAL  20   2.934   4.141 -13.250
  133   HG12  VAL  20          HG12      VAL  20   4.608   3.874 -12.763
  134   HG13  VAL  20          HG13      VAL  20   3.588   4.987 -11.848
  135   HG21  VAL  20          HG21      VAL  20   2.369   1.754 -13.119
  136   HG22  VAL  20          HG22      VAL  20   2.690   0.837 -11.646
  137   HG23  VAL  20          HG23      VAL  20   4.027   1.351 -12.675
  138    H    TRP  21           H        TRP  21   5.832   4.602 -10.235
  139    HA   TRP  21           HA       TRP  21   4.394   6.198  -8.246
  140    HB2  TRP  21           HB3      TRP  21   7.173   6.496  -9.420
  141    HB3  TRP  21           HB2      TRP  21   6.461   7.627  -8.278
  142    HD1  TRP  21           HD1      TRP  21   8.045   4.165  -8.474
  143    HE1  TRP  21           HE1      TRP  21   8.546   3.336  -6.091
  144    HE3  TRP  21           HE3      TRP  21   5.616   7.805  -5.816
  145    HZ2  TRP  21           HZ2      TRP  21   7.990   4.122  -3.437
  146    HZ3  TRP  21           HZ3      TRP  21   5.654   7.692  -3.356
  147    HH2  TRP  21           HH2      TRP  21   6.814   5.887  -2.195
  148    H    VAL  22           H        VAL  22   2.758   7.146  -9.326
  149    HA   VAL  22           HA       VAL  22   3.103   8.107 -12.026
  150    HB   VAL  22           HB       VAL  22   0.701   8.302 -10.203
  151   HG11  VAL  22          HG11      VAL  22   0.981   8.695 -13.174
  152   HG12  VAL  22          HG12      VAL  22   0.536   9.910 -11.974
  153   HG13  VAL  22          HG13      VAL  22  -0.555   8.571 -12.320
  154   HG21  VAL  22          HG21      VAL  22  -0.152   6.361 -11.417
  155   HG22  VAL  22          HG22      VAL  22   1.353   5.985 -10.577
  156   HG23  VAL  22          HG23      VAL  22   1.359   6.260 -12.319
  157    H    GLY  23           H        GLY  23   3.946  10.035 -12.433
  158    HA2  GLY  23           HA3      GLY  23   3.731  12.146 -10.408
  159    HA3  GLY  23           HA2      GLY  23   4.838  12.136 -11.779
  160    H    ASP  24           H        ASP  24   1.682  11.183 -12.556
  161    HA   ASP  24           HA       ASP  24   0.599  13.802 -13.004
  162    HB2  ASP  24           HB3      ASP  24   2.146  13.619 -14.927
  163    HB3  ASP  24           HB2      ASP  24   1.354  12.119 -15.409
  164    H    LYS  25           H        LYS  25  -0.868  12.600 -11.562
  165    HA   LYS  25           HA       LYS  25  -2.695  10.818 -13.011
  166    HB2  LYS  25           HB3      LYS  25  -1.913  10.184 -10.711
  167    HB3  LYS  25           HB2      LYS  25  -2.706  11.621 -10.089
  168    HG2  LYS  25           HG3      LYS  25  -4.864  10.764 -10.820
  169    HG3  LYS  25           HG2      LYS  25  -4.079   9.323 -11.467
  170    HD2  LYS  25           HD3      LYS  25  -3.253   8.807  -9.189
  171    HD3  LYS  25           HD2      LYS  25  -4.150  10.196  -8.581
  172    HE2  LYS  25           HE3      LYS  25  -5.459   8.220  -8.181
  173    HE3  LYS  25           HE2      LYS  25  -6.238   9.156  -9.459
  174    HZ1  LYS  25           HZ1      LYS  25  -5.187   7.667 -11.086
  175    HZ2  LYS  25           HZ2      LYS  25  -6.220   6.842 -10.036
  176    HZ3  LYS  25           HZ3      LYS  25  -4.541   6.738  -9.821
  177    H    THR  26           H        THR  26  -4.296  11.853 -14.092
  178    HA   THR  26           HA       THR  26  -4.701  14.646 -13.512
  179    HB   THR  26           HB       THR  26  -4.470  13.863 -15.848
  180    HG1  THR  26           HG1      THR  26  -5.787  15.783 -15.091
  181   HG21  THR  26          HG21      THR  26  -6.413  12.819 -16.956
  182   HG22  THR  26          HG22      THR  26  -7.185  12.626 -15.381
  183   HG23  THR  26          HG23      THR  26  -5.689  11.767 -15.742
  184    H    THR  27           H        THR  27  -6.481  11.686 -12.990
  185    HA   THR  27           HA       THR  27  -8.588  13.258 -11.717
  186    HB   THR  27           HB       THR  27 -10.287  11.632 -12.722
  187    HG1  THR  27           HG1      THR  27  -7.992  10.960 -14.111
  188   HG21  THR  27          HG21      THR  27  -8.956  13.697 -14.471
  189   HG22  THR  27          HG22      THR  27 -10.247  13.983 -13.303
  190   HG23  THR  27          HG23      THR  27 -10.560  13.014 -14.744
  191    H    ALA  28           H        ALA  28  -9.590  12.310 -10.012
  192    HA   ALA  28           HA       ALA  28  -9.154   9.470  -9.496
  193    HB1  ALA  28           HB1      ALA  28  -7.302  10.615  -8.346
  194    HB2  ALA  28           HB2      ALA  28  -8.411   9.832  -7.220
  195    HB3  ALA  28           HB3      ALA  28  -8.475  11.579  -7.452
  196    H    THR  29           H        THR  29 -10.551   8.697  -7.731
  197    HA   THR  29           HA       THR  29 -13.089  10.130  -7.795
  198    HB   THR  29           HB       THR  29 -12.570   7.385  -6.654
  199    HG1  THR  29           HG1      THR  29 -12.949   8.260  -9.301
  200   HG21  THR  29          HG21      THR  29 -15.085   8.735  -7.650
  201   HG22  THR  29          HG22      THR  29 -14.668   8.441  -5.962
  202   HG23  THR  29          HG23      THR  29 -14.974   7.084  -7.044
  203    H    ASP  30           H        ASP  30 -13.568  11.427  -6.227
  204    HA   ASP  30           HA       ASP  30 -12.261  11.590  -3.716
  205    HB2  ASP  30           HB3      ASP  30 -13.512  13.446  -4.918
  206    HB3  ASP  30           HB2      ASP  30 -15.012  12.634  -4.474
  207    H    ILE  31           H        ILE  31 -13.256  11.170  -1.621
  208    HA   ILE  31           HA       ILE  31 -14.384   8.604  -1.377
  209    HB   ILE  31           HB       ILE  31 -13.047   9.712   0.394
  210   HG12  ILE  31          HG13      ILE  31 -15.820   8.940   1.335
  211   HG13  ILE  31          HG12      ILE  31 -14.546   7.796   0.919
  212   HG21  ILE  31          HG21      ILE  31 -14.096  11.364   1.865
  213   HG22  ILE  31          HG22      ILE  31 -15.519  11.386   0.825
  214   HG23  ILE  31          HG23      ILE  31 -13.970  11.958   0.209
  215   HD11  ILE  31          HD11      ILE  31 -14.460   9.818   3.146
  216   HD12  ILE  31          HD12      ILE  31 -13.165   8.698   2.725
  217   HD13  ILE  31          HD13      ILE  31 -14.707   8.081   3.318
  218    H    LYS  32           H        LYS  32 -15.766  11.693  -1.929
  219    HA   LYS  32           HA       LYS  32 -18.443  11.098  -1.102
  220    HB2  LYS  32           HB3      LYS  32 -17.442  13.149  -3.085
  221    HB3  LYS  32           HB2      LYS  32 -19.021  13.138  -2.314
  222    HG2  LYS  32           HG3      LYS  32 -18.122  13.710  -0.223
  223    HG3  LYS  32           HG2      LYS  32 -16.480  13.307  -0.731
  224    HD2  LYS  32           HD3      LYS  32 -16.629  15.154  -2.391
  225    HD3  LYS  32           HD2      LYS  32 -18.167  15.621  -1.664
  226    HE2  LYS  32           HE3      LYS  32 -17.089  16.047   0.444
  227    HE3  LYS  32           HE2      LYS  32 -15.561  15.420  -0.174
  228    HZ1  LYS  32           HZ1      LYS  32 -15.560  17.245  -1.801
  229    HZ2  LYS  32           HZ2      LYS  32 -15.517  17.800  -0.204
  230    HZ3  LYS  32           HZ3      LYS  32 -16.958  17.878  -1.086
  231    H    GLY  33           H        GLY  33 -16.544   9.997  -3.628
  232    HA2  GLY  33           HA3      GLY  33 -17.191   8.425  -5.241
  233    HA3  GLY  33           HA2      GLY  33 -18.873   8.881  -4.982
  234    H    LYS  34           H        LYS  34 -16.638  11.431  -5.402
  235    HA   LYS  34           HA       LYS  34 -17.834  11.999  -8.020
  236    HB2  LYS  34           HB3      LYS  34 -16.391  13.853  -6.121
  237    HB3  LYS  34           HB2      LYS  34 -17.246  14.323  -7.583
  238    HG2  LYS  34           HG3      LYS  34 -18.514  13.076  -5.153
  239    HG3  LYS  34           HG2      LYS  34 -18.521  14.793  -5.539
  240    HD2  LYS  34           HD3      LYS  34 -19.766  14.363  -7.569
  241    HD3  LYS  34           HD2      LYS  34 -19.699  12.625  -7.271
  242    HE2  LYS  34           HE3      LYS  34 -20.970  14.593  -5.386
  243    HE3  LYS  34           HE2      LYS  34 -21.864  13.747  -6.643
  244    HZ1  LYS  34           HZ1      LYS  34 -22.058  12.630  -4.511
  245    HZ2  LYS  34           HZ2      LYS  34 -20.382  12.457  -4.415
  246    HZ3  LYS  34           HZ3      LYS  34 -21.244  11.649  -5.620
  247    H    GLU  35           H        GLU  35 -16.460  12.987  -9.651
  248    HA   GLU  35           HA       GLU  35 -13.763  11.851  -9.600
  249    HB2  GLU  35           HB3      GLU  35 -15.151  11.221 -11.510
  250    HB3  GLU  35           HB2      GLU  35 -15.415  12.913 -11.897
  251    HG2  GLU  35           HG3      GLU  35 -13.074  13.197 -12.418
  252    HG3  GLU  35           HG2      GLU  35 -12.742  11.537 -11.937
  253    H    VAL  36           H        VAL  36 -12.148  13.154  -9.079
  254    HA   VAL  36           HA       VAL  36 -12.457  16.036  -9.614
  255    HB   VAL  36           HB       VAL  36 -10.965  16.436  -7.666
  256   HG11  VAL  36          HG11      VAL  36 -12.648  15.931  -5.935
  257   HG12  VAL  36          HG12      VAL  36 -13.504  14.914  -7.095
  258   HG13  VAL  36          HG13      VAL  36 -13.355  16.650  -7.382
  259   HG21  VAL  36          HG21      VAL  36  -9.862  14.249  -7.623
  260   HG22  VAL  36          HG22      VAL  36 -11.380  13.499  -7.124
  261   HG23  VAL  36          HG23      VAL  36 -10.573  14.651  -6.060
  262    H    THR  37           H        THR  37 -10.544  17.223 -10.081
  263    HA   THR  37           HA       THR  37  -8.679  15.696 -11.702
  264    HB   THR  37           HB       THR  37  -8.921  18.686 -11.348
  265    HG1  THR  37           HG1      THR  37 -10.561  16.979 -12.556
  266   HG21  THR  37          HG21      THR  37  -6.744  17.990 -12.222
  267   HG22  THR  37          HG22      THR  37  -7.691  18.799 -13.471
  268   HG23  THR  37          HG23      THR  37  -7.543  17.042 -13.476
  269    H    VAL  38           H        VAL  38  -6.820  15.022 -10.888
  270    HA   VAL  38           HA       VAL  38  -5.971  16.007  -8.297
  271    HB   VAL  38           HB       VAL  38  -4.782  13.786  -9.964
  272   HG11  VAL  38          HG11      VAL  38  -3.817  13.017  -7.860
  273   HG12  VAL  38          HG12      VAL  38  -4.513  14.407  -7.027
  274   HG13  VAL  38          HG13      VAL  38  -3.268  14.647  -8.254
  275   HG21  VAL  38          HG21      VAL  38  -7.115  13.324  -9.463
  276   HG22  VAL  38          HG22      VAL  38  -6.824  13.642  -7.753
  277   HG23  VAL  38          HG23      VAL  38  -6.055  12.262  -8.537
  278    H    LEU  39           H        LEU  39  -4.077  17.065  -7.871
  279    HA   LEU  39           HA       LEU  39  -2.607  18.056 -10.219
  280    HB2  LEU  39           HB3      LEU  39  -2.728  19.277  -7.459
  281    HB3  LEU  39           HB2      LEU  39  -2.057  20.006  -8.908
  282    HG   LEU  39           HG       LEU  39  -4.979  19.401  -8.456
  283   HD11  LEU  39          HD11      LEU  39  -3.481  22.013  -8.416
  284   HD12  LEU  39          HD12      LEU  39  -4.198  21.198  -7.025
  285   HD13  LEU  39          HD13      LEU  39  -5.232  21.825  -8.310
  286   HD21  LEU  39          HD21      LEU  39  -4.365  19.275 -10.807
  287   HD22  LEU  39          HD22      LEU  39  -3.594  20.857 -10.699
  288   HD23  LEU  39          HD23      LEU  39  -5.338  20.709 -10.487
  289    H    ALA  40           H        ALA  40  -0.618  17.272 -10.473
  290    HA   ALA  40           HA       ALA  40   0.683  15.729  -8.432
  291    HB1  ALA  40           HB1      ALA  40   1.753  16.701 -11.082
  292    HB2  ALA  40           HB2      ALA  40   0.916  15.173 -10.815
  293    HB3  ALA  40           HB3      ALA  40   2.480  15.465 -10.057
  294    H    GLU  41           H        GLU  41   0.897  18.939  -9.736
  295    HA   GLU  41           HA       GLU  41   2.998  19.643  -7.808
  296    HB2  GLU  41           HB3      GLU  41   1.925  21.294 -10.106
  297    HB3  GLU  41           HB2      GLU  41   3.358  21.626  -9.146
  298    HG2  GLU  41           HG3      GLU  41   3.072  19.193 -10.880
  299    HG3  GLU  41           HG2      GLU  41   3.746  20.715 -11.456
  300    H    VAL  42           H        VAL  42   2.227  20.494  -5.960
  301    HA   VAL  42           HA       VAL  42  -0.494  21.558  -5.987
  302    HB   VAL  42           HB       VAL  42  -0.550  21.253  -3.592
  303   HG11  VAL  42          HG11      VAL  42  -1.042  19.316  -4.991
  304   HG12  VAL  42          HG12      VAL  42  -0.321  18.836  -3.455
  305   HG13  VAL  42          HG13      VAL  42   0.653  18.834  -4.925
  306   HG21  VAL  42          HG21      VAL  42   2.326  20.367  -3.771
  307   HG22  VAL  42          HG22      VAL  42   1.311  20.302  -2.331
  308   HG23  VAL  42          HG23      VAL  42   1.743  21.860  -3.036
  309    H    ASN  43           H        ASN  43  -0.912  23.625  -5.810
  310    HA   ASN  43           HA       ASN  43   1.272  25.472  -5.130
  311    HB2  ASN  43           HB3      ASN  43  -1.332  25.938  -6.618
  312    HB3  ASN  43           HB2      ASN  43  -0.189  27.211  -6.203
  313   HD21  ASN  43          HD21      ASN  43  -0.799  24.454  -8.241
  314   HD22  ASN  43          HD22      ASN  43   0.491  24.739  -9.351
  315    H    ILE  44           H        ILE  44   1.206  25.703  -2.943
  316    HA   ILE  44           HA       ILE  44  -1.406  25.974  -1.655
  317    HB   ILE  44           HB       ILE  44   1.307  25.747  -0.343
  318   HG12  ILE  44          HG13      ILE  44  -0.785  23.602  -0.797
  319   HG13  ILE  44          HG12      ILE  44   0.721  23.742  -1.699
  320   HG21  ILE  44          HG21      ILE  44  -1.471  25.391   0.775
  321   HG22  ILE  44          HG22      ILE  44  -0.436  26.794   1.034
  322   HG23  ILE  44          HG23      ILE  44   0.041  25.218   1.664
  323   HD11  ILE  44          HD11      ILE  44   0.933  22.044  -0.009
  324   HD12  ILE  44          HD12      ILE  44   0.436  23.181   1.244
  325   HD13  ILE  44          HD13      ILE  44   1.968  23.412   0.404
  326    H    ASN  45           H        ASN  45   1.670  27.499  -0.752
  327    HA   ASN  45           HA       ASN  45   0.347  30.122  -0.963
  328    HB2  ASN  45           HB3      ASN  45   0.613  29.455   1.405
  329    HB3  ASN  45           HB2      ASN  45   2.339  29.232   1.147
  330   HD21  ASN  45          HD21      ASN  45   0.426  31.881  -0.187
  331   HD22  ASN  45          HD22      ASN  45   1.190  33.124   0.737
  332    H    ASN  46           H        ASN  46   1.350  29.773  -3.151
  333    HA   ASN  46           HA       ASN  46   2.906  30.213  -4.740
  334    HB2  ASN  46           HB3      ASN  46   4.076  31.913  -2.531
  335    HB3  ASN  46           HB2      ASN  46   4.684  31.908  -4.185
  336   HD21  ASN  46          HD21      ASN  46   3.477  34.057  -2.608
  337   HD22  ASN  46          HD22      ASN  46   2.122  34.610  -3.532
  338    H    SER  47           H        SER  47   3.206  27.999  -2.820
  339    HA   SER  47           HA       SER  47   6.036  27.399  -3.314
  340    HB2  SER  47           HB3      SER  47   4.379  26.349  -1.002
  341    HB3  SER  47           HB2      SER  47   6.114  26.145  -1.247
  342    HG   SER  47           HG       SER  47   6.250  28.484  -1.085
  343    H    VAL  48           H        VAL  48   6.153  25.884  -4.835
  344    HA   VAL  48           HA       VAL  48   3.836  24.154  -5.264
  345    HB   VAL  48           HB       VAL  48   6.222  24.547  -7.071
  346   HG11  VAL  48          HG11      VAL  48   5.017  22.463  -7.444
  347   HG12  VAL  48          HG12      VAL  48   4.776  23.580  -8.786
  348   HG13  VAL  48          HG13      VAL  48   3.503  23.355  -7.588
  349   HG21  VAL  48          HG21      VAL  48   3.515  25.875  -7.168
  350   HG22  VAL  48          HG22      VAL  48   4.776  26.017  -8.394
  351   HG23  VAL  48          HG23      VAL  48   5.046  26.658  -6.775
  352    H    PHE  49           H        PHE  49   3.903  22.270  -4.290
  353    HA   PHE  49           HA       PHE  49   6.479  20.838  -4.140
  354    HB2  PHE  49           HB3      PHE  49   4.044  20.606  -2.346
  355    HB3  PHE  49           HB2      PHE  49   5.449  19.548  -2.254
  356    HD1  PHE  49           HD1      PHE  49   4.021  22.688  -1.263
  357    HD2  PHE  49           HD2      PHE  49   7.674  20.544  -1.666
  358    HE1  PHE  49           HE1      PHE  49   5.112  24.263   0.285
  359    HE2  PHE  49           HE2      PHE  49   8.768  22.115  -0.123
  360    HZ   PHE  49           HZ       PHE  49   7.487  23.975   0.853
  361    H    ARG  50           H        ARG  50   6.413  18.549  -4.578
  362    HA   ARG  50           HA       ARG  50   4.060  17.769  -6.159
  363    HB2  ARG  50           HB3      ARG  50   5.595  16.567  -7.702
  364    HB3  ARG  50           HB2      ARG  50   5.796  18.311  -7.729
  365    HG2  ARG  50           HG3      ARG  50   7.778  18.089  -6.305
  366    HG3  ARG  50           HG2      ARG  50   7.574  16.335  -6.314
  367    HD2  ARG  50           HD3      ARG  50   9.251  17.172  -7.954
  368    HD3  ARG  50           HD2      ARG  50   7.940  16.239  -8.674
  369    HE   ARG  50           HE       ARG  50   6.933  18.552  -9.131
  370   HH11  ARG  50          HH11      ARG  50  10.367  17.844  -9.164
  371   HH12  ARG  50          HH12      ARG  50  10.742  19.127 -10.269
  372   HH21  ARG  50          HH21      ARG  50   7.422  20.229 -10.560
  373   HH22  ARG  50          HH22      ARG  50   9.065  20.478 -11.078
  374    H    GLN  51           H        GLN  51   3.597  15.560  -6.276
  375    HA   GLN  51           HA       GLN  51   5.090  13.783  -4.516
  376    HB2  GLN  51           HB3      GLN  51   2.818  12.900  -3.678
  377    HB3  GLN  51           HB2      GLN  51   3.464  14.364  -2.964
  378    HG2  GLN  51           HG3      GLN  51   1.996  15.695  -4.441
  379    HG3  GLN  51           HG2      GLN  51   1.307  14.190  -5.055
  380   HE21  GLN  51          HE21      GLN  51  -0.030  12.973  -3.740
  381   HE22  GLN  51          HE22      GLN  51  -0.733  13.606  -2.291
  382    H    TYR  52           H        TYR  52   5.279  11.785  -5.305
  383    HA   TYR  52           HA       TYR  52   3.968  11.218  -7.843
  384    HB2  TYR  52           HB3      TYR  52   6.085   9.589  -6.414
  385    HB3  TYR  52           HB2      TYR  52   5.582   9.430  -8.093
  386    HD1  TYR  52           HD1      TYR  52   5.870  11.636  -9.537
  387    HD2  TYR  52           HD2      TYR  52   7.987  10.799  -5.942
  388    HE1  TYR  52           HE1      TYR  52   7.616  13.233 -10.196
  389    HE2  TYR  52           HE2      TYR  52   9.738  12.392  -6.595
  390    HH   TYR  52           HH       TYR  52  10.619  13.469  -8.519
  391    H    PHE  53           H        PHE  53   2.272   9.928  -7.981
  392    HA   PHE  53           HA       PHE  53   1.188   8.856  -5.537
  393    HB2  PHE  53           HB3      PHE  53   0.092   8.818  -8.362
  394    HB3  PHE  53           HB2      PHE  53  -0.803   8.362  -6.911
  395    HD1  PHE  53           HD1      PHE  53  -1.510  10.041  -5.311
  396    HD2  PHE  53           HD2      PHE  53   0.571  11.128  -8.856
  397    HE1  PHE  53           HE1      PHE  53  -2.146  12.390  -4.955
  398    HE2  PHE  53           HE2      PHE  53  -0.060  13.480  -8.511
  399    HZ   PHE  53           HZ       PHE  53  -1.415  14.112  -6.558
  400    H    PHE  54           H        PHE  54   1.717   6.962  -4.814
  401    HA   PHE  54           HA       PHE  54   3.008   5.009  -6.503
  402    HB2  PHE  54           HB3      PHE  54   3.883   5.480  -4.257
  403    HB3  PHE  54           HB2      PHE  54   2.346   5.015  -3.544
  404    HD1  PHE  54           HD1      PHE  54   1.945   2.800  -2.925
  405    HD2  PHE  54           HD2      PHE  54   5.209   3.710  -5.501
  406    HE1  PHE  54           HE1      PHE  54   2.773   0.497  -2.687
  407    HE2  PHE  54           HE2      PHE  54   6.039   1.408  -5.270
  408    HZ   PHE  54           HZ       PHE  54   4.821  -0.201  -3.860
  409    H    GLU  55           H        GLU  55   1.573   4.048  -7.821
  410    HA   GLU  55           HA       GLU  55  -0.822   2.848  -6.588
  411    HB2  GLU  55           HB3      GLU  55  -0.373   3.432  -9.525
  412    HB3  GLU  55           HB2      GLU  55  -1.865   2.884  -8.773
  413    HG2  GLU  55           HG3      GLU  55  -1.857   5.056  -7.470
  414    HG3  GLU  55           HG2      GLU  55  -0.553   5.582  -8.538
  415    H    THR  56           H        THR  56  -0.636   0.762  -6.246
  416    HA   THR  56           HA       THR  56   1.086  -0.825  -8.021
  417    HB   THR  56           HB       THR  56  -0.055  -1.614  -5.338
  418    HG1  THR  56           HG1      THR  56   1.475  -0.296  -4.671
  419   HG21  THR  56          HG21      THR  56   2.082  -2.891  -7.053
  420   HG22  THR  56          HG22      THR  56   0.454  -3.519  -6.790
  421   HG23  THR  56          HG23      THR  56   1.596  -3.432  -5.447
  422    H    LYS  57           H        LYS  57   0.125  -1.971  -9.533
  423    HA   LYS  57           HA       LYS  57  -2.735  -2.592  -9.215
  424    HB2  LYS  57           HB3      LYS  57  -1.113  -2.087 -11.716
  425    HB3  LYS  57           HB2      LYS  57  -2.802  -2.583 -11.707
  426    HG2  LYS  57           HG3      LYS  57  -3.450  -0.543 -10.616
  427    HG3  LYS  57           HG2      LYS  57  -1.765  -0.055 -10.444
  428    HD2  LYS  57           HD3      LYS  57  -1.561  -0.008 -12.894
  429    HD3  LYS  57           HD2      LYS  57  -3.268  -0.429 -13.030
  430    HE2  LYS  57           HE3      LYS  57  -3.896   1.613 -11.911
  431    HE3  LYS  57           HE2      LYS  57  -2.205   2.023 -11.647
  432    HZ1  LYS  57           HZ1      LYS  57  -3.104   3.234 -13.514
  433    HZ2  LYS  57           HZ2      LYS  57  -3.548   1.797 -14.284
  434    HZ3  LYS  57           HZ3      LYS  57  -1.913   2.160 -14.049
  435    H    CYS  58           H        CYS  58  -3.504  -4.552 -10.135
  436    HA   CYS  58           HA       CYS  58  -1.692  -6.753  -9.715
  437    HB2  CYS  58           HB3      CYS  58  -4.580  -6.769 -10.634
  438    HB3  CYS  58           HB2      CYS  58  -3.665  -8.168 -10.088
  439    H    ARG  59           H        ARG  59  -0.469  -7.627 -11.239
  440    HA   ARG  59           HA       ARG  59  -0.922  -7.029 -14.037
  441    HB2  ARG  59           HB3      ARG  59   1.142  -8.756 -12.654
  442    HB3  ARG  59           HB2      ARG  59   1.111  -8.444 -14.381
  443    HG2  ARG  59           HG3      ARG  59   1.489  -6.089 -13.997
  444    HG3  ARG  59           HG2      ARG  59   1.416  -6.340 -12.253
  445    HD2  ARG  59           HD3      ARG  59   3.729  -6.169 -13.084
  446    HD3  ARG  59           HD2      ARG  59   3.393  -7.725 -12.331
  447    HE   ARG  59           HE       ARG  59   2.958  -7.854 -15.127
  448   HH11  ARG  59          HH11      ARG  59   5.520  -7.724 -12.750
  449   HH12  ARG  59          HH12      ARG  59   6.648  -8.601 -13.729
  450   HH21  ARG  59          HH21      ARG  59   4.436  -9.009 -16.420
  451   HH22  ARG  59          HH22      ARG  59   6.031  -9.333 -15.824
  452    H    ALA  60           H        ALA  60  -2.932  -7.971 -14.333
  453    HA   ALA  60           HA       ALA  60  -4.398  -9.571 -14.996
  454    HB1  ALA  60           HB1      ALA  60  -3.716 -11.866 -15.406
  455    HB2  ALA  60           HB2      ALA  60  -2.180 -11.578 -14.593
  456    HB3  ALA  60           HB3      ALA  60  -2.545 -10.750 -16.106
  457    H    SER  61           H        SER  61  -6.015 -10.412 -13.854
  458    HA   SER  61           HA       SER  61  -5.915 -10.260 -11.044
  459    HB2  SER  61           HB3      SER  61  -8.245 -11.218 -11.198
  460    HB3  SER  61           HB2      SER  61  -7.969  -9.773 -12.172
  461    HG   SER  61           HG       SER  61  -8.062 -12.476 -13.046
  462    H    ASN  62           H        ASN  62  -5.223 -12.813 -13.202
  463    HA   ASN  62           HA       ASN  62  -4.893 -14.653 -10.945
  464    HB2  ASN  62           HB3      ASN  62  -6.123 -15.434 -13.603
  465    HB3  ASN  62           HB2      ASN  62  -5.773 -16.526 -12.267
  466   HD21  ASN  62          HD21      ASN  62  -7.078 -16.460 -10.424
  467   HD22  ASN  62          HD22      ASN  62  -8.627 -15.700 -10.427
  468    HA   PRO  63           HA       PRO  63  -0.960 -14.172 -13.332
  469    HB2  PRO  63           HB3      PRO  63   0.473 -15.390 -11.255
  470    HB3  PRO  63           HB2      PRO  63   0.290 -13.649 -11.509
  471    HG2  PRO  63           HG3      PRO  63  -1.178 -15.475  -9.674
  472    HG3  PRO  63           HG2      PRO  63  -0.708 -13.785  -9.438
  473    HD2  PRO  63           HD3      PRO  63  -3.249 -14.471  -9.994
  474    HD3  PRO  63           HD2      PRO  63  -2.529 -12.974 -10.642
  475    H    VAL  64           H        VAL  64  -2.054 -16.994 -11.476
  476    HA   VAL  64           HA       VAL  64  -0.970 -18.701 -13.620
  477    HB   VAL  64           HB       VAL  64  -0.812 -20.533 -11.982
  478   HG11  VAL  64          HG11      VAL  64   0.661 -18.035 -11.162
  479   HG12  VAL  64          HG12      VAL  64   1.167 -19.201 -12.383
  480   HG13  VAL  64          HG13      VAL  64   1.097 -19.675 -10.687
  481   HG21  VAL  64          HG21      VAL  64  -1.035 -20.097  -9.593
  482   HG22  VAL  64          HG22      VAL  64  -2.555 -19.812 -10.439
  483   HG23  VAL  64          HG23      VAL  64  -1.555 -18.449  -9.938
  484    H    GLU  65           H        GLU  65  -2.253 -20.650 -14.072
  485    HA   GLU  65           HA       GLU  65  -5.047 -19.955 -14.183
  486    HB2  GLU  65           HB3      GLU  65  -3.773 -21.009 -16.084
  487    HB3  GLU  65           HB2      GLU  65  -3.728 -22.497 -15.148
  488    HG2  GLU  65           HG3      GLU  65  -5.513 -22.492 -16.828
  489    HG3  GLU  65           HG2      GLU  65  -6.131 -22.641 -15.183
  490    H    SER  66           H        SER  66  -5.209 -19.986 -11.845
  491    HA   SER  66           HA       SER  66  -6.688 -22.088 -10.825
  492    HB2  SER  66           HB3      SER  66  -4.506 -23.339 -10.861
  493    HB3  SER  66           HB2      SER  66  -3.847 -22.138  -9.752
  494    HG   SER  66           HG       SER  66  -4.594 -23.937  -8.611
  495    H    GLY  67           H        GLY  67  -4.621 -19.360 -10.428
  496    HA2  GLY  67           HA3      GLY  67  -6.107 -17.628  -9.115
  497    HA3  GLY  67           HA2      GLY  67  -5.677 -18.710  -7.791
  498    H    CYS  68           H        CYS  68  -3.845 -18.321  -6.740
  499    HA   CYS  68           HA       CYS  68  -1.922 -16.459  -7.964
  500    HB2  CYS  68           HB3      CYS  68  -2.502 -17.018  -5.044
  501    HB3  CYS  68           HB2      CYS  68  -1.225 -15.945  -5.624
  502    H    ARG  69           H        ARG  69   0.355 -16.762  -7.091
  503    HA   ARG  69           HA       ARG  69   1.214 -19.383  -7.806
  504    HB2  ARG  69           HB3      ARG  69   2.823 -17.186  -6.474
  505    HB3  ARG  69           HB2      ARG  69   3.471 -18.582  -7.327
  506    HG2  ARG  69           HG3      ARG  69   2.418 -17.705  -9.414
  507    HG3  ARG  69           HG2      ARG  69   1.965 -16.259  -8.510
  508    HD2  ARG  69           HD3      ARG  69   4.368 -15.920  -7.955
  509    HD3  ARG  69           HD2      ARG  69   4.761 -17.273  -9.019
  510    HE   ARG  69           HE       ARG  69   3.425 -14.816  -9.981
  511   HH11  ARG  69          HH11      ARG  69   5.833 -17.341 -10.330
  512   HH12  ARG  69          HH12      ARG  69   6.436 -16.724 -11.835
  513   HH21  ARG  69          HH21      ARG  69   4.241 -13.976 -11.922
  514   HH22  ARG  69          HH22      ARG  69   5.534 -14.804 -12.742
  515    H    GLY  70           H        GLY  70   1.489 -21.113  -6.558
  516    HA2  GLY  70           HA3      GLY  70   2.269 -22.219  -4.599
  517    HA3  GLY  70           HA2      GLY  70   1.951 -20.753  -3.681
  518    H    ILE  71           H        ILE  71  -0.720 -20.567  -5.126
  519    HA   ILE  71           HA       ILE  71  -2.182 -22.045  -3.130
  520    HB   ILE  71           HB       ILE  71  -3.277 -20.389  -5.406
  521   HG12  ILE  71          HG13      ILE  71  -1.809 -19.049  -3.942
  522   HG13  ILE  71          HG12      ILE  71  -3.494 -18.568  -3.786
  523   HG21  ILE  71          HG21      ILE  71  -5.307 -20.277  -4.036
  524   HG22  ILE  71          HG22      ILE  71  -4.553 -21.329  -2.838
  525   HG23  ILE  71          HG23      ILE  71  -4.899 -21.940  -4.455
  526   HD11  ILE  71          HD11      ILE  71  -1.970 -20.315  -1.869
  527   HD12  ILE  71          HD12      ILE  71  -3.658 -19.835  -1.706
  528   HD13  ILE  71          HD13      ILE  71  -2.383 -18.619  -1.630
  529    H    ASP  72           H        ASP  72  -2.710 -24.088  -3.394
  530    HA   ASP  72           HA       ASP  72  -3.904 -24.936  -5.906
  531    HB2  ASP  72           HB3      ASP  72  -1.581 -25.606  -6.191
  532    HB3  ASP  72           HB2      ASP  72  -1.585 -26.398  -4.618
  533    H    SER  73           H        SER  73  -5.868 -25.156  -4.952
  534    HA   SER  73           HA       SER  73  -6.224 -27.481  -3.290
  535    HB2  SER  73           HB3      SER  73  -5.787 -25.751  -1.598
  536    HB3  SER  73           HB2      SER  73  -7.057 -24.746  -2.293
  537    HG   SER  73           HG       SER  73  -7.348 -26.493  -0.404
  538    H    LYS  74           H        LYS  74  -8.294 -28.286  -3.372
  539    HA   LYS  74           HA       LYS  74  -9.762 -27.607  -5.723
  540    HB2  LYS  74           HB3      LYS  74  -9.431 -29.920  -4.942
  541    HB3  LYS  74           HB2      LYS  74 -10.354 -29.562  -3.496
  542    HG2  LYS  74           HG3      LYS  74 -12.359 -29.267  -4.779
  543    HG3  LYS  74           HG2      LYS  74 -11.463 -29.442  -6.290
  544    HD2  LYS  74           HD3      LYS  74 -12.638 -31.508  -5.694
  545    HD3  LYS  74           HD2      LYS  74 -10.890 -31.731  -5.695
  546    HE2  LYS  74           HE3      LYS  74 -10.859 -31.493  -3.264
  547    HE3  LYS  74           HE2      LYS  74 -12.609 -31.280  -3.261
  548    HZ1  LYS  74           HZ1      LYS  74 -11.142 -33.708  -4.138
  549    HZ2  LYS  74           HZ2      LYS  74 -12.819 -33.514  -4.196
  550    HZ3  LYS  74           HZ3      LYS  74 -12.024 -33.538  -2.704
  551    H    HIS  75           H        HIS  75  -9.815 -26.460  -2.563
  552    HA   HIS  75           HA       HIS  75 -12.545 -25.427  -2.934
  553    HB2  HIS  75           HB3      HIS  75 -11.212 -26.421  -0.425
  554    HB3  HIS  75           HB2      HIS  75 -12.589 -25.325  -0.363
  555    HD1  HIS  75           HD1      HIS  75 -11.679 -28.870  -0.900
  556    HD2  HIS  75           HD2      HIS  75 -15.027 -26.440  -1.362
  557    HE1  HIS  75           HE1      HIS  75 -13.624 -30.439  -1.198
  558    HE2  HIS  75           HE2      HIS  75 -15.618 -28.946  -1.580
  559    H    TRP  76           H        TRP  76  -9.711 -24.359  -3.472
  560    HA   TRP  76           HA       TRP  76 -10.349 -21.719  -2.376
  561    HB2  TRP  76           HB3      TRP  76  -7.607 -22.990  -2.330
  562    HB3  TRP  76           HB2      TRP  76  -7.873 -21.263  -2.145
  563    HD1  TRP  76           HD1      TRP  76  -7.179 -24.088  -0.085
  564    HE1  TRP  76           HE1      TRP  76  -8.001 -23.765   2.328
  565    HE3  TRP  76           HE3      TRP  76 -10.384 -20.171  -0.828
  566    HZ2  TRP  76           HZ2      TRP  76  -9.768 -22.082   3.734
  567    HZ3  TRP  76           HZ3      TRP  76 -11.601 -19.266   1.109
  568    HH2  TRP  76           HH2      TRP  76 -11.300 -20.206   3.342
  569    H    ASN  77           H        ASN  77 -10.754 -20.477  -4.037
  570    HA   ASN  77           HA       ASN  77  -8.928 -20.604  -6.357
  571    HB2  ASN  77           HB3      ASN  77 -11.349 -20.988  -6.886
  572    HB3  ASN  77           HB2      ASN  77 -11.707 -19.395  -6.233
  573   HD21  ASN  77          HD21      ASN  77  -8.951 -20.361  -8.230
  574   HD22  ASN  77          HD22      ASN  77  -9.350 -19.342  -9.571
  575    H    SER  78           H        SER  78  -7.747 -18.768  -6.798
  576    HA   SER  78           HA       SER  78  -7.962 -16.680  -4.748
  577    HB2  SER  78           HB3      SER  78  -5.639 -16.955  -6.626
  578    HB3  SER  78           HB2      SER  78  -5.674 -16.307  -4.987
  579    HG   SER  78           HG       SER  78  -5.654 -18.303  -4.170
  580    H    TYR  79           H        TYR  79  -8.160 -14.534  -5.257
  581    HA   TYR  79           HA       TYR  79  -7.833 -13.776  -8.049
  582    HB2  TYR  79           HB3      TYR  79  -9.836 -12.286  -7.951
  583    HB3  TYR  79           HB2      TYR  79 -10.225 -13.999  -7.907
  584    HD1  TYR  79           HD1      TYR  79 -10.756 -10.835  -6.377
  585    HD2  TYR  79           HD2      TYR  79 -10.714 -15.014  -5.562
  586    HE1  TYR  79           HE1      TYR  79 -12.180 -10.462  -4.402
  587    HE2  TYR  79           HE2      TYR  79 -12.127 -14.648  -3.585
  588    HH   TYR  79           HH       TYR  79 -13.707 -11.667  -2.968
  589    H    CYS  80           H        CYS  80  -6.813 -11.896  -8.337
  590    HA   CYS  80           HA       CYS  80  -5.679 -10.670  -5.961
  591    HB2  CYS  80           HB3      CYS  80  -5.111 -10.172  -8.896
  592    HB3  CYS  80           HB2      CYS  80  -4.174  -9.534  -7.543
  593    H    THR  81           H        THR  81  -6.244  -8.752  -5.159
  594    HA   THR  81           HA       THR  81  -7.867  -6.944  -6.816
  595    HB   THR  81           HB       THR  81  -8.524  -7.715  -3.957
  596    HG1  THR  81           HG1      THR  81  -9.087  -9.325  -5.514
  597   HG21  THR  81          HG21      THR  81  -9.978  -5.898  -5.886
  598   HG22  THR  81          HG22      THR  81  -9.097  -5.388  -4.447
  599   HG23  THR  81          HG23      THR  81 -10.549  -6.374  -4.289
  600    H    THR  82           H        THR  82  -7.258  -4.845  -6.635
  601    HA   THR  82           HA       THR  82  -4.985  -4.234  -4.987
  602    HB   THR  82           HB       THR  82  -5.235  -1.930  -6.012
  603    HG1  THR  82           HG1      THR  82  -6.777  -1.565  -7.460
  604   HG21  THR  82          HG21      THR  82  -3.672  -3.538  -6.916
  605   HG22  THR  82          HG22      THR  82  -4.458  -2.669  -8.235
  606   HG23  THR  82          HG23      THR  82  -4.959  -4.313  -7.841
  607    H    THR  83           H        THR  83  -4.943  -3.191  -3.115
  608    HA   THR  83           HA       THR  83  -7.382  -2.536  -1.759
  609    HB   THR  83           HB       THR  83  -4.551  -1.895  -0.909
  610    HG1  THR  83           HG1      THR  83  -5.804  -4.285  -1.197
  611   HG21  THR  83          HG21      THR  83  -6.315  -0.761   0.374
  612   HG22  THR  83          HG22      THR  83  -5.477  -1.966   1.351
  613   HG23  THR  83          HG23      THR  83  -7.077  -2.319   0.695
  614    H    HIS  84           H        HIS  84  -8.382  -0.624  -1.741
  615    HA   HIS  84           HA       HIS  84  -6.970   1.669  -2.923
  616    HB2  HIS  84           HB3      HIS  84  -9.933   1.087  -2.698
  617    HB3  HIS  84           HB2      HIS  84  -9.276   2.613  -3.280
  618    HD1  HIS  84           HD1      HIS  84  -9.917  -0.899  -4.288
  619    HD2  HIS  84           HD2      HIS  84  -8.075   2.483  -5.850
  620    HE1  HIS  84           HE1      HIS  84  -9.545  -1.393  -6.720
  621    HE2  HIS  84           HE2      HIS  84  -8.179   0.548  -7.556
  622    H    THR  85           H        THR  85  -6.352   3.224  -1.586
  623    HA   THR  85           HA       THR  85  -7.825   3.500   0.957
  624    HB   THR  85           HB       THR  85  -5.350   2.890   1.110
  625    HG1  THR  85           HG1      THR  85  -5.271   4.015   2.956
  626   HG21  THR  85          HG21      THR  85  -4.522   4.319  -0.692
  627   HG22  THR  85          HG22      THR  85  -3.751   4.738   0.838
  628   HG23  THR  85          HG23      THR  85  -5.041   5.754   0.193
  629    H    PHE  86           H        PHE  86  -7.944   5.760   1.782
  630    HA   PHE  86           HA       PHE  86  -8.343   7.588  -0.486
  631    HB2  PHE  86           HB3      PHE  86  -9.776   7.395   2.169
  632    HB3  PHE  86           HB2      PHE  86  -9.909   8.805   1.118
  633    HD1  PHE  86           HD1      PHE  86 -10.943   5.374   1.675
  634    HD2  PHE  86           HD2      PHE  86 -10.947   8.601  -1.099
  635    HE1  PHE  86           HE1      PHE  86 -12.742   4.271   0.402
  636    HE2  PHE  86           HE2      PHE  86 -12.741   7.508  -2.377
  637    HZ   PHE  86           HZ       PHE  86 -13.641   5.344  -1.628
  638    H    VAL  87           H        VAL  87  -6.865   9.088  -0.658
  639    HA   VAL  87           HA       VAL  87  -5.576  10.094   1.799
  640    HB   VAL  87           HB       VAL  87  -3.613  10.669   0.368
  641   HG11  VAL  87          HG11      VAL  87  -3.543   8.660   1.691
  642   HG12  VAL  87          HG12      VAL  87  -2.788   8.347   0.126
  643   HG13  VAL  87          HG13      VAL  87  -4.424   7.769   0.450
  644   HG21  VAL  87          HG21      VAL  87  -4.755  10.759  -1.797
  645   HG22  VAL  87          HG22      VAL  87  -5.029   9.017  -1.723
  646   HG23  VAL  87          HG23      VAL  87  -3.386   9.649  -1.835
  647    H    LYS  88           H        LYS  88  -5.627  12.259   2.168
  648    HA   LYS  88           HA       LYS  88  -7.233  13.868   0.397
  649    HB2  LYS  88           HB3      LYS  88  -6.784  15.702   2.086
  650    HB3  LYS  88           HB2      LYS  88  -7.642  14.291   2.684
  651    HG2  LYS  88           HG3      LYS  88  -5.823  13.558   3.919
  652    HG3  LYS  88           HG2      LYS  88  -4.679  14.517   2.987
  653    HD2  LYS  88           HD3      LYS  88  -6.814  15.781   4.677
  654    HD3  LYS  88           HD2      LYS  88  -5.232  15.350   5.332
  655    HE2  LYS  88           HE3      LYS  88  -5.828  17.270   3.094
  656    HE3  LYS  88           HE2      LYS  88  -5.181  17.653   4.687
  657    HZ1  LYS  88           HZ1      LYS  88  -3.390  17.643   3.144
  658    HZ2  LYS  88           HZ2      LYS  88  -3.830  16.133   2.524
  659    HZ3  LYS  88           HZ3      LYS  88  -3.227  16.255   4.105
  660    H    ALA  89           H        ALA  89  -6.215  14.222  -1.447
  661    HA   ALA  89           HA       ALA  89  -3.587  15.570  -1.362
  662    HB1  ALA  89           HB1      ALA  89  -3.242  14.773  -3.645
  663    HB2  ALA  89           HB2      ALA  89  -4.838  14.024  -3.640
  664    HB3  ALA  89           HB3      ALA  89  -3.578  13.416  -2.565
  665    H    LEU  90           H        LEU  90  -3.289  17.329  -2.907
  666    HA   LEU  90           HA       LEU  90  -5.576  19.036  -2.902
  667    HB2  LEU  90           HB3      LEU  90  -3.191  19.820  -2.631
  668    HB3  LEU  90           HB2      LEU  90  -2.960  19.488  -4.343
  669    HG   LEU  90           HG       LEU  90  -4.896  21.110  -4.761
  670   HD11  LEU  90          HD11      LEU  90  -5.796  21.202  -2.526
  671   HD12  LEU  90          HD12      LEU  90  -5.232  22.801  -3.009
  672   HD13  LEU  90          HD13      LEU  90  -4.266  21.822  -1.903
  673   HD21  LEU  90          HD21      LEU  90  -3.440  23.050  -4.658
  674   HD22  LEU  90          HD22      LEU  90  -2.552  21.637  -5.233
  675   HD23  LEU  90          HD23      LEU  90  -2.348  22.194  -3.571
  676    H    THR  91           H        THR  91  -7.176  18.531  -4.217
  677    HA   THR  91           HA       THR  91  -6.552  18.144  -7.070
  678    HB   THR  91           HB       THR  91  -8.499  16.711  -7.287
  679    HG1  THR  91           HG1      THR  91  -9.131  17.823  -4.886
  680   HG21  THR  91          HG21      THR  91  -6.905  15.838  -4.869
  681   HG22  THR  91          HG22      THR  91  -6.408  15.620  -6.543
  682   HG23  THR  91          HG23      THR  91  -7.840  14.792  -5.939
  683    H    THR  92           H        THR  92  -8.204  19.019  -8.530
  684    HA   THR  92           HA       THR  92  -9.620  21.242  -7.240
  685    HB   THR  92           HB       THR  92  -7.862  22.032  -8.743
  686    HG1  THR  92           HG1      THR  92  -9.964  23.126  -8.546
  687   HG21  THR  92          HG21      THR  92  -7.786  20.169 -10.320
  688   HG22  THR  92          HG22      THR  92  -8.015  21.701 -11.164
  689   HG23  THR  92          HG23      THR  92  -9.382  20.610 -10.930
  690    H    ASP  93           H        ASP  93 -11.696  21.058  -7.131
  691    HA   ASP  93           HA       ASP  93 -13.178  19.054  -8.483
  692    HB2  ASP  93           HB3      ASP  93 -14.140  21.491  -6.965
  693    HB3  ASP  93           HB2      ASP  93 -15.160  20.149  -7.468
  694    H    GLU  94           H        GLU  94 -12.479  22.397  -9.124
  695    HA   GLU  94           HA       GLU  94 -13.237  22.197 -11.835
  696    HB2  GLU  94           HB3      GLU  94 -15.509  22.379 -10.876
  697    HB3  GLU  94           HB2      GLU  94 -15.057  23.892 -10.110
  698    HG2  GLU  94           HG3      GLU  94 -16.361  24.249 -12.129
  699    HG3  GLU  94           HG2      GLU  94 -14.747  24.933 -12.262
  700    H    LYS  95           H        LYS  95 -13.476  24.931  -9.554
  701    HA   LYS  95           HA       LYS  95 -11.175  26.140 -10.929
  702    HB2  LYS  95           HB3      LYS  95 -13.501  27.440  -9.512
  703    HB3  LYS  95           HB2      LYS  95 -12.079  28.320 -10.053
  704    HG2  LYS  95           HG3      LYS  95 -12.560  27.659 -12.358
  705    HG3  LYS  95           HG2      LYS  95 -13.991  26.793 -11.805
  706    HD2  LYS  95           HD3      LYS  95 -14.929  28.891 -10.964
  707    HD3  LYS  95           HD2      LYS  95 -13.490  29.750 -11.515
  708    HE2  LYS  95           HE3      LYS  95 -15.324  30.002 -13.103
  709    HE3  LYS  95           HE2      LYS  95 -13.976  29.119 -13.812
  710    HZ1  LYS  95           HZ1      LYS  95 -16.428  27.872 -12.698
  711    HZ2  LYS  95           HZ2      LYS  95 -15.152  27.061 -13.457
  712    HZ3  LYS  95           HZ3      LYS  95 -16.124  28.121 -14.344
  713    H    GLN  96           H        GLN  96 -12.486  25.157  -7.876
  714    HA   GLN  96           HA       GLN  96 -10.352  26.470  -6.393
  715    HB2  GLN  96           HB3      GLN  96 -12.619  26.502  -5.440
  716    HB3  GLN  96           HB2      GLN  96 -12.649  24.745  -5.432
  717    HG2  GLN  96           HG3      GLN  96 -12.192  25.569  -3.219
  718    HG3  GLN  96           HG2      GLN  96 -10.773  24.732  -3.850
  719   HE21  GLN  96          HE21      GLN  96  -9.273  25.772  -2.607
  720   HE22  GLN  96          HE22      GLN  96  -8.915  27.457  -2.756
  721    H    ALA  97           H        ALA  97  -8.634  25.458  -5.541
  722    HA   ALA  97           HA       ALA  97  -8.372  22.567  -5.963
  723    HB1  ALA  97           HB1      ALA  97  -6.276  24.609  -5.216
  724    HB2  ALA  97           HB2      ALA  97  -6.541  23.943  -6.827
  725    HB3  ALA  97           HB3      ALA  97  -5.987  22.896  -5.521
  726    H    ALA  98           H        ALA  98  -8.524  21.204  -4.274
  727    HA   ALA  98           HA       ALA  98  -8.068  22.193  -1.570
  728    HB1  ALA  98           HB1      ALA  98 -10.212  21.350  -0.758
  729    HB2  ALA  98           HB2      ALA  98 -10.671  20.916  -2.405
  730    HB3  ALA  98           HB3      ALA  98 -10.444  22.610  -1.969
  731    H    TRP  99           H        TRP  99  -7.708  20.536  -0.048
  732    HA   TRP  99           HA       TRP  99  -6.520  18.181  -1.181
  733    HB2  TRP  99           HB3      TRP  99  -6.934  18.936   1.725
  734    HB3  TRP  99           HB2      TRP  99  -5.911  17.634   1.136
  735    HD1  TRP  99           HD1      TRP  99  -6.066  21.456   1.326
  736    HE1  TRP  99           HE1      TRP  99  -3.701  22.397   0.945
  737    HE3  TRP  99           HE3      TRP  99  -3.661  17.125   0.080
  738    HZ2  TRP  99           HZ2      TRP  99  -1.156  21.431   0.215
  739    HZ3  TRP  99           HZ3      TRP  99  -1.254  17.220  -0.448
  740    HH2  TRP  99           HH2      TRP  99  -0.032  19.330  -0.380
  741    H    ARG 100           H        ARG 100  -8.101  16.937  -2.072
  742    HA   ARG 100           HA       ARG 100 -10.425  16.194  -0.448
  743    HB2  ARG 100           HB3      ARG 100  -9.806  15.556  -3.344
  744    HB3  ARG 100           HB2      ARG 100 -11.326  15.249  -2.521
  745    HG2  ARG 100           HG3      ARG 100 -10.160  17.978  -3.020
  746    HG3  ARG 100           HG2      ARG 100 -11.387  17.203  -4.013
  747    HD2  ARG 100           HD3      ARG 100 -12.836  17.077  -1.978
  748    HD3  ARG 100           HD2      ARG 100 -11.631  18.051  -1.136
  749    HE   ARG 100           HE       ARG 100 -12.582  19.186  -3.621
  750   HH11  ARG 100          HH11      ARG 100 -13.078  18.999  -0.149
  751   HH12  ARG 100          HH12      ARG 100 -13.948  20.499  -0.079
  752   HH21  ARG 100          HH21      ARG 100 -13.697  21.119  -3.531
  753   HH22  ARG 100          HH22      ARG 100 -14.303  21.712  -2.010
  754    H    PHE 101           H        PHE 101 -10.924  14.063   0.013
  755    HA   PHE 101           HA       PHE 101  -8.659  12.275   0.191
  756    HB2  PHE 101           HB3      PHE 101 -11.542  11.970   1.076
  757    HB3  PHE 101           HB2      PHE 101 -10.301  10.755   1.338
  758    HD1  PHE 101           HD1      PHE 101 -11.309  14.218   2.191
  759    HD2  PHE 101           HD2      PHE 101  -8.790  10.910   3.120
  760    HE1  PHE 101           HE1      PHE 101 -10.671  15.300   4.303
  761    HE2  PHE 101           HE2      PHE 101  -8.146  11.993   5.233
  762    HZ   PHE 101           HZ       PHE 101  -9.090  14.188   5.826
  763    H    ILE 102           H        ILE 102  -8.097  11.271  -1.633
  764    HA   ILE 102           HA       ILE 102 -10.245  10.235  -3.366
  765    HB   ILE 102           HB       ILE 102  -8.578  10.299  -5.212
  766   HG12  ILE 102          HG13      ILE 102  -6.902  11.901  -3.273
  767   HG13  ILE 102          HG12      ILE 102  -6.551  10.249  -3.762
  768   HG21  ILE 102          HG21      ILE 102  -9.126  12.931  -3.854
  769   HG22  ILE 102          HG22      ILE 102 -10.201  12.080  -4.964
  770   HG23  ILE 102          HG23      ILE 102  -8.665  12.726  -5.543
  771   HD11  ILE 102          HD11      ILE 102  -6.606  12.667  -5.552
  772   HD12  ILE 102          HD12      ILE 102  -6.307  11.012  -6.081
  773   HD13  ILE 102          HD13      ILE 102  -5.174  11.806  -4.985
  774    H    ARG 103           H        ARG 103 -10.052   8.193  -4.245
  775    HA   ARG 103           HA       ARG 103  -8.606   6.351  -2.541
  776    HB2  ARG 103           HB3      ARG 103  -9.842   4.588  -3.763
  777    HB3  ARG 103           HB2      ARG 103 -10.910   5.812  -3.090
  778    HG2  ARG 103           HG3      ARG 103 -11.176   6.827  -5.260
  779    HG3  ARG 103           HG2      ARG 103 -10.011   5.708  -5.959
  780    HD2  ARG 103           HD3      ARG 103 -11.510   3.832  -5.396
  781    HD3  ARG 103           HD2      ARG 103 -12.686   4.985  -4.759
  782    HE   ARG 103           HE       ARG 103 -12.031   5.698  -7.399
  783   HH11  ARG 103          HH11      ARG 103 -13.726   3.177  -5.660
  784   HH12  ARG 103          HH12      ARG 103 -14.853   2.881  -6.945
  785   HH21  ARG 103          HH21      ARG 103 -13.497   5.304  -9.085
  786   HH22  ARG 103          HH22      ARG 103 -14.721   4.089  -8.895
  787    H    ILE 104           H        ILE 104  -6.708   5.510  -2.974
  788    HA   ILE 104           HA       ILE 104  -5.856   5.308  -5.785
  789    HB   ILE 104           HB       ILE 104  -3.514   5.586  -5.028
  790   HG12  ILE 104          HG13      ILE 104  -4.749   6.388  -2.388
  791   HG13  ILE 104          HG12      ILE 104  -3.888   4.883  -2.676
  792   HG21  ILE 104          HG21      ILE 104  -4.712   7.489  -5.936
  793   HG22  ILE 104          HG22      ILE 104  -3.622   8.009  -4.651
  794   HG23  ILE 104          HG23      ILE 104  -5.352   7.873  -4.338
  795   HD11  ILE 104          HD11      ILE 104  -2.496   6.531  -1.547
  796   HD12  ILE 104          HD12      ILE 104  -2.710   7.640  -2.901
  797   HD13  ILE 104          HD13      ILE 104  -1.852   6.116  -3.135
  798    H    ASP 105           H        ASP 105  -4.543   3.532  -6.332
  799    HA   ASP 105           HA       ASP 105  -5.112   1.112  -4.844
  800    HB2  ASP 105           HB3      ASP 105  -3.512   1.536  -7.394
  801    HB3  ASP 105           HB2      ASP 105  -3.977  -0.031  -6.731
  802    H    THR 106           H        THR 106  -3.839   0.598  -3.149
  803    HA   THR 106           HA       THR 106  -1.148   1.707  -3.053
  804    HB   THR 106           HB       THR 106  -1.163   0.758  -0.712
  805    HG1  THR 106           HG1      THR 106  -3.055  -0.064   0.076
  806   HG21  THR 106          HG21      THR 106  -2.705   2.485   0.152
  807   HG22  THR 106          HG22      THR 106  -3.324   2.716  -1.482
  808   HG23  THR 106          HG23      THR 106  -1.644   3.101  -1.116
  809    H    ALA 107           H        ALA 107  -2.705  -1.473  -2.942
  810    HA   ALA 107           HA       ALA 107  -0.290  -2.725  -3.906
  811    HB1  ALA 107           HB1      ALA 107  -1.399  -3.462  -1.205
  812    HB2  ALA 107           HB2      ALA 107   0.137  -2.648  -1.507
  813    HB3  ALA 107           HB3      ALA 107  -0.107  -4.307  -2.058
  814    H    CYS 108           H        CYS 108  -0.639  -4.901  -4.585
  815    HA   CYS 108           HA       CYS 108  -3.463  -5.521  -5.054
  816    HB2  CYS 108           HB3      CYS 108  -2.111  -5.438  -7.084
  817    HB3  CYS 108           HB2      CYS 108  -0.945  -6.564  -6.386
  818    H    VAL 109           H        VAL 109  -4.352  -6.898  -3.662
  819    HA   VAL 109           HA       VAL 109  -2.565  -8.743  -2.238
  820    HB   VAL 109           HB       VAL 109  -4.246  -8.915  -0.509
  821   HG11  VAL 109          HG11      VAL 109  -3.785  -6.045  -1.301
  822   HG12  VAL 109          HG12      VAL 109  -2.703  -7.053  -0.341
  823   HG13  VAL 109          HG13      VAL 109  -4.283  -6.598   0.298
  824   HG21  VAL 109          HG21      VAL 109  -6.270  -8.817  -1.836
  825   HG22  VAL 109          HG22      VAL 109  -5.952  -7.131  -2.246
  826   HG23  VAL 109          HG23      VAL 109  -6.321  -7.577  -0.580
  827    H    CYS 110           H        CYS 110  -3.023 -10.912  -2.090
  828    HA   CYS 110           HA       CYS 110  -4.871 -11.941  -4.106
  829    HB2  CYS 110           HB3      CYS 110  -2.606 -12.860  -4.177
  830    HB3  CYS 110           HB2      CYS 110  -2.729 -13.349  -2.492
  831    H    VAL 111           H        VAL 111  -6.857 -12.407  -3.459
  832    HA   VAL 111           HA       VAL 111  -7.176 -13.386  -0.698
  833    HB   VAL 111           HB       VAL 111  -9.579 -12.579  -0.916
  834   HG11  VAL 111          HG11      VAL 111  -7.360 -10.534  -0.975
  835   HG12  VAL 111          HG12      VAL 111  -7.957 -11.391   0.448
  836   HG13  VAL 111          HG13      VAL 111  -9.000 -10.245  -0.391
  837   HG21  VAL 111          HG21      VAL 111  -8.414 -11.018  -3.212
  838   HG22  VAL 111          HG22      VAL 111 -10.029 -10.826  -2.530
  839   HG23  VAL 111          HG23      VAL 111  -9.591 -12.325  -3.353
  840    H    LEU 112           H        LEU 112  -8.562 -15.122  -0.343
  841    HA   LEU 112           HA       LEU 112  -8.790 -16.849  -2.701
  842    HB2  LEU 112           HB3      LEU 112  -8.880 -17.556   0.239
  843    HB3  LEU 112           HB2      LEU 112  -8.871 -18.696  -1.088
  844    HG   LEU 112           HG       LEU 112  -6.588 -16.814  -0.467
  845   HD11  LEU 112          HD11      LEU 112  -5.454 -18.768   0.444
  846   HD12  LEU 112          HD12      LEU 112  -6.905 -19.739   0.197
  847   HD13  LEU 112          HD13      LEU 112  -6.921 -18.407   1.354
  848   HD21  LEU 112          HD21      LEU 112  -6.822 -19.191  -2.308
  849   HD22  LEU 112          HD22      LEU 112  -5.328 -18.330  -1.942
  850   HD23  LEU 112          HD23      LEU 112  -6.635 -17.502  -2.785
  851    H    SER 113           H        SER 113 -10.615 -18.149  -2.994
  852    HA   SER 113           HA       SER 113 -13.019 -17.425  -1.477
  853    HB2  SER 113           HB3      SER 113 -14.284 -17.866  -3.646
  854    HB3  SER 113           HB2      SER 113 -13.319 -16.392  -3.616
  855    HG   SER 113           HG       SER 113 -11.648 -17.657  -4.679
  856    H    ARG 114           H        ARG 114 -14.344 -19.135  -0.930
  857    HA   ARG 114           HA       ARG 114 -12.958 -21.648  -0.750
  858    HB2  ARG 114           HB3      ARG 114 -14.263 -20.619   1.120
  859    HB3  ARG 114           HB2      ARG 114 -15.734 -20.927   0.211
  860    HG2  ARG 114           HG3      ARG 114 -15.449 -22.616   1.891
  861    HG3  ARG 114           HG2      ARG 114 -15.253 -23.341   0.295
  862    HD2  ARG 114           HD3      ARG 114 -12.844 -23.297   0.540
  863    HD3  ARG 114           HD2      ARG 114 -12.991 -22.468   2.088
  864    HE   ARG 114           HE       ARG 114 -14.444 -24.847   2.242
  865   HH11  ARG 114          HH11      ARG 114 -11.124 -23.815   1.882
  866   HH12  ARG 114          HH12      ARG 114 -10.471 -25.183   2.721
  867   HH21  ARG 114          HH21      ARG 114 -13.594 -26.662   3.324
  868   HH22  ARG 114          HH22      ARG 114 -11.878 -26.802   3.550
  869    H    LYS 115           H        LYS 115 -14.946 -20.275  -3.012
  870    HA   LYS 115           HA       LYS 115 -15.704 -21.032  -5.006
  871    HB2  LYS 115           HB3      LYS 115 -14.599 -23.691  -4.080
  872    HB3  LYS 115           HB2      LYS 115 -15.275 -23.411  -5.675
  873    HG2  LYS 115           HG3      LYS 115 -13.535 -21.764  -6.134
  874    HG3  LYS 115           HG2      LYS 115 -12.878 -22.014  -4.514
  875    HD2  LYS 115           HD3      LYS 115 -11.620 -23.261  -6.211
  876    HD3  LYS 115           HD2      LYS 115 -12.380 -24.325  -5.031
  877    HE2  LYS 115           HE3      LYS 115 -12.610 -25.198  -7.299
  878    HE3  LYS 115           HE2      LYS 115 -14.175 -24.812  -6.591
  879    HZ1  LYS 115           HZ1      LYS 115 -12.688 -23.110  -8.518
  880    HZ2  LYS 115           HZ2      LYS 115 -14.199 -22.754  -7.854
  881    HZ3  LYS 115           HZ3      LYS 115 -14.022 -24.076  -8.890
  882    H    ALA 116           H        ALA 116 -16.341 -23.844  -2.913
  883    HA   ALA 116           HA       ALA 116 -19.022 -24.052  -3.935
  884    HB1  ALA 116           HB1      ALA 116 -17.694 -25.551  -1.678
  885    HB2  ALA 116           HB2      ALA 116 -17.720 -26.049  -3.369
  886    HB3  ALA 116           HB3      ALA 116 -19.221 -25.973  -2.450
  887    H    THR 117           H        THR 117 -17.495 -22.980  -0.962
  888    HA   THR 117           HA       THR 117 -20.081 -21.885  -0.110
  889    HB   THR 117           HB       THR 117 -19.207 -22.253   2.276
  890    HG1  THR 117           HG1      THR 117 -17.772 -24.445   1.379
  891   HG21  THR 117          HG21      THR 117 -20.029 -24.570   2.340
  892   HG22  THR 117          HG22      THR 117 -19.923 -24.651   0.582
  893   HG23  THR 117          HG23      THR 117 -21.060 -23.542   1.347
  894    H    ARG 118           H        ARG 118 -19.389 -20.372   1.977
  895    HA   ARG 118           HA       ARG 118 -16.940 -18.930   1.541
  896    HB2  ARG 118           HB3      ARG 118 -18.661 -17.966  -0.098
  897    HB3  ARG 118           HB2      ARG 118 -19.539 -17.395   1.305
  898    HG2  ARG 118           HG3      ARG 118 -16.679 -16.643   0.765
  899    HG3  ARG 118           HG2      ARG 118 -18.046 -15.730   0.135
  900    HD2  ARG 118           HD3      ARG 118 -17.479 -16.252   3.055
  901    HD3  ARG 118           HD2      ARG 118 -17.151 -14.746   2.199
  902    HE   ARG 118           HE       ARG 118 -19.764 -15.034   1.751
  903   HH11  ARG 118          HH11      ARG 118 -17.910 -15.362   4.701
  904   HH12  ARG 118          HH12      ARG 118 -19.212 -14.859   5.726
  905   HH21  ARG 118          HH21      ARG 118 -21.485 -14.376   3.099
  906   HH22  ARG 118          HH22      ARG 118 -21.250 -14.301   4.816
  907    H1   SER   1           H1       SER   1 -23.957  -3.259   2.826
  908    H2   SER   1           H2       SER   1 -23.947  -4.914   3.167
  909    H3   SER   1           H3       SER   1 -25.329  -4.196   2.516
  910    HA   SER   1           HA       SER   1 -24.165  -3.698   0.483
  911    HB2  SER   1           HB3      SER   1 -21.914  -3.484   1.471
  912    HB3  SER   1           HB2      SER   1 -21.888  -5.215   1.794
  913    HG   SER   1           HG       SER   1 -21.435  -3.848  -0.547
  914    H    SER   2           H        SER   2 -25.731  -4.922  -0.421
  915    HA   SER   2           HA       SER   2 -25.726  -7.808   0.005
  916    HB2  SER   2           HB3      SER   2 -27.869  -7.684  -1.360
  917    HB3  SER   2           HB2      SER   2 -27.897  -6.827   0.182
  918    HG   SER   2           HG       SER   2 -27.843  -4.922  -0.842
  919    H    THR   3           H        THR   3 -25.561  -5.465  -2.654
  920    HA   THR   3           HA       THR   3 -25.036  -7.445  -4.641
  921    HB   THR   3           HB       THR   3 -24.256  -5.311  -5.935
  922    HG1  THR   3           HG1      THR   3 -25.504  -3.472  -4.916
  923   HG21  THR   3          HG21      THR   3 -27.116  -5.651  -5.028
  924   HG22  THR   3          HG22      THR   3 -26.348  -6.510  -6.362
  925   HG23  THR   3          HG23      THR   3 -26.586  -4.766  -6.457
  926    H    HIS   4           H        HIS   4 -23.189  -8.463  -4.973
  927    HA   HIS   4           HA       HIS   4 -20.697  -7.172  -4.116
  928    HB2  HIS   4           HB3      HIS   4 -19.916  -9.484  -3.386
  929    HB3  HIS   4           HB2      HIS   4 -21.098  -8.692  -2.356
  930    HD1  HIS   4           HD1      HIS   4 -23.436  -9.751  -2.199
  931    HD2  HIS   4           HD2      HIS   4 -20.819 -11.812  -4.681
  932    HE1  HIS   4           HE1      HIS   4 -24.522 -11.977  -2.629
  933    HE2  HIS   4           HE2      HIS   4 -23.034 -13.094  -4.321
  934    HA   PRO   5           HA       PRO   5 -19.908  -8.463  -8.409
  935    HB2  PRO   5           HB3      PRO   5 -17.891  -6.358  -8.299
  936    HB3  PRO   5           HB2      PRO   5 -19.288  -6.499  -9.367
  937    HG2  PRO   5           HG3      PRO   5 -19.119  -4.626  -7.413
  938    HG3  PRO   5           HG2      PRO   5 -20.659  -5.328  -7.940
  939    HD2  PRO   5           HD3      PRO   5 -19.014  -5.967  -5.517
  940    HD3  PRO   5           HD2      PRO   5 -20.779  -5.825  -5.683
  941    H    VAL   6           H        VAL   6 -19.030 -10.264  -6.889
  942    HA   VAL   6           HA       VAL   6 -17.411 -11.852  -6.732
  943    HB   VAL   6           HB       VAL   6 -15.627  -9.914  -8.208
  944   HG11  VAL   6          HG11      VAL   6 -14.327 -11.544  -6.950
  945   HG12  VAL   6          HG12      VAL   6 -14.231 -11.873  -8.681
  946   HG13  VAL   6          HG13      VAL   6 -15.273 -12.857  -7.653
  947   HG21  VAL   6          HG21      VAL   6 -17.555 -10.553  -9.530
  948   HG22  VAL   6          HG22      VAL   6 -17.251 -12.257  -9.190
  949   HG23  VAL   6          HG23      VAL   6 -16.105 -11.333 -10.160
  950    H    PHE   7           H        PHE   7 -16.690  -8.597  -5.756
  951    HA   PHE   7           HA       PHE   7 -14.397  -8.961  -4.254
  952    HB2  PHE   7           HB3      PHE   7 -15.522  -6.771  -4.802
  953    HB3  PHE   7           HB2      PHE   7 -16.673  -7.114  -3.517
  954    HD1  PHE   7           HD1      PHE   7 -13.044  -6.663  -4.171
  955    HD2  PHE   7           HD2      PHE   7 -16.206  -6.494  -1.326
  956    HE1  PHE   7           HE1      PHE   7 -11.522  -5.624  -2.548
  957    HE2  PHE   7           HE2      PHE   7 -14.684  -5.456   0.305
  958    HZ   PHE   7           HZ       PHE   7 -12.340  -5.019  -0.303
  959    H    HIS   8           H        HIS   8 -17.690  -8.800  -2.874
  960    HA   HIS   8           HA       HIS   8 -16.781 -10.237  -0.531
  961    HB2  HIS   8           HB3      HIS   8 -18.375  -8.326  -0.360
  962    HB3  HIS   8           HB2      HIS   8 -19.569  -9.286  -1.218
  963    HD1  HIS   8           HD1      HIS   8 -17.557  -9.439   2.009
  964    HD2  HIS   8           HD2      HIS   8 -21.138 -10.812   0.398
  965    HE1  HIS   8           HE1      HIS   8 -18.812 -10.481   3.923
  966    HE2  HIS   8           HE2      HIS   8 -21.053 -11.108   2.964
  967    H    MET   9           H        MET   9 -16.262 -11.966  -2.303
  968    HA   MET   9           HA       MET   9 -18.368 -13.993  -1.945
  969    HB2  MET   9           HB3      MET   9 -16.651 -13.589  -4.405
  970    HB3  MET   9           HB2      MET   9 -17.600 -15.036  -4.105
  971    HG2  MET   9           HG3      MET   9 -19.644 -13.665  -4.084
  972    HG3  MET   9           HG2      MET   9 -18.669 -12.244  -4.442
  973    HE1  MET   9           HE1      MET   9 -18.038 -15.844  -5.873
  974    HE2  MET   9           HE2      MET   9 -19.038 -15.826  -7.325
  975    HE3  MET   9           HE3      MET   9 -19.795 -15.780  -5.735
  976    H    GLY  10           H        GLY  10 -15.732 -13.031  -0.734
  977    HA2  GLY  10           HA3      GLY  10 -14.758 -15.515   0.145
  978    HA3  GLY  10           HA2      GLY  10 -13.717 -14.927  -1.143
  979    H    GLU  11           H        GLU  11 -12.789 -12.775  -0.888
  980    HA   GLU  11           HA       GLU  11 -11.481 -11.306   0.251
  981    HB2  GLU  11           HB3      GLU  11 -13.700 -11.559   2.286
  982    HB3  GLU  11           HB2      GLU  11 -12.409 -10.364   2.378
  983    HG2  GLU  11           HG3      GLU  11 -13.155  -9.357   0.306
  984    HG3  GLU  11           HG2      GLU  11 -14.393 -10.600   0.119
  985    H    PHE  12           H        PHE  12 -11.325 -14.316   0.800
  986    HA   PHE  12           HA       PHE  12 -10.202 -14.439   3.452
  987    HB2  PHE  12           HB3      PHE  12 -10.218 -16.468   1.203
  988    HB3  PHE  12           HB2      PHE  12  -9.600 -16.779   2.822
  989    HD1  PHE  12           HD1      PHE  12 -12.368 -17.122   0.723
  990    HD2  PHE  12           HD2      PHE  12 -11.333 -16.222   4.751
  991    HE1  PHE  12           HE1      PHE  12 -14.616 -17.801   1.451
  992    HE2  PHE  12           HE2      PHE  12 -13.577 -16.902   5.484
  993    HZ   PHE  12           HZ       PHE  12 -15.223 -17.693   3.833
  994    H    SER  13           H        SER  13  -8.590 -12.839   3.275
  995    HA   SER  13           HA       SER  13  -6.603 -12.744   1.310
  996    HB2  SER  13           HB3      SER  13  -5.334 -11.443   3.128
  997    HB3  SER  13           HB2      SER  13  -6.909 -10.814   2.657
  998    HG   SER  13           HG       SER  13  -6.068 -11.685   5.065
  999    H    VAL  14           H        VAL  14  -4.748 -13.810   1.007
 1000    HA   VAL  14           HA       VAL  14  -4.282 -16.296   2.160
 1001    HB   VAL  14           HB       VAL  14  -2.021 -16.190   1.120
 1002   HG11  VAL  14          HG11      VAL  14  -2.816 -16.030  -1.196
 1003   HG12  VAL  14          HG12      VAL  14  -4.303 -15.273  -0.625
 1004   HG13  VAL  14          HG13      VAL  14  -3.933 -16.938  -0.176
 1005   HG21  VAL  14          HG21      VAL  14  -1.569 -13.811   1.468
 1006   HG22  VAL  14          HG22      VAL  14  -2.845 -13.398   0.322
 1007   HG23  VAL  14          HG23      VAL  14  -1.406 -14.253  -0.230
 1008    H    CYS  15           H        CYS  15  -3.274 -13.153   3.198
 1009    HA   CYS  15           HA       CYS  15  -2.091 -14.400   5.570
 1010    HB2  CYS  15           HB3      CYS  15  -0.290 -13.477   4.122
 1011    HB3  CYS  15           HB2      CYS  15  -1.056 -11.891   4.221
 1012    H    ASP  16           H        ASP  16  -2.723 -13.520   7.488
 1013    HA   ASP  16           HA       ASP  16  -5.072 -11.909   7.470
 1014    HB2  ASP  16           HB3      ASP  16  -3.311 -12.888   9.730
 1015    HB3  ASP  16           HB2      ASP  16  -4.766 -11.933   9.993
 1016    H    SER  17           H        SER  17  -5.155  -9.803   7.238
 1017    HA   SER  17           HA       SER  17  -2.830  -8.198   8.073
 1018    HB2  SER  17           HB3      SER  17  -4.654  -7.680   5.709
 1019    HB3  SER  17           HB2      SER  17  -3.222  -6.746   6.156
 1020    HG   SER  17           HG       SER  17  -2.896  -9.489   5.783
 1021    H    VAL  18           H        VAL  18  -3.217  -6.427   9.292
 1022    HA   VAL  18           HA       VAL  18  -6.038  -5.806   9.850
 1023    HB   VAL  18           HB       VAL  18  -4.898  -6.602  11.828
 1024   HG11  VAL  18          HG11      VAL  18  -2.999  -5.395  12.813
 1025   HG12  VAL  18          HG12      VAL  18  -2.916  -4.382  11.371
 1026   HG13  VAL  18          HG13      VAL  18  -2.607  -6.115  11.252
 1027   HG21  VAL  18          HG21      VAL  18  -5.355  -3.626  11.934
 1028   HG22  VAL  18          HG22      VAL  18  -5.270  -4.697  13.332
 1029   HG23  VAL  18          HG23      VAL  18  -6.569  -4.884  12.156
 1030    H    SER  19           H        SER  19  -6.746  -4.000   8.971
 1031    HA   SER  19           HA       SER  19  -4.822  -1.927   8.210
 1032    HB2  SER  19           HB3      SER  19  -6.757  -1.068   6.822
 1033    HB3  SER  19           HB2      SER  19  -6.165  -2.664   6.365
 1034    HG   SER  19           HG       SER  19  -8.194  -2.603   8.264
 1035    H    VAL  20           H        VAL  20  -4.662  -0.150   9.411
 1036    HA   VAL  20           HA       VAL  20  -6.933   0.553  11.158
 1037    HB   VAL  20           HB       VAL  20  -4.002   1.028  11.706
 1038   HG11  VAL  20          HG11      VAL  20  -4.753   1.605  13.968
 1039   HG12  VAL  20          HG12      VAL  20  -6.427   1.429  13.443
 1040   HG13  VAL  20          HG13      VAL  20  -5.411   2.690  12.745
 1041   HG21  VAL  20          HG21      VAL  20  -4.190  -0.717  13.406
 1042   HG22  VAL  20          HG22      VAL  20  -4.508  -1.349  11.791
 1043   HG23  VAL  20          HG23      VAL  20  -5.847  -1.035  12.894
 1044    H    TRP  21           H        TRP  21  -7.650   2.614  11.093
 1045    HA   TRP  21           HA       TRP  21  -6.206   4.542   9.426
 1046    HB2  TRP  21           HB3      TRP  21  -8.989   4.623  10.632
 1047    HB3  TRP  21           HB2      TRP  21  -8.274   5.941   9.715
 1048    HD1  TRP  21           HD1      TRP  21  -9.855   2.501   9.281
 1049    HE1  TRP  21           HE1      TRP  21 -10.357   2.122   6.786
 1050    HE3  TRP  21           HE3      TRP  21  -7.433   6.567   7.330
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.802   3.380   4.319
 1052    HZ3  TRP  21           HZ3      TRP  21  -7.469   6.906   4.892
 1053    HH2  TRP  21           HH2      TRP  21  -8.628   5.344   3.420
 1054    H    VAL  22           H        VAL  22  -4.572   5.274  10.668
 1055    HA   VAL  22           HA       VAL  22  -4.923   5.724  13.500
 1056    HB   VAL  22           HB       VAL  22  -2.522   6.257  11.745
 1057   HG11  VAL  22          HG11      VAL  22  -2.803   6.089  14.738
 1058   HG12  VAL  22          HG12      VAL  22  -2.364   7.509  13.786
 1059   HG13  VAL  22          HG13      VAL  22  -1.266   6.133  13.875
 1060   HG21  VAL  22          HG21      VAL  22  -1.665   4.128  12.579
 1061   HG22  VAL  22          HG22      VAL  22  -3.170   3.912  11.684
 1062   HG23  VAL  22          HG23      VAL  22  -3.177   3.860  13.447
 1063    H    GLY  23           H        GLY  23  -5.765   7.541  14.255
 1064    HA2  GLY  23           HA3      GLY  23  -5.557   9.990  12.652
 1065    HA3  GLY  23           HA2      GLY  23  -6.665   9.725  13.997
 1066    H    ASP  24           H        ASP  24  -3.509   8.652  14.588
 1067    HA   ASP  24           HA       ASP  24  -2.426  11.146  15.506
 1068    HB2  ASP  24           HB3      ASP  24  -3.978  10.605  17.358
 1069    HB3  ASP  24           HB2      ASP  24  -3.171   9.051  17.562
 1070    H    LYS  25           H        LYS  25  -0.966  10.217  13.862
 1071    HA   LYS  25           HA       LYS  25   0.870   8.217  14.967
 1072    HB2  LYS  25           HB3      LYS  25   0.091   8.015  12.588
 1073    HB3  LYS  25           HB2      LYS  25   0.887   9.540  12.240
 1074    HG2  LYS  25           HG3      LYS  25   3.042   8.561  12.808
 1075    HG3  LYS  25           HG2      LYS  25   2.254   7.026  13.178
 1076    HD2  LYS  25           HD3      LYS  25   1.434   6.938  10.842
 1077    HD3  LYS  25           HD2      LYS  25   2.334   8.415  10.502
 1078    HE2  LYS  25           HE3      LYS  25   3.642   6.541   9.749
 1079    HE3  LYS  25           HE2      LYS  25   4.419   7.231  11.176
 1080    HZ1  LYS  25           HZ1      LYS  25   3.377   5.475  12.507
 1081    HZ2  LYS  25           HZ2      LYS  25   4.395   4.844  11.319
 1082    HZ3  LYS  25           HZ3      LYS  25   2.715   4.793  11.103
 1083    H    THR  26           H        THR  26   2.480   9.028  16.210
 1084    HA   THR  26           HA       THR  26   2.879  11.883  16.159
 1085    HB   THR  26           HB       THR  26   2.635  10.682  18.311
 1086    HG1  THR  26           HG1      THR  26   3.968  12.715  17.909
 1087   HG21  THR  26          HG21      THR  26   4.585   9.467  19.222
 1088   HG22  THR  26          HG22      THR  26   5.357   9.562  17.639
 1089   HG23  THR  26          HG23      THR  26   3.863   8.648  17.838
 1090    H    THR  27           H        THR  27   4.656   9.074  15.106
 1091    HA   THR  27           HA       THR  27   6.763  10.854  14.150
 1092    HB   THR  27           HB       THR  27   8.465   9.067  14.841
 1093    HG1  THR  27           HG1      THR  27   6.166   8.158  16.083
 1094   HG21  THR  27          HG21      THR  27   7.131  10.781  16.936
 1095   HG22  THR  27          HG22      THR  27   8.423  11.275  15.840
 1096   HG23  THR  27          HG23      THR  27   8.735  10.062  17.081
 1097    H    ALA  28           H        ALA  28   7.768  10.236  12.300
 1098    HA   ALA  28           HA       ALA  28   7.337   7.534  11.274
 1099    HB1  ALA  28           HB1      ALA  28   5.481   8.865  10.350
 1100    HB2  ALA  28           HB2      ALA  28   6.592   8.304   9.100
 1101    HB3  ALA  28           HB3      ALA  28   6.653   9.980   9.649
 1102    H    THR  29           H        THR  29   8.739   7.100   9.396
 1103    HA   THR  29           HA       THR  29  11.273   8.506   9.727
 1104    HB   THR  29           HB       THR  29  10.764   6.002   8.117
 1105    HG1  THR  29           HG1      THR  29  11.092   6.402  10.867
 1106   HG21  THR  29          HG21      THR  29  13.281   7.159   9.318
 1107   HG22  THR  29          HG22      THR  29  12.851   7.183   7.607
 1108   HG23  THR  29          HG23      THR  29  13.167   5.648   8.416
 1109    H    ASP  30           H        ASP  30  11.751  10.064   8.421
 1110    HA   ASP  30           HA       ASP  30  10.445  10.681   5.983
 1111    HB2  ASP  30           HB3      ASP  30  11.692  12.292   7.498
 1112    HB3  ASP  30           HB2      ASP  30  13.194  11.577   6.917
 1113    H    ILE  31           H        ILE  31  11.430  10.645   3.845
 1114    HA   ILE  31           HA       ILE  31  12.571   8.176   3.136
 1115    HB   ILE  31           HB       ILE  31  11.235   9.591   1.596
 1116   HG12  ILE  31          HG13      ILE  31  14.008   9.003   0.533
 1117   HG13  ILE  31          HG12      ILE  31  12.736   7.803   0.732
 1118   HG21  ILE  31          HG21      ILE  31  12.283  11.481   0.454
 1119   HG22  ILE  31          HG22      ILE  31  13.707  11.314   1.481
 1120   HG23  ILE  31          HG23      ILE  31  12.157  11.765   2.191
 1121   HD11  ILE  31          HD11      ILE  31  12.650  10.197  -1.086
 1122   HD12  ILE  31          HD12      ILE  31  11.355   9.022  -0.878
 1123   HD13  ILE  31          HD13      ILE  31  12.897   8.521  -1.571
 1124    H    LYS  32           H        LYS  32  13.952  11.113   4.250
 1125    HA   LYS  32           HA       LYS  32  16.628  10.683   3.326
 1126    HB2  LYS  32           HB3      LYS  32  15.627  12.334   5.651
 1127    HB3  LYS  32           HB2      LYS  32  17.208  12.467   4.893
 1128    HG2  LYS  32           HG3      LYS  32  16.305  13.412   2.941
 1129    HG3  LYS  32           HG2      LYS  32  14.664  12.919   3.367
 1130    HD2  LYS  32           HD3      LYS  32  14.806  14.433   5.337
 1131    HD3  LYS  32           HD2      LYS  32  16.344  15.028   4.713
 1132    HE2  LYS  32           HE3      LYS  32  15.269  15.830   2.716
 1133    HE3  LYS  32           HE2      LYS  32  13.741  15.103   3.203
 1134    HZ1  LYS  32           HZ1      LYS  32  13.739  16.600   5.140
 1135    HZ2  LYS  32           HZ2      LYS  32  13.697  17.438   3.671
 1136    HZ3  LYS  32           HZ3      LYS  32  15.139  17.350   4.551
 1137    H    GLY  33           H        GLY  33  14.728   9.138   5.606
 1138    HA2  GLY  33           HA3      GLY  33  15.373   7.296   6.899
 1139    HA3  GLY  33           HA2      GLY  33  17.054   7.794   6.731
 1140    H    LYS  34           H        LYS  34  14.815  10.217   7.612
 1141    HA   LYS  34           HA       LYS  34  16.013  10.300  10.288
 1142    HB2  LYS  34           HB3      LYS  34  14.569  12.472   8.762
 1143    HB3  LYS  34           HB2      LYS  34  15.422  12.665  10.287
 1144    HG2  LYS  34           HG3      LYS  34  16.694  11.883   7.673
 1145    HG3  LYS  34           HG2      LYS  34  16.700  13.500   8.366
 1146    HD2  LYS  34           HD3      LYS  34  17.941  12.710  10.285
 1147    HD3  LYS  34           HD2      LYS  34  17.875  11.056   9.678
 1148    HE2  LYS  34           HE3      LYS  34  19.147  13.333   8.181
 1149    HE3  LYS  34           HE2      LYS  34  20.038  12.275   9.268
 1150    HZ1  LYS  34           HZ1      LYS  34  20.241  11.557   6.973
 1151    HZ2  LYS  34           HZ2      LYS  34  18.563  11.402   6.842
 1152    HZ3  LYS  34           HZ3      LYS  34  19.425  10.391   7.886
 1153    H    GLU  35           H        GLU  35  14.639  10.971  12.076
 1154    HA   GLU  35           HA       GLU  35  11.940   9.860  11.816
 1155    HB2  GLU  35           HB3      GLU  35  13.326   8.887  13.577
 1156    HB3  GLU  35           HB2      GLU  35  13.598  10.480  14.267
 1157    HG2  GLU  35           HG3      GLU  35  11.264  10.672  14.844
 1158    HG3  GLU  35           HG2      GLU  35  10.917   9.137  14.056
 1159    H    VAL  36           H        VAL  36  10.328  11.238  11.542
 1160    HA   VAL  36           HA       VAL  36  10.634  13.971  12.597
 1161    HB   VAL  36           HB       VAL  36   9.142  14.721  10.755
 1162   HG11  VAL  36          HG11      VAL  36  10.830  14.544   8.962
 1163   HG12  VAL  36          HG12      VAL  36  11.684  13.332   9.919
 1164   HG13  VAL  36          HG13      VAL  36  11.531  14.985  10.519
 1165   HG21  VAL  36          HG21      VAL  36   8.040  12.579  10.311
 1166   HG22  VAL  36          HG22      VAL  36   9.556  11.932   9.683
 1167   HG23  VAL  36          HG23      VAL  36   8.750  13.259   8.848
 1168    H    THR  37           H        THR  37   8.722  15.049  13.273
 1169    HA   THR  37           HA       THR  37   6.855  13.259  14.591
 1170    HB   THR  37           HB       THR  37   7.068  16.265  14.764
 1171    HG1  THR  37           HG1      THR  37   8.724  14.376  15.678
 1172   HG21  THR  37          HG21      THR  37   4.914  15.413  15.519
 1173   HG22  THR  37          HG22      THR  37   5.867  15.980  16.891
 1174   HG23  THR  37          HG23      THR  37   5.724  14.251  16.569
 1175    H    VAL  38           H        VAL  38   4.996  12.738  13.657
 1176    HA   VAL  38           HA       VAL  38   4.144  14.181  11.292
 1177    HB   VAL  38           HB       VAL  38   2.957  11.688  12.521
 1178   HG11  VAL  38          HG11      VAL  38   1.994  11.324  10.311
 1179   HG12  VAL  38          HG12      VAL  38   2.689  12.843   9.749
 1180   HG13  VAL  38          HG13      VAL  38   1.444  12.851  11.000
 1181   HG21  VAL  38          HG21      VAL  38   5.292  11.330  11.945
 1182   HG22  VAL  38          HG22      VAL  38   5.001  11.957  10.324
 1183   HG23  VAL  38          HG23      VAL  38   4.234  10.455  10.838
 1184    H    LEU  39           H        LEU  39   2.250  15.295  11.066
 1185    HA   LEU  39           HA       LEU  39   0.779  15.840  13.555
 1186    HB2  LEU  39           HB3      LEU  39   0.903  17.546  11.063
 1187    HB3  LEU  39           HB2      LEU  39   0.228  17.995  12.620
 1188    HG   LEU  39           HG       LEU  39   3.151  17.485  12.071
 1189   HD11  LEU  39          HD11      LEU  39   1.649  20.058  12.506
 1190   HD12  LEU  39          HD12      LEU  39   2.372  19.512  10.991
 1191   HD13  LEU  39          HD13      LEU  39   3.401  19.899  12.370
 1192   HD21  LEU  39          HD21      LEU  39   2.533  16.933  14.360
 1193   HD22  LEU  39          HD22      LEU  39   1.760  18.506  14.541
 1194   HD23  LEU  39          HD23      LEU  39   3.506  18.403  14.308
 1195    H    ALA  40           H        ALA  40  -1.205  15.012  13.655
 1196    HA   ALA  40           HA       ALA  40  -2.504  13.878  11.365
 1197    HB1  ALA  40           HB1      ALA  40  -3.578  14.344  14.145
 1198    HB2  ALA  40           HB2      ALA  40  -2.736  12.892  13.603
 1199    HB3  ALA  40           HB3      ALA  40  -4.301  13.317  12.909
 1200    H    GLU  41           H        GLU  41  -2.710  16.803  13.226
 1201    HA   GLU  41           HA       GLU  41  -4.826  17.832  11.464
 1202    HB2  GLU  41           HB3      GLU  41  -3.765  19.044  14.026
 1203    HB3  GLU  41           HB2      GLU  41  -5.199  19.534  13.143
 1204    HG2  GLU  41           HG3      GLU  41  -4.899  16.825  14.400
 1205    HG3  GLU  41           HG2      GLU  41  -5.574  18.212  15.251
 1206    H    VAL  42           H        VAL  42  -4.056  19.016   9.802
 1207    HA   VAL  42           HA       VAL  42  -1.333  20.057  10.030
 1208    HB   VAL  42           HB       VAL  42  -1.272  20.197   7.618
 1209   HG11  VAL  42          HG11      VAL  42  -0.780  18.038   8.639
 1210   HG12  VAL  42          HG12      VAL  42  -1.502  17.846   7.041
 1211   HG13  VAL  42          HG13      VAL  42  -2.475  17.577   8.487
 1212   HG21  VAL  42          HG21      VAL  42  -4.146  19.289   7.632
 1213   HG22  VAL  42          HG22      VAL  42  -3.130  19.492   6.204
 1214   HG23  VAL  42          HG23      VAL  42  -3.568  20.893   7.183
 1215    H    ASN  43           H        ASN  43  -0.914  22.125  10.246
 1216    HA   ASN  43           HA       ASN  43  -3.101  24.062   9.902
 1217    HB2  ASN  43           HB3      ASN  43  -0.499  24.257  11.450
 1218    HB3  ASN  43           HB2      ASN  43  -1.643  25.581  11.270
 1219   HD21  ASN  43          HD21      ASN  43  -1.027  22.503  12.771
 1220   HD22  ASN  43          HD22      ASN  43  -2.327  22.581  13.911
 1221    H    ILE  44           H        ILE  44  -3.033  24.684   7.795
 1222    HA   ILE  44           HA       ILE  44  -0.421  25.191   6.580
 1223    HB   ILE  44           HB       ILE  44  -3.133  25.210   5.249
 1224   HG12  ILE  44          HG13      ILE  44  -1.039  23.020   5.300
 1225   HG13  ILE  44          HG12      ILE  44  -2.544  22.991   6.214
 1226   HG21  ILE  44          HG21      ILE  44  -0.357  25.064   4.082
 1227   HG22  ILE  44          HG22      ILE  44  -1.389  26.493   4.090
 1228   HG23  ILE  44          HG23      ILE  44  -1.869  25.062   3.178
 1229   HD11  ILE  44          HD11      ILE  44  -2.756  21.632   4.241
 1230   HD12  ILE  44          HD12      ILE  44  -2.257  22.980   3.217
 1231   HD13  ILE  44          HD13      ILE  44  -3.791  23.052   4.085
 1232    H    ASN  45           H        ASN  45  -3.496  26.853   5.981
 1233    HA   ASN  45           HA       ASN  45  -2.176  29.394   6.665
 1234    HB2  ASN  45           HB3      ASN  45  -2.433  29.177   4.216
 1235    HB3  ASN  45           HB2      ASN  45  -4.160  28.901   4.420
 1236   HD21  ASN  45          HD21      ASN  45  -2.251  31.275   6.218
 1237   HD22  ASN  45          HD22      ASN  45  -3.036  32.659   5.542
 1238    H    ASN  46           H        ASN  46  -3.181  28.655   8.755
 1239    HA   ASN  46           HA       ASN  46  -4.745  28.793  10.391
 1240    HB2  ASN  46           HB3      ASN  46  -5.911  30.865   8.521
 1241    HB3  ASN  46           HB2      ASN  46  -6.515  30.566  10.150
 1242   HD21  ASN  46          HD21      ASN  46  -5.306  32.964   8.981
 1243   HD22  ASN  46          HD22      ASN  46  -3.955  33.340   9.988
 1244    H    SER  47           H        SER  47  -5.036  26.968   8.100
 1245    HA   SER  47           HA       SER  47  -7.866  26.287   8.472
 1246    HB2  SER  47           HB3      SER  47  -6.206  25.679   6.004
 1247    HB3  SER  47           HB2      SER  47  -7.941  25.435   6.206
 1248    HG   SER  47           HG       SER  47  -8.064  27.772   6.483
 1249    H    VAL  48           H        VAL  48  -7.977  24.517   9.690
 1250    HA   VAL  48           HA       VAL  48  -5.662  22.735   9.792
 1251    HB   VAL  48           HB       VAL  48  -8.051  22.792  11.639
 1252   HG11  VAL  48          HG11      VAL  48  -6.844  20.674  11.621
 1253   HG12  VAL  48          HG12      VAL  48  -6.609  21.525  13.149
 1254   HG13  VAL  48          HG13      VAL  48  -5.331  21.527  11.934
 1255   HG21  VAL  48          HG21      VAL  48  -5.345  24.082  11.979
 1256   HG22  VAL  48          HG22      VAL  48  -6.606  23.997  13.210
 1257   HG23  VAL  48          HG23      VAL  48  -6.876  24.922  11.734
 1258    H    PHE  49           H        PHE  49  -5.731  21.065   8.493
 1259    HA   PHE  49           HA       PHE  49  -8.301  19.685   8.074
 1260    HB2  PHE  49           HB3      PHE  49  -5.866  19.788   6.271
 1261    HB3  PHE  49           HB2      PHE  49  -7.268  18.762   5.988
 1262    HD1  PHE  49           HD1      PHE  49  -5.847  22.034   5.589
 1263    HD2  PHE  49           HD2      PHE  49  -9.498  19.847   5.587
 1264    HE1  PHE  49           HE1      PHE  49  -6.940  23.864   4.354
 1265    HE2  PHE  49           HE2      PHE  49 -10.596  21.671   4.357
 1266    HZ   PHE  49           HZ       PHE  49  -9.316  23.681   3.738
 1267    H    ARG  50           H        ARG  50  -8.237  17.355   8.073
 1268    HA   ARG  50           HA       ARG  50  -5.888  16.300   9.500
 1269    HB2  ARG  50           HB3      ARG  50  -7.427  14.835  10.790
 1270    HB3  ARG  50           HB2      ARG  50  -7.627  16.544  11.136
 1271    HG2  ARG  50           HG3      ARG  50  -9.607  16.589   9.692
 1272    HG3  ARG  50           HG2      ARG  50  -9.401  14.863   9.377
 1273    HD2  ARG  50           HD3      ARG  50 -11.084  15.387  11.141
 1274    HD3  ARG  50           HD2      ARG  50  -9.775  14.333  11.677
 1275    HE   ARG  50           HE       ARG  50  -8.761  16.519  12.556
 1276   HH11  ARG  50          HH11      ARG  50 -12.197  15.815  12.466
 1277   HH12  ARG  50          HH12      ARG  50 -12.571  16.872  13.787
 1278   HH21  ARG  50          HH21      ARG  50  -9.245  17.901  14.270
 1279   HH22  ARG  50          HH22      ARG  50 -10.887  18.056  14.829
 1280    H    GLN  51           H        GLN  51  -5.417  14.107   9.210
 1281    HA   GLN  51           HA       GLN  51  -6.911  12.684   7.153
 1282    HB2  GLN  51           HB3      GLN  51  -4.638  11.970   6.170
 1283    HB3  GLN  51           HB2      GLN  51  -5.284  13.539   5.735
 1284    HG2  GLN  51           HG3      GLN  51  -3.818  14.577   7.431
 1285    HG3  GLN  51           HG2      GLN  51  -3.127  12.986   7.760
 1286   HE21  GLN  51          HE21      GLN  51  -1.789  12.030   6.245
 1287   HE22  GLN  51          HE22      GLN  51  -1.081  12.921   4.940
 1288    H    TYR  52           H        TYR  52  -7.102  10.574   7.563
 1289    HA   TYR  52           HA       TYR  52  -5.789   9.550   9.955
 1290    HB2  TYR  52           HB3      TYR  52  -7.904   8.209   8.247
 1291    HB3  TYR  52           HB2      TYR  52  -7.400   7.744   9.868
 1292    HD1  TYR  52           HD1      TYR  52  -7.684   9.649  11.687
 1293    HD2  TYR  52           HD2      TYR  52  -9.812   9.481   8.005
 1294    HE1  TYR  52           HE1      TYR  52  -9.424  11.096  12.630
 1295    HE2  TYR  52           HE2      TYR  52 -11.562  10.927   8.946
 1296    HH   TYR  52           HH       TYR  52 -12.438  11.625  11.056
 1297    H    PHE  53           H        PHE  53  -4.093   8.259   9.855
 1298    HA   PHE  53           HA       PHE  53  -3.004   7.653   7.257
 1299    HB2  PHE  53           HB3      PHE  53  -1.911   7.098  10.029
 1300    HB3  PHE  53           HB2      PHE  53  -1.015   6.917   8.520
 1301    HD1  PHE  53           HD1      PHE  53  -0.312   8.862   7.253
 1302    HD2  PHE  53           HD2      PHE  53  -2.386   9.275  10.941
 1303    HE1  PHE  53           HE1      PHE  53   0.323  11.237   7.335
 1304    HE2  PHE  53           HE2      PHE  53  -1.756  11.651  11.036
 1305    HZ   PHE  53           HZ       PHE  53  -0.404  12.634   9.230
 1306    H    PHE  54           H        PHE  54  -3.532   5.925   6.200
 1307    HA   PHE  54           HA       PHE  54  -4.821   3.691   7.498
 1308    HB2  PHE  54           HB3      PHE  54  -5.695   4.566   5.377
 1309    HB3  PHE  54           HB2      PHE  54  -4.158   4.241   4.589
 1310    HD1  PHE  54           HD1      PHE  54  -3.752   2.176   3.579
 1311    HD2  PHE  54           HD2      PHE  54  -7.021   2.597   6.274
 1312    HE1  PHE  54           HE1      PHE  54  -4.575  -0.045   2.923
 1313    HE2  PHE  54           HE2      PHE  54  -7.846   0.374   5.624
 1314    HZ   PHE  54           HZ       PHE  54  -6.624  -0.950   3.944
 1315    H    GLU  55           H        GLU  55  -3.389   2.506   8.617
 1316    HA   GLU  55           HA       GLU  55  -0.990   1.555   7.194
 1317    HB2  GLU  55           HB3      GLU  55  -1.441   1.593  10.188
 1318    HB3  GLU  55           HB2      GLU  55   0.054   1.194   9.350
 1319    HG2  GLU  55           HG3      GLU  55   0.040   3.568   8.466
 1320    HG3  GLU  55           HG2      GLU  55  -1.266   3.887   9.611
 1321    H    THR  56           H        THR  56  -1.169  -0.435   6.476
 1322    HA   THR  56           HA       THR  56  -2.898  -2.316   7.927
 1323    HB   THR  56           HB       THR  56  -1.759  -2.594   5.144
 1324    HG1  THR  56           HG1      THR  56  -3.298  -1.199   4.710
 1325   HG21  THR  56          HG21      THR  56  -3.895  -4.169   6.593
 1326   HG22  THR  56          HG22      THR  56  -2.268  -4.738   6.215
 1327   HG23  THR  56          HG23      THR  56  -3.410  -4.401   4.913
 1328    H    LYS  57           H        LYS  57  -1.939  -3.727   9.200
 1329    HA   LYS  57           HA       LYS  57   0.923  -4.272   8.778
 1330    HB2  LYS  57           HB3      LYS  57  -0.703  -4.234  11.328
 1331    HB3  LYS  57           HB2      LYS  57   0.985  -4.721  11.232
 1332    HG2  LYS  57           HG3      LYS  57   1.633  -2.516  10.530
 1333    HG3  LYS  57           HG2      LYS  57  -0.053  -2.006  10.446
 1334    HD2  LYS  57           HD3      LYS  57  -0.264  -2.399  12.863
 1335    HD3  LYS  57           HD2      LYS  57   1.441  -2.844  12.924
 1336    HE2  LYS  57           HE3      LYS  57   2.078  -0.634  12.188
 1337    HE3  LYS  57           HE2      LYS  57   0.387  -0.181  12.011
 1338    HZ1  LYS  57           HZ1      LYS  57   1.297   0.669  14.066
 1339    HZ2  LYS  57           HZ2      LYS  57   1.736  -0.888  14.556
 1340    HZ3  LYS  57           HZ3      LYS  57   0.101  -0.483  14.396
 1341    H    CYS  58           H        CYS  58   1.690  -6.364   9.334
 1342    HA   CYS  58           HA       CYS  58  -0.113  -8.454   8.505
 1343    HB2  CYS  58           HB3      CYS  58   2.774  -8.630   9.408
 1344    HB3  CYS  58           HB2      CYS  58   1.862  -9.910   8.618
 1345    H    ARG  59           H        ARG  59  -1.340  -9.587   9.843
 1346    HA   ARG  59           HA       ARG  59  -0.891  -9.519  12.699
 1347    HB2  ARG  59           HB3      ARG  59  -2.950 -10.964  11.019
 1348    HB3  ARG  59           HB2      ARG  59  -2.923 -10.972  12.775
 1349    HG2  ARG  59           HG3      ARG  59  -3.294  -8.583  12.820
 1350    HG3  ARG  59           HG2      ARG  59  -3.224  -8.518  11.061
 1351    HD2  ARG  59           HD3      ARG  59  -5.531  -8.495  11.914
 1352    HD3  ARG  59           HD2      ARG  59  -5.201  -9.891  10.894
 1353    HE   ARG  59           HE       ARG  59  -4.766 -10.511  13.630
 1354   HH11  ARG  59          HH11      ARG  59  -7.333  -9.953  11.311
 1355   HH12  ARG  59          HH12      ARG  59  -8.454 -11.002  12.113
 1356   HH21  ARG  59          HH21      ARG  59  -6.239 -11.885  14.685
 1357   HH22  ARG  59          HH22      ARG  59  -7.834 -12.104  14.036
 1358    H    ALA  60           H        ALA  60   1.116 -10.495  12.823
 1359    HA   ALA  60           HA       ALA  60   2.586 -12.193  13.187
 1360    HB1  ALA  60           HB1      ALA  60   1.901 -14.526  13.161
 1361    HB2  ALA  60           HB2      ALA  60   0.365 -14.089  12.415
 1362    HB3  ALA  60           HB3      ALA  60   0.730 -13.556  14.056
 1363    H    SER  61           H        SER  61   4.207 -12.820  11.913
 1364    HA   SER  61           HA       SER  61   4.108 -12.149   9.176
 1365    HB2  SER  61           HB3      SER  61   6.439 -13.114   9.147
 1366    HB3  SER  61           HB2      SER  61   6.165 -11.872  10.368
 1367    HG   SER  61           HG       SER  61   6.239 -14.688  10.741
 1368    H    ASN  62           H        ASN  62   3.410 -15.053  10.829
 1369    HA   ASN  62           HA       ASN  62   3.085 -16.448   8.273
 1370    HB2  ASN  62           HB3      ASN  62   4.321 -17.703  10.740
 1371    HB3  ASN  62           HB2      ASN  62   3.967 -18.532   9.229
 1372   HD21  ASN  62          HD21      ASN  62   5.278 -18.141   7.423
 1373   HD22  ASN  62          HD22      ASN  62   6.820 -17.383   7.563
 1374    HA   PRO  63           HA       PRO  63  -0.851 -16.415  10.701
 1375    HB2  PRO  63           HB3      PRO  63  -2.279 -17.228   8.432
 1376    HB3  PRO  63           HB2      PRO  63  -2.094 -15.565   9.001
 1377    HG2  PRO  63           HG3      PRO  63  -0.624 -17.025   6.864
 1378    HG3  PRO  63           HG2      PRO  63  -1.093 -15.319   6.942
 1379    HD2  PRO  63           HD3      PRO  63   1.445 -16.095   7.367
 1380    HD3  PRO  63           HD2      PRO  63   0.723 -14.744   8.276
 1381    H    VAL  64           H        VAL  64   0.256 -18.844   8.363
 1382    HA   VAL  64           HA       VAL  64  -0.835 -20.918  10.149
 1383    HB   VAL  64           HB       VAL  64  -0.983 -22.421   8.206
 1384   HG11  VAL  64          HG11      VAL  64  -2.466 -19.818   7.851
 1385   HG12  VAL  64          HG12      VAL  64  -2.969 -21.190   8.839
 1386   HG13  VAL  64          HG13      VAL  64  -2.896 -21.344   7.084
 1387   HG21  VAL  64          HG21      VAL  64  -0.760 -21.547   5.938
 1388   HG22  VAL  64          HG22      VAL  64   0.759 -21.428   6.825
 1389   HG23  VAL  64          HG23      VAL  64  -0.239 -19.993   6.583
 1390    H    GLU  65           H        GLU  65   0.450 -22.909  10.247
 1391    HA   GLU  65           HA       GLU  65   3.244 -22.256  10.476
 1392    HB2  GLU  65           HB3      GLU  65   1.967 -23.639  12.150
 1393    HB3  GLU  65           HB2      GLU  65   1.931 -24.931  10.956
 1394    HG2  GLU  65           HG3      GLU  65   3.716 -25.221  12.615
 1395    HG3  GLU  65           HG2      GLU  65   4.335 -25.070  10.970
 1396    H    SER  66           H        SER  66   3.437 -21.858   8.182
 1397    HA   SER  66           HA       SER  66   4.895 -23.733   6.783
 1398    HB2  SER  66           HB3      SER  66   2.697 -24.963   6.602
 1399    HB3  SER  66           HB2      SER  66   2.058 -23.587   5.705
 1400    HG   SER  66           HG       SER  66   2.782 -25.117   4.252
 1401    H    GLY  67           H        GLY  67   2.823 -20.981   6.900
 1402    HA2  GLY  67           HA3      GLY  67   4.305 -19.035   5.926
 1403    HA3  GLY  67           HA2      GLY  67   3.879 -19.856   4.425
 1404    H    CYS  68           H        CYS  68   2.047 -19.279   3.460
 1405    HA   CYS  68           HA       CYS  68   0.124 -17.677   5.006
 1406    HB2  CYS  68           HB3      CYS  68   0.704 -17.690   2.032
 1407    HB3  CYS  68           HB2      CYS  68  -0.571 -16.739   2.801
 1408    H    ARG  69           H        ARG  69  -2.153 -17.814   4.087
 1409    HA   ARG  69           HA       ARG  69  -3.009 -20.521   4.309
 1410    HB2  ARG  69           HB3      ARG  69  -4.622 -18.122   3.399
 1411    HB3  ARG  69           HB2      ARG  69  -5.267 -19.651   3.980
 1412    HG2  ARG  69           HG3      ARG  69  -4.220 -19.170   6.194
 1413    HG3  ARG  69           HG2      ARG  69  -3.766 -17.581   5.571
 1414    HD2  ARG  69           HD3      ARG  69  -6.170 -17.152   5.082
 1415    HD3  ARG  69           HD2      ARG  69  -6.561 -18.675   5.884
 1416    HE   ARG  69           HE       ARG  69  -5.228 -16.436   7.273
 1417   HH11  ARG  69          HH11      ARG  69  -7.641 -18.975   7.159
 1418   HH12  ARG  69          HH12      ARG  69  -8.240 -18.640   8.749
 1419   HH21  ARG  69          HH21      ARG  69  -6.037 -15.971   9.338
 1420   HH22  ARG  69          HH22      ARG  69  -7.331 -16.933   9.990
 1421    H    GLY  70           H        GLY  70  -3.288 -21.998   2.767
 1422    HA2  GLY  70           HA3      GLY  70  -4.060 -22.732   0.637
 1423    HA3  GLY  70           HA2      GLY  70  -3.749 -21.117   0.004
 1424    H    ILE  71           H        ILE  71  -1.079 -21.198   1.463
 1425    HA   ILE  71           HA       ILE  71   0.391 -22.280  -0.773
 1426    HB   ILE  71           HB       ILE  71   1.481 -21.067   1.770
 1427   HG12  ILE  71          HG13      ILE  71   0.013 -19.484   0.574
 1428   HG13  ILE  71          HG12      ILE  71   1.697 -18.980   0.511
 1429   HG21  ILE  71          HG21      ILE  71   3.513 -20.705   0.445
 1430   HG22  ILE  71          HG22      ILE  71   2.763 -21.524  -0.924
 1431   HG23  ILE  71          HG23      ILE  71   3.105 -22.418   0.557
 1432   HD11  ILE  71          HD11      ILE  71   0.178 -20.348  -1.696
 1433   HD12  ILE  71          HD12      ILE  71   1.865 -19.845  -1.765
 1434   HD13  ILE  71          HD13      ILE  71   0.590 -18.635  -1.618
 1435    H    ASP  72           H        ASP  72   0.922 -24.334  -0.883
 1436    HA   ASP  72           HA       ASP  72   2.119 -25.623   1.431
 1437    HB2  ASP  72           HB3      ASP  72  -0.205 -26.337   1.599
 1438    HB3  ASP  72           HB2      ASP  72  -0.206 -26.825  -0.093
 1439    H    SER  73           H        SER  73   4.081 -25.684   0.459
 1440    HA   SER  73           HA       SER  73   4.431 -27.655  -1.607
 1441    HB2  SER  73           HB3      SER  73   3.997 -25.643  -2.958
 1442    HB3  SER  73           HB2      SER  73   5.270 -24.785  -2.091
 1443    HG   SER  73           HG       SER  73   5.564 -26.150  -4.268
 1444    H    LYS  74           H        LYS  74   6.500 -28.458  -1.676
 1445    HA   LYS  74           HA       LYS  74   7.958 -28.228   0.765
 1446    HB2  LYS  74           HB3      LYS  74   7.641 -30.355  -0.435
 1447    HB3  LYS  74           HB2      LYS  74   8.567 -29.728  -1.787
 1448    HG2  LYS  74           HG3      LYS  74  10.570 -29.675  -0.467
 1449    HG3  LYS  74           HG2      LYS  74   9.671 -30.129   0.983
 1450    HD2  LYS  74           HD3      LYS  74  10.850 -32.045   0.020
 1451    HD3  LYS  74           HD2      LYS  74   9.104 -32.267  -0.027
 1452    HE2  LYS  74           HE3      LYS  74   9.081 -31.577  -2.370
 1453    HE3  LYS  74           HE2      LYS  74  10.830 -31.377  -2.328
 1454    HZ1  LYS  74           HZ1      LYS  74   9.351 -33.915  -1.913
 1455    HZ2  LYS  74           HZ2      LYS  74  11.032 -33.741  -1.829
 1456    HZ3  LYS  74           HZ3      LYS  74  10.229 -33.490  -3.295
 1457    H    HIS  75           H        HIS  75   8.028 -26.514  -2.136
 1458    HA   HIS  75           HA       HIS  75  10.756 -25.567  -1.566
 1459    HB2  HIS  75           HB3      HIS  75   9.434 -26.083  -4.222
 1460    HB3  HIS  75           HB2      HIS  75  10.809 -24.994  -4.076
 1461    HD1  HIS  75           HD1      HIS  75   9.903 -28.572  -4.195
 1462    HD2  HIS  75           HD2      HIS  75  13.246 -26.270  -3.301
 1463    HE1  HIS  75           HE1      HIS  75  11.847 -30.171  -4.190
 1464    HE2  HIS  75           HE2      HIS  75  13.830 -28.778  -3.516
 1465    H    TRP  76           H        TRP  76   7.920 -24.617  -0.856
 1466    HA   TRP  76           HA       TRP  76   8.559 -21.821  -1.448
 1467    HB2  TRP  76           HB3      TRP  76   5.819 -23.061  -1.728
 1468    HB3  TRP  76           HB2      TRP  76   6.083 -21.329  -1.593
 1469    HD1  TRP  76           HD1      TRP  76   5.392 -23.729  -4.135
 1470    HE1  TRP  76           HE1      TRP  76   6.215 -22.969  -6.449
 1471    HE3  TRP  76           HE3      TRP  76   8.594 -20.010  -2.684
 1472    HZ2  TRP  76           HZ2      TRP  76   7.983 -21.054  -7.519
 1473    HZ3  TRP  76           HZ3      TRP  76   9.811 -18.765  -4.421
 1474    HH2  TRP  76           HH2      TRP  76   9.511 -19.279  -6.788
 1475    H    ASN  77           H        ASN  77   8.960 -20.896   0.413
 1476    HA   ASN  77           HA       ASN  77   7.135 -21.453   2.670
 1477    HB2  ASN  77           HB3      ASN  77   9.559 -21.924   3.118
 1478    HB3  ASN  77           HB2      ASN  77   9.913 -20.237   2.776
 1479   HD21  ASN  77          HD21      ASN  77   7.148 -21.551   4.546
 1480   HD22  ASN  77          HD22      ASN  77   7.550 -20.806   6.056
 1481    H    SER  78           H        SER  78   5.955 -19.727   3.445
 1482    HA   SER  78           HA       SER  78   6.167 -17.301   1.811
 1483    HB2  SER  78           HB3      SER  78   3.840 -17.920   3.603
 1484    HB3  SER  78           HB2      SER  78   3.878 -16.981   2.111
 1485    HG   SER  78           HG       SER  78   3.858 -18.791   0.940
 1486    H    TYR  79           H        TYR  79   6.363 -15.287   2.702
 1487    HA   TYR  79           HA       TYR  79   6.032 -15.051   5.584
 1488    HB2  TYR  79           HB3      TYR  79   8.034 -13.567   5.766
 1489    HB3  TYR  79           HB2      TYR  79   8.426 -15.242   5.408
 1490    HD1  TYR  79           HD1      TYR  79   8.956 -11.851   4.485
 1491    HD2  TYR  79           HD2      TYR  79   8.914 -15.809   2.918
 1492    HE1  TYR  79           HE1      TYR  79  10.377 -11.121   2.613
 1493    HE2  TYR  79           HE2      TYR  79  10.328 -15.086   1.039
 1494    HH   TYR  79           HH       TYR  79  11.912 -12.047   0.985
 1495    H    CYS  80           H        CYS  80   5.005 -13.261   6.211
 1496    HA   CYS  80           HA       CYS  80   3.875 -11.616   4.104
 1497    HB2  CYS  80           HB3      CYS  80   3.307 -11.660   7.080
 1498    HB3  CYS  80           HB2      CYS  80   2.368 -10.790   5.864
 1499    H    THR  81           H        THR  81   4.438  -9.583   3.667
 1500    HA   THR  81           HA       THR  81   6.060  -8.110   5.627
 1501    HB   THR  81           HB       THR  81   6.716  -8.336   2.675
 1502    HG1  THR  81           HG1      THR  81   7.278 -10.211   3.889
 1503   HG21  THR  81          HG21      THR  81   8.174  -6.912   4.910
 1504   HG22  THR  81          HG22      THR  81   7.295  -6.141   3.590
 1505   HG23  THR  81          HG23      THR  81   8.746  -7.083   3.251
 1506    H    THR  82           H        THR  82   5.454  -6.007   5.832
 1507    HA   THR  82           HA       THR  82   3.182  -5.111   4.323
 1508    HB   THR  82           HB       THR  82   3.440  -3.032   5.759
 1509    HG1  THR  82           HG1      THR  82   4.998  -2.947   7.222
 1510   HG21  THR  82          HG21      THR  82   1.862  -4.777   6.332
 1511   HG22  THR  82          HG22      THR  82   2.638  -4.168   7.793
 1512   HG23  THR  82          HG23      THR  82   3.139  -5.714   7.109
 1513    H    THR  83           H        THR  83   3.136  -3.738   2.679
 1514    HA   THR  83           HA       THR  83   5.577  -2.849   1.465
 1515    HB   THR  83           HB       THR  83   2.745  -2.066   0.740
 1516    HG1  THR  83           HG1      THR  83   4.006  -4.467   0.587
 1517   HG21  THR  83          HG21      THR  83   4.513  -0.712  -0.306
 1518   HG22  THR  83          HG22      THR  83   3.679  -1.715  -1.492
 1519   HG23  THR  83          HG23      THR  83   5.276  -2.183  -0.910
 1520    H    HIS  84           H        HIS  84   6.573  -0.965   1.795
 1521    HA   HIS  84           HA       HIS  84   5.157   1.071   3.375
 1522    HB2  HIS  84           HB3      HIS  84   8.121   0.548   3.051
 1523    HB3  HIS  84           HB2      HIS  84   7.458   1.934   3.907
 1524    HD1  HIS  84           HD1      HIS  84   8.082  -1.714   4.231
 1525    HD2  HIS  84           HD2      HIS  84   6.270   1.327   6.409
 1526    HE1  HIS  84           HE1      HIS  84   7.730  -2.646   6.536
 1527    HE2  HIS  84           HE2      HIS  84   6.375  -0.892   7.724
 1528    H    THR  85           H        THR  85   4.543   2.844   2.350
 1529    HA   THR  85           HA       THR  85   6.018   3.580  -0.102
 1530    HB   THR  85           HB       THR  85   3.543   3.012  -0.367
 1531    HG1  THR  85           HG1      THR  85   3.464   4.461  -1.974
 1532   HG21  THR  85          HG21      THR  85   2.715   4.087   1.666
 1533   HG22  THR  85          HG22      THR  85   1.944   4.777   0.238
 1534   HG23  THR  85          HG23      THR  85   3.233   5.658   1.058
 1535    H    PHE  86           H        PHE  86   6.135   5.958  -0.497
 1536    HA   PHE  86           HA       PHE  86   6.531   7.337   2.069
 1537    HB2  PHE  86           HB3      PHE  86   7.967   7.636  -0.574
 1538    HB3  PHE  86           HB2      PHE  86   8.099   8.829   0.717
 1539    HD1  PHE  86           HD1      PHE  86   9.137   5.558  -0.459
 1540    HD2  PHE  86           HD2      PHE  86   9.134   8.223   2.860
 1541    HE1  PHE  86           HE1      PHE  86  10.937   4.244   0.591
 1542    HE2  PHE  86           HE2      PHE  86  10.929   6.916   3.917
 1543    HZ   PHE  86           HZ       PHE  86  11.834   4.929   2.785
 1544    H    VAL  87           H        VAL  87   5.050   8.782   2.512
 1545    HA   VAL  87           HA       VAL  87   3.766  10.219   0.281
 1546    HB   VAL  87           HB       VAL  87   1.800  10.523   1.789
 1547   HG11  VAL  87          HG11      VAL  87   1.735   8.790   0.120
 1548   HG12  VAL  87          HG12      VAL  87   0.976   8.196   1.599
 1549   HG13  VAL  87          HG13      VAL  87   2.611   7.688   1.180
 1550   HG21  VAL  87          HG21      VAL  87   2.939  10.215   3.936
 1551   HG22  VAL  87          HG22      VAL  87   3.215   8.518   3.544
 1552   HG23  VAL  87          HG23      VAL  87   1.571   9.112   3.767
 1553    H    LYS  88           H        LYS  88   3.818  12.416   0.315
 1554    HA   LYS  88           HA       LYS  88   5.419  13.676   2.352
 1555    HB2  LYS  88           HB3      LYS  88   4.970  15.786   1.026
 1556    HB3  LYS  88           HB2      LYS  88   5.827  14.510   0.180
 1557    HG2  LYS  88           HG3      LYS  88   4.012  14.014  -1.172
 1558    HG3  LYS  88           HG2      LYS  88   2.864  14.783  -0.079
 1559    HD2  LYS  88           HD3      LYS  88   5.000  16.341  -1.502
 1560    HD3  LYS  88           HD2      LYS  88   3.421  16.039  -2.229
 1561    HE2  LYS  88           HE3      LYS  88   4.010  17.508   0.327
 1562    HE3  LYS  88           HE2      LYS  88   3.367  18.181  -1.168
 1563    HZ1  LYS  88           HZ1      LYS  88   1.574  17.889   0.346
 1564    HZ2  LYS  88           HZ2      LYS  88   2.011  16.287   0.673
 1565    HZ3  LYS  88           HZ3      LYS  88   1.409  16.704  -0.856
 1566    H    ALA  89           H        ALA  89   4.399  13.683   4.228
 1567    HA   ALA  89           HA       ALA  89   1.770  15.022   4.389
 1568    HB1  ALA  89           HB1      ALA  89   1.423  13.820   6.485
 1569    HB2  ALA  89           HB2      ALA  89   3.018  13.083   6.346
 1570    HB3  ALA  89           HB3      ALA  89   1.759  12.684   5.176
 1571    H    LEU  90           H        LEU  90   1.468  16.468   6.229
 1572    HA   LEU  90           HA       LEU  90   3.754  18.149   6.541
 1573    HB2  LEU  90           HB3      LEU  90   1.369  18.967   6.416
 1574    HB3  LEU  90           HB2      LEU  90   1.136  18.327   8.037
 1575    HG   LEU  90           HG       LEU  90   3.070  19.847   8.748
 1576   HD11  LEU  90          HD11      LEU  90   3.972  20.344   6.569
 1577   HD12  LEU  90          HD12      LEU  90   3.408  21.828   7.334
 1578   HD13  LEU  90          HD13      LEU  90   2.445  21.069   6.068
 1579   HD21  LEU  90          HD21      LEU  90   1.612  21.768   9.006
 1580   HD22  LEU  90          HD22      LEU  90   0.723  20.273   9.302
 1581   HD23  LEU  90          HD23      LEU  90   0.522  21.131   7.773
 1582    H    THR  91           H        THR  91   5.354  17.412   7.742
 1583    HA   THR  91           HA       THR  91   4.727  16.507  10.475
 1584    HB   THR  91           HB       THR  91   6.672  15.059  10.428
 1585    HG1  THR  91           HG1      THR  91   7.305  16.590   8.270
 1586   HG21  THR  91          HG21      THR  91   5.086  14.645   7.889
 1587   HG22  THR  91          HG22      THR  91   4.582  14.124   9.492
 1588   HG23  THR  91          HG23      THR  91   6.017  13.422   8.751
 1589    H    THR  92           H        THR  92   6.380  17.096  12.072
 1590    HA   THR  92           HA       THR  92   7.794  19.521  11.213
 1591    HB   THR  92           HB       THR  92   6.035  20.023  12.829
 1592    HG1  THR  92           HG1      THR  92   8.128  21.140  12.843
 1593   HG21  THR  92          HG21      THR  92   5.956  17.903  14.041
 1594   HG22  THR  92          HG22      THR  92   6.181  19.255  15.149
 1595   HG23  THR  92          HG23      THR  92   7.548  18.226  14.725
 1596    H    ASP  93           H        ASP  93   9.873  19.359  11.071
 1597    HA   ASP  93           HA       ASP  93  11.357  17.146  12.040
 1598    HB2  ASP  93           HB3      ASP  93  12.314  19.821  10.989
 1599    HB3  ASP  93           HB2      ASP  93  13.339  18.414  11.247
 1600    H    GLU  94           H        GLU  94  10.652  20.315  13.279
 1601    HA   GLU  94           HA       GLU  94  11.405  19.625  15.910
 1602    HB2  GLU  94           HB3      GLU  94  13.677  19.977  15.004
 1603    HB3  GLU  94           HB2      GLU  94  13.230  21.606  14.529
 1604    HG2  GLU  94           HG3      GLU  94  14.524  21.574  16.589
 1605    HG3  GLU  94           HG2      GLU  94  12.911  22.228  16.836
 1606    H    LYS  95           H        LYS  95  11.644  22.721  14.151
 1607    HA   LYS  95           HA       LYS  95   9.346  23.665  15.733
 1608    HB2  LYS  95           HB3      LYS  95  11.681  25.196  14.588
 1609    HB3  LYS  95           HB2      LYS  95  10.258  25.965  15.270
 1610    HG2  LYS  95           HG3      LYS  95  10.717  24.891  17.421
 1611    HG3  LYS  95           HG2      LYS  95  12.158  24.149  16.729
 1612    HD2  LYS  95           HD3      LYS  95  13.089  26.361  16.289
 1613    HD3  LYS  95           HD2      LYS  95  11.649  27.107  16.983
 1614    HE2  LYS  95           HE3      LYS  95  13.479  27.066  18.592
 1615    HE3  LYS  95           HE2      LYS  95  12.137  26.060  19.130
 1616    HZ1  LYS  95           HZ1      LYS  95  14.598  25.054  17.811
 1617    HZ2  LYS  95           HZ2      LYS  95  13.324  24.108  18.395
 1618    HZ3  LYS  95           HZ3      LYS  95  14.283  24.987  19.470
 1619    H    GLN  96           H        GLN  96  10.649  23.238  12.555
 1620    HA   GLN  96           HA       GLN  96   8.522  24.814  11.339
 1621    HB2  GLN  96           HB3      GLN  96  10.791  25.022  10.409
 1622    HB3  GLN  96           HB2      GLN  96  10.821  23.297  10.077
 1623    HG2  GLN  96           HG3      GLN  96  10.365  24.522   8.056
 1624    HG3  GLN  96           HG2      GLN  96   8.947  23.578   8.519
 1625   HE21  GLN  96          HE21      GLN  96   7.449  24.829   7.487
 1626   HE22  GLN  96          HE22      GLN  96   7.081  26.452   7.960
 1627    H    ALA  97           H        ALA  97   6.807  23.973  10.313
 1628    HA   ALA  97           HA       ALA  97   6.544  21.054  10.201
 1629    HB1  ALA  97           HB1      ALA  97   4.450  23.200   9.837
 1630    HB2  ALA  97           HB2      ALA  97   4.711  22.253  11.301
 1631    HB3  ALA  97           HB3      ALA  97   4.160  21.461   9.824
 1632    H    ALA  98           H        ALA  98   6.695  20.028   8.291
 1633    HA   ALA  98           HA       ALA  98   6.243  21.497   5.814
 1634    HB1  ALA  98           HB1      ALA  98   8.390  20.819   4.862
 1635    HB2  ALA  98           HB2      ALA  98   8.846  20.089   6.401
 1636    HB3  ALA  98           HB3      ALA  98   8.621  21.834   6.287
 1637    H    TRP  99           H        TRP  99   5.887  20.147   4.011
 1638    HA   TRP  99           HA       TRP  99   4.703  17.618   4.691
 1639    HB2  TRP  99           HB3      TRP  99   5.116  18.895   1.973
 1640    HB3  TRP  99           HB2      TRP  99   4.094  17.507   2.314
 1641    HD1  TRP  99           HD1      TRP  99   4.248  21.299   2.825
 1642    HE1  TRP  99           HE1      TRP  99   1.884  22.159   3.365
 1643    HE3  TRP  99           HE3      TRP  99   1.842  16.813   3.259
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.664  21.071   3.909
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.562  16.811   3.792
 1646    HH2  TRP  99           HH2      TRP  99  -1.787  18.897   4.108
 1647    H    ARG 100           H        ARG 100   6.277  16.235   5.339
 1648    HA   ARG 100           HA       ARG 100   8.607  15.807   3.613
 1649    HB2  ARG 100           HB3      ARG 100   7.987  14.648   6.343
 1650    HB3  ARG 100           HB2      ARG 100   9.508  14.500   5.480
 1651    HG2  ARG 100           HG3      ARG 100   8.337  17.088   6.471
 1652    HG3  ARG 100           HG2      ARG 100   9.566  16.147   7.304
 1653    HD2  ARG 100           HD3      ARG 100  11.013  16.397   5.277
 1654    HD3  ARG 100           HD2      ARG 100   9.805  17.509   4.632
 1655    HE   ARG 100           HE       ARG 100  10.759  18.169   7.282
 1656   HH11  ARG 100          HH11      ARG 100  11.266  18.600   3.835
 1657   HH12  ARG 100          HH12      ARG 100  12.131  20.089   4.032
 1658   HH21  ARG 100          HH21      ARG 100  11.870  20.093   7.544
 1659   HH22  ARG 100          HH22      ARG 100  12.482  20.949   6.157
 1660    H    PHE 101           H        PHE 101   9.106  13.798   2.763
 1661    HA   PHE 101           HA       PHE 101   6.842  12.070   2.264
 1662    HB2  PHE 101           HB3      PHE 101   9.727  11.934   1.340
 1663    HB3  PHE 101           HB2      PHE 101   8.488  10.786   0.860
 1664    HD1  PHE 101           HD1      PHE 101   9.495  14.348   0.655
 1665    HD2  PHE 101           HD2      PHE 101   6.980  11.265  -0.868
 1666    HE1  PHE 101           HE1      PHE 101   8.860  15.797  -1.225
 1667    HE2  PHE 101           HE2      PHE 101   6.340  12.716  -2.748
 1668    HZ   PHE 101           HZ       PHE 101   7.281  14.982  -2.929
 1669    H    ILE 102           H        ILE 102   6.281  10.748   3.870
 1670    HA   ILE 102           HA       ILE 102   8.430   9.414   5.384
 1671    HB   ILE 102           HB       ILE 102   6.762   9.135   7.210
 1672   HG12  ILE 102          HG13      ILE 102   5.084  11.066   5.596
 1673   HG13  ILE 102          HG12      ILE 102   4.733   9.353   5.777
 1674   HG21  ILE 102          HG21      ILE 102   7.311  11.974   6.359
 1675   HG22  ILE 102          HG22      ILE 102   8.384  10.933   7.298
 1676   HG23  ILE 102          HG23      ILE 102   6.847  11.461   7.982
 1677   HD11  ILE 102          HD11      ILE 102   4.786  11.405   7.977
 1678   HD12  ILE 102          HD12      ILE 102   4.489   9.681   8.197
 1679   HD13  ILE 102          HD13      ILE 102   3.355  10.658   7.263
 1680    H    ARG 103           H        ARG 103   8.234   7.245   5.878
 1681    HA   ARG 103           HA       ARG 103   6.792   5.744   3.865
 1682    HB2  ARG 103           HB3      ARG 103   8.032   3.788   4.742
 1683    HB3  ARG 103           HB2      ARG 103   9.097   5.116   4.305
 1684    HG2  ARG 103           HG3      ARG 103   9.362   5.718   6.626
 1685    HG3  ARG 103           HG2      ARG 103   8.196   4.488   7.106
 1686    HD2  ARG 103           HD3      ARG 103   9.698   2.749   6.214
 1687    HD3  ARG 103           HD2      ARG 103  10.874   3.999   5.797
 1688    HE   ARG 103           HE       ARG 103  10.217   4.225   8.520
 1689   HH11  ARG 103          HH11      ARG 103  11.916   2.053   6.358
 1690   HH12  ARG 103          HH12      ARG 103  13.028   1.516   7.574
 1691   HH21  ARG 103          HH21      ARG 103  11.683   3.519  10.115
 1692   HH22  ARG 103          HH22      ARG 103  12.885   2.332   9.711
 1693    H    ILE 104           H        ILE 104   4.893   4.840   4.139
 1694    HA   ILE 104           HA       ILE 104   4.038   4.121   6.867
 1695    HB   ILE 104           HB       ILE 104   1.699   4.534   6.164
 1696   HG12  ILE 104          HG13      ILE 104   2.937   5.806   3.714
 1697   HG13  ILE 104          HG12      ILE 104   2.077   4.272   3.722
 1698   HG21  ILE 104          HG21      ILE 104   2.894   6.242   7.405
 1699   HG22  ILE 104          HG22      ILE 104   1.807   6.986   6.232
 1700   HG23  ILE 104          HG23      ILE 104   3.538   6.910   5.902
 1701   HD11  ILE 104          HD11      ILE 104   0.684   6.100   2.912
 1702   HD12  ILE 104          HD12      ILE 104   0.899   6.942   4.446
 1703   HD13  ILE 104          HD13      ILE 104   0.039   5.403   4.397
 1704    H    ASP 105           H        ASP 105   2.736   2.270   7.075
 1705    HA   ASP 105           HA       ASP 105   3.301   0.170   5.162
 1706    HB2  ASP 105           HB3      ASP 105   1.711   0.119   7.752
 1707    HB3  ASP 105           HB2      ASP 105   2.155  -1.299   6.805
 1708    H    THR 106           H        THR 106   2.032  -0.025   3.403
 1709    HA   THR 106           HA       THR 106  -0.659   1.082   3.508
 1710    HB   THR 106           HB       THR 106  -0.642   0.579   1.032
 1711    HG1  THR 106           HG1      THR 106   1.244  -0.090   0.108
 1712   HG21  THR 106          HG21      THR 106   0.897   2.437   0.500
 1713   HG22  THR 106          HG22      THR 106   1.518   2.364   2.150
 1714   HG23  THR 106          HG23      THR 106  -0.163   2.808   1.860
 1715    H    ALA 107           H        ALA 107   0.901  -2.024   2.822
 1716    HA   ALA 107           HA       ALA 107  -1.517  -3.432   3.533
 1717    HB1  ALA 107           HB1      ALA 107  -0.410  -3.660   0.741
 1718    HB2  ALA 107           HB2      ALA 107  -1.947  -2.918   1.189
 1719    HB3  ALA 107           HB3      ALA 107  -1.701  -4.649   1.424
 1720    H    CYS 108           H        CYS 108  -1.170  -5.694   3.802
 1721    HA   CYS 108           HA       CYS 108   1.654  -6.391   4.150
 1722    HB2  CYS 108           HB3      CYS 108   0.304  -6.677   6.159
 1723    HB3  CYS 108           HB2      CYS 108  -0.863  -7.656   5.268
 1724    H    VAL 109           H        VAL 109   2.547  -7.488   2.534
 1725    HA   VAL 109           HA       VAL 109   0.764  -9.040   0.791
 1726    HB   VAL 109           HB       VAL 109   2.446  -8.892  -0.938
 1727   HG11  VAL 109          HG11      VAL 109   1.981  -6.217   0.367
 1728   HG12  VAL 109          HG12      VAL 109   0.903  -7.034  -0.766
 1729   HG13  VAL 109          HG13      VAL 109   2.484  -6.467  -1.304
 1730   HG21  VAL 109          HG21      VAL 109   4.470  -9.039   0.385
 1731   HG22  VAL 109          HG22      VAL 109   4.152  -7.456   1.095
 1732   HG23  VAL 109          HG23      VAL 109   4.521  -7.592  -0.625
 1733    H    CYS 110           H        CYS 110   1.217 -11.146   0.257
 1734    HA   CYS 110           HA       CYS 110   3.070 -12.526   2.043
 1735    HB2  CYS 110           HB3      CYS 110   0.805 -13.445   1.943
 1736    HB3  CYS 110           HB2      CYS 110   0.929 -13.615   0.197
 1737    H    VAL 111           H        VAL 111   5.057 -12.862   1.324
 1738    HA   VAL 111           HA       VAL 111   5.381 -13.321  -1.569
 1739    HB   VAL 111           HB       VAL 111   7.783 -12.568  -1.206
 1740   HG11  VAL 111          HG11      VAL 111   5.563 -10.569  -0.774
 1741   HG12  VAL 111          HG12      VAL 111   6.163 -11.148  -2.330
 1742   HG13  VAL 111          HG13      VAL 111   7.203 -10.175  -1.290
 1743   HG21  VAL 111          HG21      VAL 111   6.613 -11.454   1.335
 1744   HG22  VAL 111          HG22      VAL 111   8.228 -11.139   0.701
 1745   HG23  VAL 111          HG23      VAL 111   7.791 -12.763   1.236
 1746    H    LEU 112           H        LEU 112   6.769 -14.959  -2.234
 1747    HA   LEU 112           HA       LEU 112   6.997 -17.091  -0.236
 1748    HB2  LEU 112           HB3      LEU 112   7.088 -17.247  -3.257
 1749    HB3  LEU 112           HB2      LEU 112   7.080 -18.611  -2.160
 1750    HG   LEU 112           HG       LEU 112   4.796 -16.648  -2.427
 1751   HD11  LEU 112          HD11      LEU 112   3.662 -18.403  -3.682
 1752   HD12  LEU 112          HD12      LEU 112   5.111 -19.402  -3.617
 1753   HD13  LEU 112          HD13      LEU 112   5.128 -17.881  -4.510
 1754   HD21  LEU 112          HD21      LEU 112   5.032 -19.322  -1.052
 1755   HD22  LEU 112          HD22      LEU 112   3.538 -18.410  -1.254
 1756   HD23  LEU 112          HD23      LEU 112   4.847 -17.750  -0.276
 1757    H    SER 113           H        SER 113   8.825 -18.416  -0.179
 1758    HA   SER 113           HA       SER 113  11.229 -17.428  -1.539
 1759    HB2  SER 113           HB3      SER 113  12.488 -18.265   0.513
 1760    HB3  SER 113           HB2      SER 113  11.522 -16.810   0.757
 1761    HG   SER 113           HG       SER 113   9.851 -18.241   1.566
 1762    H    ARG 114           H        ARG 114  12.555 -19.012  -2.385
 1763    HA   ARG 114           HA       ARG 114  11.169 -21.451  -3.027
 1764    HB2  ARG 114           HB3      ARG 114  12.470 -20.096  -4.678
 1765    HB3  ARG 114           HB2      ARG 114  13.943 -20.562  -3.842
 1766    HG2  ARG 114           HG3      ARG 114  13.658 -21.916  -5.803
 1767    HG3  ARG 114           HG2      ARG 114  13.462 -22.922  -4.367
 1768    HD2  ARG 114           HD3      ARG 114  11.055 -22.836  -4.601
 1769    HD3  ARG 114           HD2      ARG 114  11.201 -21.732  -5.968
 1770    HE   ARG 114           HE       ARG 114  12.652 -24.040  -6.569
 1771   HH11  ARG 114          HH11      ARG 114   9.334 -23.098  -6.017
 1772   HH12  ARG 114          HH12      ARG 114   8.675 -24.293  -7.086
 1773   HH21  ARG 114          HH21      ARG 114  11.798 -25.632  -7.965
 1774   HH22  ARG 114          HH22      ARG 114  10.082 -25.732  -8.209
 1775    H    LYS 115           H        LYS 115  13.142 -20.514  -0.548
 1776    HA   LYS 115           HA       LYS 115  13.910 -21.619   1.273
 1777    HB2  LYS 115           HB3      LYS 115  12.812 -24.067  -0.127
 1778    HB3  LYS 115           HB2      LYS 115  13.485 -24.083   1.494
 1779    HG2  LYS 115           HG3      LYS 115  11.741 -22.549   2.245
 1780    HG3  LYS 115           HG2      LYS 115  11.088 -22.496   0.605
 1781    HD2  LYS 115           HD3      LYS 115   9.824 -24.034   2.037
 1782    HD3  LYS 115           HD2      LYS 115  10.591 -24.865   0.687
 1783    HE2  LYS 115           HE3      LYS 115  10.807 -26.131   2.762
 1784    HE3  LYS 115           HE2      LYS 115  12.376 -25.629   2.140
 1785    HZ1  LYS 115           HZ1      LYS 115  10.879 -24.303   4.334
 1786    HZ2  LYS 115           HZ2      LYS 115  12.397 -23.834   3.754
 1787    HZ3  LYS 115           HZ3      LYS 115  12.213 -25.322   4.531
 1788    H    ALA 116           H        ALA 116  14.552 -24.002  -1.296
 1789    HA   ALA 116           HA       ALA 116  17.233 -24.390  -0.329
 1790    HB1  ALA 116           HB1      ALA 116  15.906 -25.451  -2.822
 1791    HB2  ALA 116           HB2      ALA 116  15.931 -26.249  -1.249
 1792    HB3  ALA 116           HB3      ALA 116  17.435 -26.006  -2.139
 1793    H    THR 117           H        THR 117  15.709 -22.781  -3.051
 1794    HA   THR 117           HA       THR 117  18.297 -21.555  -3.697
 1795    HB   THR 117           HB       THR 117  17.412 -21.487  -6.112
 1796    HG1  THR 117           HG1      THR 117  16.005 -23.824  -5.610
 1797   HG21  THR 117          HG21      THR 117  18.250 -23.742  -6.603
 1798   HG22  THR 117          HG22      THR 117  18.147 -24.150  -4.892
 1799   HG23  THR 117          HG23      THR 117  19.279 -22.912  -5.436
 1800    H    ARG 118           H        ARG 118  17.606 -19.685  -5.471
 1801    HA   ARG 118           HA       ARG 118  15.152 -18.352  -4.779
 1802    HB2  ARG 118           HB3      ARG 118  16.867 -17.706  -2.985
 1803    HB3  ARG 118           HB2      ARG 118  17.750 -16.885  -4.256
 1804    HG2  ARG 118           HG3      ARG 118  14.888 -16.246  -3.591
 1805    HG3  ARG 118           HG2      ARG 118  16.253 -15.464  -2.804
 1806    HD2  ARG 118           HD3      ARG 118  15.688 -15.443  -5.772
 1807    HD3  ARG 118           HD2      ARG 118  15.357 -14.119  -4.654
 1808    HE   ARG 118           HE       ARG 118  17.970 -14.483  -4.262
 1809   HH11  ARG 118          HH11      ARG 118  16.121 -14.261  -7.218
 1810   HH12  ARG 118          HH12      ARG 118  17.428 -13.597  -8.140
 1811   HH21  ARG 118          HH21      ARG 118  19.696 -13.596  -5.468
 1812   HH22  ARG 118          HH22      ARG 118  19.466 -13.217  -7.145
  Start of MODEL    6
    1    H1   SER   1           H1       SER   1  25.410   0.808  -4.398
    2    H2   SER   1           H2       SER   1  26.361  -0.445  -3.779
    3    H3   SER   1           H3       SER   1  26.170   0.984  -2.898
    4    HA   SER   1           HA       SER   1  23.847   0.545  -2.597
    5    HB2  SER   1           HB3      SER   1  23.108  -1.835  -3.281
    6    HB3  SER   1           HB2      SER   1  23.226  -0.615  -4.549
    7    HG   SER   1           HG       SER   1  24.379  -2.931  -4.554
    8    H    SER   2           H        SER   2  25.520   0.696  -0.739
    9    HA   SER   2           HA       SER   2  26.578  -1.676   0.386
   10    HB2  SER   2           HB3      SER   2  26.766  -0.181   2.470
   11    HB3  SER   2           HB2      SER   2  27.623   0.351   1.021
   12    HG   SER   2           HG       SER   2  26.064   1.825   2.341
   13    H    THR   3           H        THR   3  23.708   0.260   1.175
   14    HA   THR   3           HA       THR   3  22.750  -1.797   2.988
   15    HB   THR   3           HB       THR   3  20.727  -0.240   3.126
   16    HG1  THR   3           HG1      THR   3  21.612   0.836   1.049
   17   HG21  THR   3          HG21      THR   3  23.439   0.829   3.909
   18   HG22  THR   3          HG22      THR   3  22.445  -0.283   4.849
   19   HG23  THR   3          HG23      THR   3  21.897   1.370   4.570
   20    H    HIS   4           H        HIS   4  22.050  -3.589   1.971
   21    HA   HIS   4           HA       HIS   4  19.948  -3.232  -0.031
   22    HB2  HIS   4           HB3      HIS   4  20.910  -5.220  -1.298
   23    HB3  HIS   4           HB2      HIS   4  21.778  -3.702  -1.448
   24    HD1  HIS   4           HD1      HIS   4  24.207  -3.688  -0.782
   25    HD2  HIS   4           HD2      HIS   4  22.261  -7.198   0.308
   26    HE1  HIS   4           HE1      HIS   4  26.015  -5.264  -0.034
   27    HE2  HIS   4           HE2      HIS   4  24.828  -7.412   0.517
   28    HA   PRO   5           HA       PRO   5  18.496  -6.297   3.013
   29    HB2  PRO   5           HB3      PRO   5  16.085  -5.231   3.450
   30    HB3  PRO   5           HB2      PRO   5  17.533  -4.536   4.192
   31    HG2  PRO   5           HG3      PRO   5  15.986  -3.604   1.807
   32    HG3  PRO   5           HG2      PRO   5  16.733  -2.647   3.099
   33    HD2  PRO   5           HD3      PRO   5  17.839  -3.091   0.588
   34    HD3  PRO   5           HD2      PRO   5  18.748  -2.592   2.029
   35    H    VAL   6           H        VAL   6  18.623  -6.736   0.237
   36    HA   VAL   6           HA       VAL   6  17.693  -7.922  -1.465
   37    HB   VAL   6           HB       VAL   6  15.602  -8.864   0.496
   38   HG11  VAL   6          HG11      VAL   6  15.718 -10.944  -0.804
   39   HG12  VAL   6          HG12      VAL   6  16.903 -10.194  -1.875
   40   HG13  VAL   6          HG13      VAL   6  15.257  -9.564  -1.801
   41   HG21  VAL   6          HG21      VAL   6  17.774  -9.055   1.583
   42   HG22  VAL   6          HG22      VAL   6  18.408  -9.925   0.187
   43   HG23  VAL   6          HG23      VAL   6  17.132 -10.644   1.169
   44    H    PHE   7           H        PHE   7  16.928  -5.243  -1.180
   45    HA   PHE   7           HA       PHE   7  15.379  -3.664  -1.719
   46    HB2  PHE   7           HB3      PHE   7  15.522  -4.954  -3.874
   47    HB3  PHE   7           HB2      PHE   7  14.120  -5.877  -3.358
   48    HD1  PHE   7           HD1      PHE   7  12.036  -5.184  -4.060
   49    HD2  PHE   7           HD2      PHE   7  15.201  -2.345  -3.852
   50    HE1  PHE   7           HE1      PHE   7  10.566  -3.483  -5.048
   51    HE2  PHE   7           HE2      PHE   7  13.735  -0.634  -4.842
   52    HZ   PHE   7           HZ       PHE   7  11.413  -1.199  -5.440
   53    H    HIS   8           H        HIS   8  14.940  -4.572   0.695
   54    HA   HIS   8           HA       HIS   8  13.468  -4.932   2.386
   55    HB2  HIS   8           HB3      HIS   8  12.455  -2.867   1.290
   56    HB3  HIS   8           HB2      HIS   8  11.330  -3.950   0.482
   57    HD1  HIS   8           HD1      HIS   8  12.278  -2.756   3.934
   58    HD2  HIS   8           HD2      HIS   8   9.177  -4.747   2.013
   59    HE1  HIS   8           HE1      HIS   8  10.426  -2.909   5.624
   60    HE2  HIS   8           HE2      HIS   8   8.524  -4.040   4.417
   61    H    MET   9           H        MET   9  14.139  -7.150   1.167
   62    HA   MET   9           HA       MET   9  13.616  -9.344   0.978
   63    HB2  MET   9           HB3      MET   9  11.968  -8.977   2.810
   64    HB3  MET   9           HB2      MET   9  10.754  -8.592   1.599
   65    HG2  MET   9           HG3      MET   9  10.483 -10.867   2.341
   66    HG3  MET   9           HG2      MET   9  10.993 -10.845   0.656
   67    HE1  MET   9           HE1      MET   9  13.122 -10.312   3.946
   68    HE2  MET   9           HE2      MET   9  13.720 -11.947   4.215
   69    HE3  MET   9           HE3      MET   9  11.996 -11.604   4.356
   70    H    GLY  10           H        GLY  10  11.453  -7.067  -0.611
   71    HA2  GLY  10           HA3      GLY  10  11.870  -7.154  -3.102
   72    HA3  GLY  10           HA2      GLY  10  11.453  -8.854  -2.961
   73    H    GLU  11           H        GLU  11   9.990  -7.702  -4.727
   74    HA   GLU  11           HA       GLU  11   7.487  -6.908  -3.407
   75    HB2  GLU  11           HB3      GLU  11   6.768  -6.044  -5.578
   76    HB3  GLU  11           HB2      GLU  11   8.313  -5.340  -5.117
   77    HG2  GLU  11           HG3      GLU  11   8.035  -7.652  -7.024
   78    HG3  GLU  11           HG2      GLU  11   8.098  -5.966  -7.527
   79    H    PHE  12           H        PHE  12   8.540  -9.601  -3.501
   80    HA   PHE  12           HA       PHE  12   7.196 -11.140  -5.469
   81    HB2  PHE  12           HB3      PHE  12   8.268 -11.959  -2.754
   82    HB3  PHE  12           HB2      PHE  12   7.722 -13.076  -4.000
   83    HD1  PHE  12           HD1      PHE  12  10.372 -10.791  -2.959
   84    HD2  PHE  12           HD2      PHE  12   9.043 -13.469  -5.985
   85    HE1  PHE  12           HE1      PHE  12  12.637 -10.828  -3.918
   86    HE2  PHE  12           HE2      PHE  12  11.306 -13.511  -6.949
   87    HZ   PHE  12           HZ       PHE  12  13.106 -12.189  -5.916
   88    H    SER  13           H        SER  13   5.157 -11.797  -5.553
   89    HA   SER  13           HA       SER  13   3.575 -12.068  -3.146
   90    HB2  SER  13           HB3      SER  13   3.316  -9.669  -3.769
   91    HB3  SER  13           HB2      SER  13   2.728 -10.163  -5.351
   92    HG   SER  13           HG       SER  13   1.109  -9.662  -3.667
   93    H    VAL  14           H        VAL  14   1.476 -13.064  -3.610
   94    HA   VAL  14           HA       VAL  14   1.712 -15.123  -5.590
   95    HB   VAL  14           HB       VAL  14  -0.544 -15.828  -4.785
   96   HG11  VAL  14          HG11      VAL  14   1.552 -15.318  -2.679
   97   HG12  VAL  14          HG12      VAL  14   1.422 -16.734  -3.723
   98   HG13  VAL  14          HG13      VAL  14   0.192 -16.427  -2.498
   99   HG21  VAL  14          HG21      VAL  14  -1.550 -14.730  -2.877
  100   HG22  VAL  14          HG22      VAL  14  -1.382 -13.582  -4.207
  101   HG23  VAL  14          HG23      VAL  14  -0.256 -13.532  -2.850
  102    H    CYS  15           H        CYS  15   0.390 -11.991  -5.503
  103    HA   CYS  15           HA       CYS  15  -0.892 -12.450  -8.112
  104    HB2  CYS  15           HB3      CYS  15  -1.716 -10.565  -5.895
  105    HB3  CYS  15           HB2      CYS  15  -2.334 -10.448  -7.542
  106    H    ASP  16           H        ASP  16   0.027 -11.386  -9.731
  107    HA   ASP  16           HA       ASP  16   2.355  -9.875  -9.450
  108    HB2  ASP  16           HB3      ASP  16   0.397  -9.871 -11.768
  109    HB3  ASP  16           HB2      ASP  16   2.053  -9.275 -11.832
  110    H    SER  17           H        SER  17   2.616  -7.931  -8.630
  111    HA   SER  17           HA       SER  17   0.468  -5.950  -8.972
  112    HB2  SER  17           HB3      SER  17   2.218  -6.304  -6.523
  113    HB3  SER  17           HB2      SER  17   0.919  -5.122  -6.721
  114    HG   SER  17           HG       SER  17   0.528  -7.933  -6.883
  115    H    VAL  18           H        VAL  18   1.095  -4.049  -9.799
  116    HA   VAL  18           HA       VAL  18   3.988  -3.567  -9.996
  117    HB   VAL  18           HB       VAL  18   2.979  -3.936 -12.174
  118   HG11  VAL  18          HG11      VAL  18   1.314  -2.377 -13.093
  119   HG12  VAL  18          HG12      VAL  18   1.164  -1.629 -11.503
  120   HG13  VAL  18          HG13      VAL  18   0.695  -3.314 -11.733
  121   HG21  VAL  18          HG21      VAL  18   4.825  -2.387 -12.073
  122   HG22  VAL  18          HG22      VAL  18   3.729  -1.056 -11.709
  123   HG23  VAL  18          HG23      VAL  18   3.664  -1.847 -13.284
  124    H    SER  19           H        SER  19   4.671  -2.035  -8.663
  125    HA   SER  19           HA       SER  19   2.841   0.028  -7.736
  126    HB2  SER  19           HB3      SER  19   5.729  -0.509  -6.978
  127    HB3  SER  19           HB2      SER  19   4.651   0.648  -6.187
  128    HG   SER  19           HG       SER  19   3.314  -1.102  -5.586
  129    H    VAL  20           H        VAL  20   2.639   1.857  -8.813
  130    HA   VAL  20           HA       VAL  20   4.946   2.841 -10.367
  131    HB   VAL  20           HB       VAL  20   2.011   3.268 -10.950
  132   HG11  VAL  20          HG11      VAL  20   3.311   5.140 -11.701
  133   HG12  VAL  20          HG12      VAL  20   2.816   4.180 -13.097
  134   HG13  VAL  20          HG13      VAL  20   4.470   4.067 -12.489
  135   HG21  VAL  20          HG21      VAL  20   2.633   0.964 -11.365
  136   HG22  VAL  20          HG22      VAL  20   4.011   1.490 -12.332
  137   HG23  VAL  20          HG23      VAL  20   2.367   1.812 -12.890
  138    H    TRP  21           H        TRP  21   5.552   4.929 -10.049
  139    HA   TRP  21           HA       TRP  21   4.016   6.473  -8.084
  140    HB2  TRP  21           HB3      TRP  21   6.894   6.708  -9.000
  141    HB3  TRP  21           HB2      TRP  21   6.110   7.879  -7.943
  142    HD1  TRP  21           HD1      TRP  21   7.323   4.224  -7.971
  143    HE1  TRP  21           HE1      TRP  21   7.603   3.432  -5.537
  144    HE3  TRP  21           HE3      TRP  21   5.365   8.296  -5.556
  145    HZ2  TRP  21           HZ2      TRP  21   7.072   4.406  -2.942
  146    HZ3  TRP  21           HZ3      TRP  21   5.294   8.281  -3.096
  147    HH2  TRP  21           HH2      TRP  21   6.128   6.378  -1.818
  148    H    VAL  22           H        VAL  22   2.476   7.442  -9.253
  149    HA   VAL  22           HA       VAL  22   3.145   8.647 -11.828
  150    HB   VAL  22           HB       VAL  22   0.437   8.468 -10.504
  151   HG11  VAL  22          HG11      VAL  22   1.244   8.931 -13.369
  152   HG12  VAL  22          HG12      VAL  22   0.560  10.125 -12.267
  153   HG13  VAL  22          HG13      VAL  22  -0.411   8.749 -12.791
  154   HG21  VAL  22          HG21      VAL  22   0.036   6.506 -11.938
  155   HG22  VAL  22          HG22      VAL  22   1.312   6.227 -10.754
  156   HG23  VAL  22          HG23      VAL  22   1.727   6.546 -12.438
  157    H    GLY  23           H        GLY  23   3.956  10.658 -11.685
  158    HA2  GLY  23           HA3      GLY  23   2.896  12.445  -9.602
  159    HA3  GLY  23           HA2      GLY  23   4.409  12.675 -10.475
  160    H    ASP  24           H        ASP  24   1.889  11.696 -12.493
  161    HA   ASP  24           HA       ASP  24   1.214  14.471 -13.187
  162    HB2  ASP  24           HB3      ASP  24   2.072  12.306 -15.122
  163    HB3  ASP  24           HB2      ASP  24   1.324  13.823 -15.612
  164    H    LYS  25           H        LYS  25  -0.244  12.368 -11.733
  165    HA   LYS  25           HA       LYS  25  -2.305  11.428 -13.497
  166    HB2  LYS  25           HB3      LYS  25  -1.630  10.289 -11.351
  167    HB3  LYS  25           HB2      LYS  25  -2.369  11.621 -10.475
  168    HG2  LYS  25           HG3      LYS  25  -4.536  11.066 -11.353
  169    HG3  LYS  25           HG2      LYS  25  -3.841   9.814 -12.382
  170    HD2  LYS  25           HD3      LYS  25  -3.073   8.633 -10.337
  171    HD3  LYS  25           HD2      LYS  25  -3.897   9.852  -9.365
  172    HE2  LYS  25           HE3      LYS  25  -6.033   9.228 -10.381
  173    HE3  LYS  25           HE2      LYS  25  -5.217   8.014 -11.371
  174    HZ1  LYS  25           HZ1      LYS  25  -6.258   7.027  -9.433
  175    HZ2  LYS  25           HZ2      LYS  25  -5.358   8.015  -8.402
  176    HZ3  LYS  25           HZ3      LYS  25  -4.574   6.847  -9.348
  177    H    THR  26           H        THR  26  -3.685  12.832 -14.405
  178    HA   THR  26           HA       THR  26  -4.142  15.386 -13.072
  179    HB   THR  26           HB       THR  26  -3.369  15.460 -15.403
  180    HG1  THR  26           HG1      THR  26  -5.834  16.515 -14.599
  181   HG21  THR  26          HG21      THR  26  -5.990  14.095 -16.026
  182   HG22  THR  26          HG22      THR  26  -4.375  13.428 -16.269
  183   HG23  THR  26          HG23      THR  26  -4.910  14.810 -17.222
  184    H    THR  27           H        THR  27  -5.720  12.446 -13.374
  185    HA   THR  27           HA       THR  27  -8.185  13.692 -12.427
  186    HB   THR  27           HB       THR  27  -9.428  11.839 -13.773
  187    HG1  THR  27           HG1      THR  27  -6.910  11.989 -15.036
  188   HG21  THR  27          HG21      THR  27  -8.334  14.315 -15.105
  189   HG22  THR  27          HG22      THR  27  -9.784  14.218 -14.103
  190   HG23  THR  27          HG23      THR  27  -9.728  13.388 -15.660
  191    H    ALA  28           H        ALA  28  -9.084  12.669 -10.746
  192    HA   ALA  28           HA       ALA  28  -8.485   9.844 -10.297
  193    HB1  ALA  28           HB1      ALA  28  -7.906  11.945  -8.212
  194    HB2  ALA  28           HB2      ALA  28  -6.694  11.050  -9.129
  195    HB3  ALA  28           HB3      ALA  28  -7.756  10.199  -8.008
  196    H    THR  29           H        THR  29  -9.834   8.931  -8.561
  197    HA   THR  29           HA       THR  29 -12.456  10.215  -8.606
  198    HB   THR  29           HB       THR  29 -11.797   7.431  -7.645
  199    HG1  THR  29           HG1      THR  29 -11.668   8.399 -10.123
  200   HG21  THR  29          HG21      THR  29 -14.169   7.019  -8.057
  201   HG22  THR  29          HG22      THR  29 -14.377   8.685  -8.598
  202   HG23  THR  29          HG23      THR  29 -13.962   8.349  -6.916
  203    H    ASP  30           H        ASP  30 -13.036  11.382  -6.979
  204    HA   ASP  30           HA       ASP  30 -11.670  11.576  -4.512
  205    HB2  ASP  30           HB3      ASP  30 -12.890  13.451  -5.502
  206    HB3  ASP  30           HB2      ASP  30 -14.405  12.560  -5.378
  207    H    ILE  31           H        ILE  31 -12.770  11.312  -2.358
  208    HA   ILE  31           HA       ILE  31 -13.508   8.638  -1.962
  209    HB   ILE  31           HB       ILE  31 -12.462   9.969  -0.207
  210   HG12  ILE  31          HG13      ILE  31 -15.227   9.093   0.656
  211   HG13  ILE  31          HG12      ILE  31 -13.866   8.004   0.407
  212   HG21  ILE  31          HG21      ILE  31 -15.060  11.493  -0.087
  213   HG22  ILE  31          HG22      ILE  31 -13.511  12.115  -0.653
  214   HG23  ILE  31          HG23      ILE  31 -13.714  11.661   1.038
  215   HD11  ILE  31          HD11      ILE  31 -14.187   8.496   2.761
  216   HD12  ILE  31          HD12      ILE  31 -14.004  10.219   2.437
  217   HD13  ILE  31          HD13      ILE  31 -12.641   9.127   2.193
  218    H    LYS  32           H        LYS  32 -15.424  11.483  -2.600
  219    HA   LYS  32           HA       LYS  32 -17.925  10.295  -1.824
  220    HB2  LYS  32           HB3      LYS  32 -17.296  12.756  -3.459
  221    HB3  LYS  32           HB2      LYS  32 -18.903  12.309  -2.897
  222    HG2  LYS  32           HG3      LYS  32 -18.248  12.587  -0.611
  223    HG3  LYS  32           HG2      LYS  32 -16.563  12.824  -1.078
  224    HD2  LYS  32           HD3      LYS  32 -17.155  14.867  -2.237
  225    HD3  LYS  32           HD2      LYS  32 -18.855  14.632  -1.830
  226    HE2  LYS  32           HE3      LYS  32 -18.341  14.829   0.531
  227    HE3  LYS  32           HE2      LYS  32 -16.623  14.965   0.165
  228    HZ1  LYS  32           HZ1      LYS  32 -17.042  17.038  -0.965
  229    HZ2  LYS  32           HZ2      LYS  32 -17.666  17.123   0.603
  230    HZ3  LYS  32           HZ3      LYS  32 -18.704  16.891  -0.708
  231    H    GLY  33           H        GLY  33 -15.891   9.966  -4.486
  232    HA2  GLY  33           HA3      GLY  33 -16.299   8.289  -6.124
  233    HA3  GLY  33           HA2      GLY  33 -18.027   8.547  -5.912
  234    H    LYS  34           H        LYS  34 -16.234  11.413  -6.122
  235    HA   LYS  34           HA       LYS  34 -17.281  11.908  -8.802
  236    HB2  LYS  34           HB3      LYS  34 -15.914  13.776  -6.856
  237    HB3  LYS  34           HB2      LYS  34 -16.691  14.249  -8.357
  238    HG2  LYS  34           HG3      LYS  34 -18.845  13.620  -7.483
  239    HG3  LYS  34           HG2      LYS  34 -18.094  12.995  -6.014
  240    HD2  LYS  34           HD3      LYS  34 -17.282  15.214  -5.468
  241    HD3  LYS  34           HD2      LYS  34 -17.990  15.858  -6.948
  242    HE2  LYS  34           HE3      LYS  34 -19.538  14.545  -4.725
  243    HE3  LYS  34           HE2      LYS  34 -19.361  16.283  -4.926
  244    HZ1  LYS  34           HZ1      LYS  34 -20.430  16.069  -7.106
  245    HZ2  LYS  34           HZ2      LYS  34 -21.439  15.564  -5.849
  246    HZ3  LYS  34           HZ3      LYS  34 -20.670  14.419  -6.825
  247    H    GLU  35           H        GLU  35 -15.984  12.290 -10.579
  248    HA   GLU  35           HA       GLU  35 -13.158  11.696 -10.294
  249    HB2  GLU  35           HB3      GLU  35 -14.383  10.774 -12.217
  250    HB3  GLU  35           HB2      GLU  35 -14.776  12.402 -12.751
  251    HG2  GLU  35           HG3      GLU  35 -12.421  12.873 -13.115
  252    HG3  GLU  35           HG2      GLU  35 -11.998  11.264 -12.537
  253    H    VAL  36           H        VAL  36 -11.776  13.229  -9.780
  254    HA   VAL  36           HA       VAL  36 -12.470  16.006 -10.454
  255    HB   VAL  36           HB       VAL  36 -11.128  16.686  -8.475
  256   HG11  VAL  36          HG11      VAL  36 -13.442  14.833  -7.934
  257   HG12  VAL  36          HG12      VAL  36 -13.535  16.559  -8.294
  258   HG13  VAL  36          HG13      VAL  36 -12.793  16.009  -6.790
  259   HG21  VAL  36          HG21      VAL  36 -10.562  15.025  -6.783
  260   HG22  VAL  36          HG22      VAL  36  -9.721  14.694  -8.297
  261   HG23  VAL  36          HG23      VAL  36 -11.133  13.737  -7.843
  262    H    THR  37           H        THR  37 -10.745  17.438 -10.908
  263    HA   THR  37           HA       THR  37  -8.674  16.137 -12.461
  264    HB   THR  37           HB       THR  37  -9.289  19.084 -12.224
  265    HG1  THR  37           HG1      THR  37 -10.850  17.251 -13.208
  266   HG21  THR  37          HG21      THR  37  -7.074  18.570 -13.151
  267   HG22  THR  37          HG22      THR  37  -8.140  19.246 -14.381
  268   HG23  THR  37          HG23      THR  37  -7.820  17.513 -14.348
  269    H    VAL  38           H        VAL  38  -6.909  15.585 -11.373
  270    HA   VAL  38           HA       VAL  38  -5.994  17.041  -9.063
  271    HB   VAL  38           HB       VAL  38  -4.510  14.868 -10.543
  272   HG11  VAL  38          HG11      VAL  38  -4.428  15.693  -7.647
  273   HG12  VAL  38          HG12      VAL  38  -3.242  16.149  -8.869
  274   HG13  VAL  38          HG13      VAL  38  -3.438  14.458  -8.422
  275   HG21  VAL  38          HG21      VAL  38  -6.548  14.530  -8.348
  276   HG22  VAL  38          HG22      VAL  38  -5.540  13.256  -9.027
  277   HG23  VAL  38          HG23      VAL  38  -6.750  14.052 -10.033
  278    H    LEU  39           H        LEU  39  -4.295  18.466  -8.989
  279    HA   LEU  39           HA       LEU  39  -3.565  19.652 -11.519
  280    HB2  LEU  39           HB3      LEU  39  -2.844  20.395  -8.683
  281    HB3  LEU  39           HB2      LEU  39  -2.427  21.343 -10.100
  282    HG   LEU  39           HG       LEU  39  -5.243  20.738  -9.195
  283   HD11  LEU  39          HD11      LEU  39  -3.640  23.279  -8.989
  284   HD12  LEU  39          HD12      LEU  39  -4.080  22.226  -7.647
  285   HD13  LEU  39          HD13      LEU  39  -5.334  23.080  -8.544
  286   HD21  LEU  39          HD21      LEU  39  -4.167  22.505 -11.382
  287   HD22  LEU  39          HD22      LEU  39  -5.846  22.464 -10.846
  288   HD23  LEU  39          HD23      LEU  39  -5.122  21.036 -11.584
  289    H    ALA  40           H        ALA  40  -2.423  17.070 -10.015
  290    HA   ALA  40           HA       ALA  40  -0.561  15.794 -10.154
  291    HB1  ALA  40           HB1      ALA  40   1.164  16.301 -11.785
  292    HB2  ALA  40           HB2      ALA  40   0.512  17.927 -11.994
  293    HB3  ALA  40           HB3      ALA  40  -0.439  16.525 -12.487
  294    H    GLU  41           H        GLU  41   0.188  19.225  -9.801
  295    HA   GLU  41           HA       GLU  41   2.032  18.525  -7.617
  296    HB2  GLU  41           HB3      GLU  41   2.362  20.833  -9.548
  297    HB3  GLU  41           HB2      GLU  41   3.490  20.339  -8.293
  298    HG2  GLU  41           HG3      GLU  41   3.906  18.254  -9.465
  299    HG3  GLU  41           HG2      GLU  41   2.742  18.704 -10.706
  300    H    VAL  42           H        VAL  42   2.041  20.000  -5.856
  301    HA   VAL  42           HA       VAL  42  -0.362  21.665  -5.763
  302    HB   VAL  42           HB       VAL  42  -0.141  21.712  -3.357
  303   HG11  VAL  42          HG11      VAL  42  -1.247  19.778  -4.321
  304   HG12  VAL  42          HG12      VAL  42  -0.391  19.337  -2.843
  305   HG13  VAL  42          HG13      VAL  42   0.295  18.926  -4.415
  306   HG21  VAL  42          HG21      VAL  42   1.626  20.546  -2.156
  307   HG22  VAL  42          HG22      VAL  42   2.292  21.827  -3.172
  308   HG23  VAL  42          HG23      VAL  42   2.411  20.142  -3.683
  309    H    ASN  43           H        ASN  43  -0.230  23.789  -5.947
  310    HA   ASN  43           HA       ASN  43   2.344  25.028  -6.268
  311    HB2  ASN  43           HB3      ASN  43   1.142  27.019  -6.920
  312    HB3  ASN  43           HB2      ASN  43   0.368  25.638  -7.688
  313   HD21  ASN  43          HD21      ASN  43  -1.688  25.003  -7.004
  314   HD22  ASN  43          HD22      ASN  43  -2.690  26.037  -6.047
  315    H    ILE  44           H        ILE  44   3.120  26.798  -5.034
  316    HA   ILE  44           HA       ILE  44   2.908  26.171  -2.279
  317    HB   ILE  44           HB       ILE  44   5.061  26.740  -3.180
  318   HG12  ILE  44          HG13      ILE  44   4.176  28.905  -1.262
  319   HG13  ILE  44          HG12      ILE  44   4.596  27.258  -0.798
  320   HG21  ILE  44          HG21      ILE  44   4.410  28.271  -4.934
  321   HG22  ILE  44          HG22      ILE  44   5.635  29.010  -3.905
  322   HG23  ILE  44          HG23      ILE  44   3.941  29.477  -3.740
  323   HD11  ILE  44          HD11      ILE  44   6.875  27.619  -1.611
  324   HD12  ILE  44          HD12      ILE  44   6.430  28.779  -0.360
  325   HD13  ILE  44          HD13      ILE  44   6.450  29.273  -2.053
  326    H    ASN  45           H        ASN  45   0.548  26.687  -2.180
  327    HA   ASN  45           HA       ASN  45   0.112  29.440  -1.309
  328    HB2  ASN  45           HB3      ASN  45  -1.640  26.969  -1.162
  329    HB3  ASN  45           HB2      ASN  45  -2.112  28.534  -0.517
  330   HD21  ASN  45          HD21      ASN  45  -0.867  30.008  -2.734
  331   HD22  ASN  45          HD22      ASN  45  -1.903  29.772  -4.091
  332    H    ASN  46           H        ASN  46   1.647  26.790  -0.306
  333    HA   ASN  46           HA       ASN  46   2.142  27.793   2.311
  334    HB2  ASN  46           HB3      ASN  46   0.059  26.575   2.807
  335    HB3  ASN  46           HB2      ASN  46   0.714  25.126   2.052
  336   HD21  ASN  46          HD21      ASN  46   2.597  27.276   4.089
  337   HD22  ASN  46          HD22      ASN  46   2.788  26.161   5.396
  338    H    SER  47           H        SER  47   2.275  24.958   0.191
  339    HA   SER  47           HA       SER  47   5.177  25.019   0.303
  340    HB2  SER  47           HB3      SER  47   5.163  22.491   0.624
  341    HB3  SER  47           HB2      SER  47   4.715  23.434   2.047
  342    HG   SER  47           HG       SER  47   3.011  22.200   2.024
  343    H    VAL  48           H        VAL  48   6.132  23.749  -1.474
  344    HA   VAL  48           HA       VAL  48   4.196  23.187  -3.613
  345    HB   VAL  48           HB       VAL  48   5.298  25.213  -4.252
  346   HG11  VAL  48          HG11      VAL  48   7.743  25.359  -4.543
  347   HG12  VAL  48          HG12      VAL  48   7.903  23.783  -3.765
  348   HG13  VAL  48          HG13      VAL  48   7.259  25.153  -2.861
  349   HG21  VAL  48          HG21      VAL  48   4.883  23.652  -6.045
  350   HG22  VAL  48          HG22      VAL  48   6.439  22.871  -5.762
  351   HG23  VAL  48          HG23      VAL  48   6.380  24.532  -6.352
  352    H    PHE  49           H        PHE  49   4.130  21.123  -3.989
  353    HA   PHE  49           HA       PHE  49   6.585  19.580  -4.286
  354    HB2  PHE  49           HB3      PHE  49   4.377  18.888  -2.334
  355    HB3  PHE  49           HB2      PHE  49   5.521  17.694  -2.932
  356    HD1  PHE  49           HD1      PHE  49   4.963  20.420  -0.623
  357    HD2  PHE  49           HD2      PHE  49   7.921  17.901  -2.362
  358    HE1  PHE  49           HE1      PHE  49   6.529  21.017   1.182
  359    HE2  PHE  49           HE2      PHE  49   9.488  18.496  -0.563
  360    HZ   PHE  49           HZ       PHE  49   8.793  20.053   1.211
  361    H    ARG  50           H        ARG  50   6.408  18.040  -5.859
  362    HA   ARG  50           HA       ARG  50   3.958  17.861  -7.350
  363    HB2  ARG  50           HB3      ARG  50   6.006  17.734  -8.608
  364    HB3  ARG  50           HB2      ARG  50   6.600  16.412  -7.613
  365    HG2  ARG  50           HG3      ARG  50   5.049  14.890  -8.534
  366    HG3  ARG  50           HG2      ARG  50   4.132  16.180  -9.306
  367    HD2  ARG  50           HD3      ARG  50   6.995  15.550  -9.979
  368    HD3  ARG  50           HD2      ARG  50   5.623  14.833 -10.823
  369    HE   ARG  50           HE       ARG  50   6.067  17.755 -10.723
  370   HH11  ARG  50          HH11      ARG  50   5.361  14.818 -12.497
  371   HH12  ARG  50          HH12      ARG  50   5.022  15.641 -13.983
  372   HH21  ARG  50          HH21      ARG  50   5.651  18.843 -12.690
  373   HH22  ARG  50          HH22      ARG  50   5.226  17.930 -14.103
  374    H    GLN  51           H        GLN  51   2.394  16.383  -7.147
  375    HA   GLN  51           HA       GLN  51   2.540  14.659  -4.828
  376    HB2  GLN  51           HB3      GLN  51   0.492  16.058  -6.119
  377    HB3  GLN  51           HB2      GLN  51   0.147  14.368  -6.455
  378    HG2  GLN  51           HG3      GLN  51   0.483  15.632  -3.746
  379    HG3  GLN  51           HG2      GLN  51  -1.022  15.077  -4.475
  380   HE21  GLN  51          HE21      GLN  51   0.194  12.642  -5.565
  381   HE22  GLN  51          HE22      GLN  51   0.458  11.588  -4.214
  382    H    TYR  52           H        TYR  52   4.045  13.071  -5.504
  383    HA   TYR  52           HA       TYR  52   3.480  11.425  -7.786
  384    HB2  TYR  52           HB3      TYR  52   5.271  10.887  -5.394
  385    HB3  TYR  52           HB2      TYR  52   5.217   9.920  -6.863
  386    HD1  TYR  52           HD1      TYR  52   6.514  12.925  -5.309
  387    HD2  TYR  52           HD2      TYR  52   6.020  10.885  -9.008
  388    HE1  TYR  52           HE1      TYR  52   8.223  14.368  -6.327
  389    HE2  TYR  52           HE2      TYR  52   7.729  12.322 -10.036
  390    HH   TYR  52           HH       TYR  52   8.763  14.470  -9.714
  391    H    PHE  53           H        PHE  53   1.959   9.942  -7.901
  392    HA   PHE  53           HA       PHE  53   0.698   9.010  -5.439
  393    HB2  PHE  53           HB3      PHE  53  -0.143   8.800  -8.341
  394    HB3  PHE  53           HB2      PHE  53  -1.043   8.088  -7.004
  395    HD1  PHE  53           HD1      PHE  53  -1.960   9.597  -5.234
  396    HD2  PHE  53           HD2      PHE  53  -0.407  11.060  -8.910
  397    HE1  PHE  53           HE1      PHE  53  -3.150  11.719  -4.882
  398    HE2  PHE  53           HE2      PHE  53  -1.591  13.188  -8.568
  399    HZ   PHE  53           HZ       PHE  53  -2.961  13.517  -6.549
  400    H    PHE  54           H        PHE  54   1.338   7.184  -4.598
  401    HA   PHE  54           HA       PHE  54   2.791   5.238  -6.159
  402    HB2  PHE  54           HB3      PHE  54   2.758   3.995  -3.886
  403    HB3  PHE  54           HB2      PHE  54   3.683   5.486  -3.997
  404    HD1  PHE  54           HD1      PHE  54   0.846   3.817  -2.456
  405    HD2  PHE  54           HD2      PHE  54   2.834   7.549  -2.949
  406    HE1  PHE  54           HE1      PHE  54  -0.387   4.723  -0.534
  407    HE2  PHE  54           HE2      PHE  54   1.603   8.462  -1.026
  408    HZ   PHE  54           HZ       PHE  54  -0.009   7.052   0.185
  409    H    GLU  55           H        GLU  55   1.404   4.344  -7.590
  410    HA   GLU  55           HA       GLU  55  -1.050   3.141  -6.507
  411    HB2  GLU  55           HB3      GLU  55  -0.452   3.763  -9.409
  412    HB3  GLU  55           HB2      GLU  55  -1.997   3.269  -8.723
  413    HG2  GLU  55           HG3      GLU  55  -1.788   5.436  -7.311
  414    HG3  GLU  55           HG2      GLU  55  -0.596   5.908  -8.523
  415    H    THR  56           H        THR  56  -0.680   1.119  -6.000
  416    HA   THR  56           HA       THR  56   0.988  -0.542  -7.733
  417    HB   THR  56           HB       THR  56  -0.267  -1.253  -5.073
  418    HG1  THR  56           HG1      THR  56   1.304  -0.051  -4.328
  419   HG21  THR  56          HG21      THR  56   0.225  -3.199  -6.476
  420   HG22  THR  56          HG22      THR  56   1.319  -3.125  -5.094
  421   HG23  THR  56          HG23      THR  56   1.882  -2.633  -6.691
  422    H    LYS  57           H        LYS  57  -0.079  -1.299  -9.410
  423    HA   LYS  57           HA       LYS  57  -2.925  -1.944  -9.104
  424    HB2  LYS  57           HB3      LYS  57  -1.301  -1.432 -11.607
  425    HB3  LYS  57           HB2      LYS  57  -3.030  -1.756 -11.563
  426    HG2  LYS  57           HG3      LYS  57  -3.362   0.289 -10.242
  427    HG3  LYS  57           HG2      LYS  57  -1.635   0.623 -10.348
  428    HD2  LYS  57           HD3      LYS  57  -2.734   1.931 -12.010
  429    HD3  LYS  57           HD2      LYS  57  -1.880   0.628 -12.835
  430    HE2  LYS  57           HE3      LYS  57  -3.971  -0.635 -12.981
  431    HE3  LYS  57           HE2      LYS  57  -4.819   0.682 -12.175
  432    HZ1  LYS  57           HZ1      LYS  57  -3.442   0.859 -14.799
  433    HZ2  LYS  57           HZ2      LYS  57  -4.225   2.135 -14.021
  434    HZ3  LYS  57           HZ3      LYS  57  -5.114   0.802 -14.559
  435    H    CYS  58           H        CYS  58  -3.753  -3.860 -10.058
  436    HA   CYS  58           HA       CYS  58  -1.867  -6.043  -9.715
  437    HB2  CYS  58           HB3      CYS  58  -4.247  -5.885  -8.676
  438    HB3  CYS  58           HB2      CYS  58  -4.792  -6.404 -10.265
  439    H    ARG  59           H        ARG  59  -0.990  -7.108 -11.333
  440    HA   ARG  59           HA       ARG  59  -1.968  -6.613 -14.051
  441    HB2  ARG  59           HB3      ARG  59   0.600  -7.869 -13.068
  442    HB3  ARG  59           HB2      ARG  59   0.195  -7.603 -14.756
  443    HG2  ARG  59           HG3      ARG  59   0.121  -5.183 -14.331
  444    HG3  ARG  59           HG2      ARG  59   0.598  -5.483 -12.661
  445    HD2  ARG  59           HD3      ARG  59   2.525  -4.852 -14.004
  446    HD3  ARG  59           HD2      ARG  59   2.672  -6.513 -13.437
  447    HE   ARG  59           HE       ARG  59   1.489  -6.488 -15.997
  448   HH11  ARG  59          HH11      ARG  59   4.559  -5.936 -14.421
  449   HH12  ARG  59          HH12      ARG  59   5.498  -6.371 -15.814
  450   HH21  ARG  59          HH21      ARG  59   2.710  -7.064 -17.831
  451   HH22  ARG  59          HH22      ARG  59   4.445  -7.016 -17.759
  452    H    ALA  60           H        ALA  60  -3.017  -8.536 -11.903
  453    HA   ALA  60           HA       ALA  60  -3.394 -10.794 -13.701
  454    HB1  ALA  60           HB1      ALA  60  -2.371 -11.136 -10.877
  455    HB2  ALA  60           HB2      ALA  60  -1.451 -11.433 -12.352
  456    HB3  ALA  60           HB3      ALA  60  -2.849 -12.438 -11.967
  457    H    SER  61           H        SER  61  -5.018 -12.350 -12.673
  458    HA   SER  61           HA       SER  61  -6.843 -11.051 -10.797
  459    HB2  SER  61           HB3      SER  61  -7.732 -12.262 -13.429
  460    HB3  SER  61           HB2      SER  61  -8.797 -11.632 -12.173
  461    HG   SER  61           HG       SER  61  -6.856  -9.865 -12.973
  462    H    ASN  62           H        ASN  62  -6.216 -13.962 -12.727
  463    HA   ASN  62           HA       ASN  62  -6.371 -15.534 -10.262
  464    HB2  ASN  62           HB3      ASN  62  -7.624 -16.387 -12.890
  465    HB3  ASN  62           HB2      ASN  62  -7.520 -17.375 -11.440
  466   HD21  ASN  62          HD21      ASN  62  -8.791 -16.784  -9.616
  467   HD22  ASN  62          HD22      ASN  62 -10.205 -15.816  -9.806
  468    HA   PRO  63           HA       PRO  63  -2.257 -15.949 -12.247
  469    HB2  PRO  63           HB3      PRO  63  -1.936 -17.360  -9.632
  470    HB3  PRO  63           HB2      PRO  63  -0.852 -16.210 -10.433
  471    HG2  PRO  63           HG3      PRO  63  -2.364 -15.434  -8.388
  472    HG3  PRO  63           HG2      PRO  63  -2.117 -14.370  -9.785
  473    HD2  PRO  63           HD3      PRO  63  -4.517 -15.984  -9.032
  474    HD3  PRO  63           HD2      PRO  63  -4.423 -14.400  -9.835
  475    H    VAL  64           H        VAL  64  -4.210 -18.490 -10.705
  476    HA   VAL  64           HA       VAL  64  -3.157 -20.305 -12.769
  477    HB   VAL  64           HB       VAL  64  -3.527 -22.226 -11.279
  478   HG11  VAL  64          HG11      VAL  64  -1.628 -21.847  -9.782
  479   HG12  VAL  64          HG12      VAL  64  -1.702 -20.123 -10.144
  480   HG13  VAL  64          HG13      VAL  64  -1.313 -21.277 -11.420
  481   HG21  VAL  64          HG21      VAL  64  -4.048 -20.173  -9.139
  482   HG22  VAL  64          HG22      VAL  64  -3.903 -21.915  -8.898
  483   HG23  VAL  64          HG23      VAL  64  -5.247 -21.262  -9.835
  484    H    GLU  65           H        GLU  65  -4.804 -22.346 -12.704
  485    HA   GLU  65           HA       GLU  65  -6.912 -21.617 -14.261
  486    HB2  GLU  65           HB3      GLU  65  -7.871 -23.873 -13.702
  487    HB3  GLU  65           HB2      GLU  65  -6.193 -23.875 -14.221
  488    HG2  GLU  65           HG3      GLU  65  -5.557 -23.921 -11.792
  489    HG3  GLU  65           HG2      GLU  65  -7.259 -24.207 -11.434
  490    H    SER  66           H        SER  66  -7.075 -22.127 -10.738
  491    HA   SER  66           HA       SER  66  -9.499 -20.520 -10.691
  492    HB2  SER  66           HB3      SER  66 -10.219 -22.904 -10.954
  493    HB3  SER  66           HB2      SER  66  -9.408 -23.274  -9.432
  494    HG   SER  66           HG       SER  66 -11.605 -21.514  -9.835
  495    H    GLY  67           H        GLY  67  -7.199 -19.527  -9.850
  496    HA2  GLY  67           HA3      GLY  67  -7.623 -18.523  -7.388
  497    HA3  GLY  67           HA2      GLY  67  -6.818 -20.046  -7.027
  498    H    CYS  68           H        CYS  68  -5.117 -18.828  -6.083
  499    HA   CYS  68           HA       CYS  68  -3.423 -17.330  -7.947
  500    HB2  CYS  68           HB3      CYS  68  -3.342 -17.559  -4.925
  501    HB3  CYS  68           HB2      CYS  68  -2.221 -16.596  -5.889
  502    H    ARG  69           H        ARG  69  -1.047 -17.713  -7.780
  503    HA   ARG  69           HA       ARG  69  -0.518 -20.465  -8.247
  504    HB2  ARG  69           HB3      ARG  69   1.287 -18.049  -8.057
  505    HB3  ARG  69           HB2      ARG  69   1.900 -19.667  -8.381
  506    HG2  ARG  69           HG3      ARG  69   0.694 -19.792 -10.434
  507    HG3  ARG  69           HG2      ARG  69  -0.185 -18.308 -10.075
  508    HD2  ARG  69           HD3      ARG  69   2.791 -18.524 -10.519
  509    HD3  ARG  69           HD2      ARG  69   1.620 -17.945 -11.705
  510    HE   ARG  69           HE       ARG  69   2.266 -16.586  -9.166
  511   HH11  ARG  69          HH11      ARG  69   1.147 -16.499 -12.490
  512   HH12  ARG  69          HH12      ARG  69   1.057 -14.769 -12.540
  513   HH21  ARG  69          HH21      ARG  69   2.138 -14.316  -9.240
  514   HH22  ARG  69          HH22      ARG  69   1.602 -13.524 -10.698
  515    H    GLY  70           H        GLY  70   0.084 -22.007  -6.903
  516    HA2  GLY  70           HA3      GLY  70   1.426 -22.858  -5.117
  517    HA3  GLY  70           HA2      GLY  70   1.361 -21.267  -4.358
  518    H    ILE  71           H        ILE  71  -1.539 -21.055  -4.898
  519    HA   ILE  71           HA       ILE  71  -2.415 -22.122  -2.399
  520    HB   ILE  71           HB       ILE  71  -3.985 -20.768  -4.599
  521   HG12  ILE  71          HG13      ILE  71  -2.207 -19.348  -3.665
  522   HG13  ILE  71          HG12      ILE  71  -3.801 -18.749  -3.225
  523   HG21  ILE  71          HG21      ILE  71  -5.442 -22.063  -3.160
  524   HG22  ILE  71          HG22      ILE  71  -5.676 -20.338  -2.876
  525   HG23  ILE  71          HG23      ILE  71  -4.742 -21.301  -1.731
  526   HD11  ILE  71          HD11      ILE  71  -3.551 -19.764  -1.007
  527   HD12  ILE  71          HD12      ILE  71  -2.285 -18.587  -1.356
  528   HD13  ILE  71          HD13      ILE  71  -1.936 -20.311  -1.455
  529    H    ASP  72           H        ASP  72  -3.633 -23.882  -1.974
  530    HA   ASP  72           HA       ASP  72  -4.056 -25.894  -3.945
  531    HB2  ASP  72           HB3      ASP  72  -5.006 -25.588  -1.096
  532    HB3  ASP  72           HB2      ASP  72  -5.503 -26.942  -2.101
  533    H    SER  73           H        SER  73  -5.373 -25.178  -5.577
  534    HA   SER  73           HA       SER  73  -7.778 -23.753  -5.234
  535    HB2  SER  73           HB3      SER  73  -6.460 -23.978  -7.385
  536    HB3  SER  73           HB2      SER  73  -7.124 -25.607  -7.538
  537    HG   SER  73           HG       SER  73  -8.547 -23.147  -7.496
  538    H    LYS  74           H        LYS  74  -7.001 -27.024  -4.696
  539    HA   LYS  74           HA       LYS  74  -9.519 -28.228  -5.069
  540    HB2  LYS  74           HB3      LYS  74  -7.150 -28.924  -3.349
  541    HB3  LYS  74           HB2      LYS  74  -8.602 -29.907  -3.368
  542    HG2  LYS  74           HG3      LYS  74  -8.297 -30.487  -5.635
  543    HG3  LYS  74           HG2      LYS  74  -7.058 -29.254  -5.859
  544    HD2  LYS  74           HD3      LYS  74  -6.127 -31.537  -5.663
  545    HD3  LYS  74           HD2      LYS  74  -5.552 -30.449  -4.403
  546    HE2  LYS  74           HE3      LYS  74  -7.243 -31.383  -2.872
  547    HE3  LYS  74           HE2      LYS  74  -7.723 -32.516  -4.129
  548    HZ1  LYS  74           HZ1      LYS  74  -6.195 -33.512  -2.538
  549    HZ2  LYS  74           HZ2      LYS  74  -5.024 -32.349  -2.904
  550    HZ3  LYS  74           HZ3      LYS  74  -5.508 -33.461  -4.083
  551    H    HIS  75           H        HIS  75  -8.216 -26.262  -2.514
  552    HA   HIS  75           HA       HIS  75 -10.652 -26.768  -0.927
  553    HB2  HIS  75           HB3      HIS  75  -8.554 -27.620   0.134
  554    HB3  HIS  75           HB2      HIS  75  -7.929 -25.976   0.139
  555    HD1  HIS  75           HD1      HIS  75 -10.284 -28.248   1.920
  556    HD2  HIS  75           HD2      HIS  75  -9.107 -24.262   2.055
  557    HE1  HIS  75           HE1      HIS  75 -11.145 -27.359   4.110
  558    HE2  HIS  75           HE2      HIS  75 -10.235 -25.015   4.255
  559    H    TRP  76           H        TRP  76  -8.532 -24.417  -2.339
  560    HA   TRP  76           HA       TRP  76 -10.216 -22.271  -1.235
  561    HB2  TRP  76           HB3      TRP  76  -7.233 -22.232  -1.746
  562    HB3  TRP  76           HB2      TRP  76  -8.188 -20.801  -1.368
  563    HD1  TRP  76           HD1      TRP  76  -6.208 -23.479   0.236
  564    HE1  TRP  76           HE1      TRP  76  -6.473 -23.374   2.794
  565    HE3  TRP  76           HE3      TRP  76 -10.204 -20.300   0.511
  566    HZ2  TRP  76           HZ2      TRP  76  -8.155 -22.114   4.675
  567    HZ3  TRP  76           HZ3      TRP  76 -11.078 -19.696   2.728
  568    HH2  TRP  76           HH2      TRP  76 -10.073 -20.585   4.766
  569    H    ASN  77           H        ASN  77 -11.139 -20.993  -2.686
  570    HA   ASN  77           HA       ASN  77  -9.987 -20.851  -5.389
  571    HB2  ASN  77           HB3      ASN  77 -12.382 -21.335  -5.394
  572    HB3  ASN  77           HB2      ASN  77 -12.692 -19.954  -4.352
  573   HD21  ASN  77          HD21      ASN  77 -11.806 -20.977  -7.572
  574   HD22  ASN  77          HD22      ASN  77 -12.145 -19.468  -8.350
  575    H    SER  78           H        SER  78  -9.133 -18.941  -6.108
  576    HA   SER  78           HA       SER  78  -8.984 -16.796  -4.102
  577    HB2  SER  78           HB3      SER  78  -6.621 -17.538  -5.794
  578    HB3  SER  78           HB2      SER  78  -6.659 -16.700  -4.244
  579    HG   SER  78           HG       SER  78  -7.462 -18.771  -3.386
  580    H    TYR  79           H        TYR  79  -8.752 -14.714  -4.869
  581    HA   TYR  79           HA       TYR  79  -8.549 -14.292  -7.745
  582    HB2  TYR  79           HB3      TYR  79 -10.989 -14.364  -7.231
  583    HB3  TYR  79           HB2      TYR  79 -10.760 -13.041  -6.087
  584    HD1  TYR  79           HD1      TYR  79 -10.820 -10.799  -6.835
  585    HD2  TYR  79           HD2      TYR  79 -10.418 -13.947  -9.670
  586    HE1  TYR  79           HE1      TYR  79 -11.123  -9.184  -8.666
  587    HE2  TYR  79           HE2      TYR  79 -10.724 -12.343 -11.506
  588    HH   TYR  79           HH       TYR  79 -11.648 -10.167 -11.921
  589    H    CYS  80           H        CYS  80  -7.366 -12.542  -8.239
  590    HA   CYS  80           HA       CYS  80  -6.095 -11.120  -6.074
  591    HB2  CYS  80           HB3      CYS  80  -5.773 -10.817  -9.071
  592    HB3  CYS  80           HB2      CYS  80  -4.722 -10.108  -7.843
  593    H    THR  81           H        THR  81  -7.028  -9.451  -5.153
  594    HA   THR  81           HA       THR  81  -8.744  -7.686  -6.778
  595    HB   THR  81           HB       THR  81  -8.974  -8.227  -3.809
  596    HG1  THR  81           HG1      THR  81  -9.494 -10.008  -5.375
  597   HG21  THR  81          HG21      THR  81 -10.893  -6.892  -5.718
  598   HG22  THR  81          HG22      THR  81  -9.847  -6.042  -4.581
  599   HG23  THR  81          HG23      THR  81 -11.118  -7.108  -3.985
  600    H    THR  82           H        THR  82  -8.136  -5.581  -6.875
  601    HA   THR  82           HA       THR  82  -5.795  -4.767  -5.369
  602    HB   THR  82           HB       THR  82  -7.346  -3.144  -7.393
  603    HG1  THR  82           HG1      THR  82  -6.621  -4.858  -8.552
  604   HG21  THR  82          HG21      THR  82  -5.844  -1.851  -5.955
  605   HG22  THR  82          HG22      THR  82  -5.243  -1.905  -7.613
  606   HG23  THR  82          HG23      THR  82  -4.509  -2.925  -6.375
  607    H    THR  83           H        THR  83  -5.977  -3.835  -3.456
  608    HA   THR  83           HA       THR  83  -8.407  -2.603  -2.540
  609    HB   THR  83           HB       THR  83  -5.660  -2.443  -1.278
  610    HG1  THR  83           HG1      THR  83  -7.648  -4.425  -0.784
  611   HG21  THR  83          HG21      THR  83  -6.904  -2.231   0.813
  612   HG22  THR  83          HG22      THR  83  -8.427  -2.343  -0.067
  613   HG23  THR  83          HG23      THR  83  -7.367  -0.956  -0.314
  614    H    HIS  84           H        HIS  84  -8.790  -0.392  -2.266
  615    HA   HIS  84           HA       HIS  84  -6.822   1.409  -3.525
  616    HB2  HIS  84           HB3      HIS  84  -9.848   1.636  -3.549
  617    HB3  HIS  84           HB2      HIS  84  -8.743   2.860  -4.173
  618    HD1  HIS  84           HD1      HIS  84  -8.026   2.615  -6.558
  619    HD2  HIS  84           HD2      HIS  84  -9.752  -0.861  -5.064
  620    HE1  HIS  84           HE1      HIS  84  -8.262   1.076  -8.527
  621    HE2  HIS  84           HE2      HIS  84  -9.421  -0.967  -7.626
  622    H    THR  85           H        THR  85  -6.271   3.232  -2.428
  623    HA   THR  85           HA       THR  85  -7.581   3.620   0.185
  624    HB   THR  85           HB       THR  85  -5.228   2.749   0.346
  625    HG1  THR  85           HG1      THR  85  -4.849   4.031   2.068
  626   HG21  THR  85          HG21      THR  85  -4.517   5.453  -0.802
  627   HG22  THR  85          HG22      THR  85  -4.281   3.900  -1.601
  628   HG23  THR  85          HG23      THR  85  -3.377   4.282  -0.137
  629    H    PHE  86           H        PHE  86  -6.985   5.979   1.008
  630    HA   PHE  86           HA       PHE  86  -7.620   7.769  -1.243
  631    HB2  PHE  86           HB3      PHE  86  -8.780   7.810   1.555
  632    HB3  PHE  86           HB2      PHE  86  -9.031   9.078   0.356
  633    HD1  PHE  86           HD1      PHE  86 -10.054   5.817   1.511
  634    HD2  PHE  86           HD2      PHE  86 -10.246   8.551  -1.746
  635    HE1  PHE  86           HE1      PHE  86 -11.974   4.575   0.585
  636    HE2  PHE  86           HE2      PHE  86 -12.160   7.320  -2.673
  637    HZ   PHE  86           HZ       PHE  86 -13.026   5.332  -1.515
  638    H    VAL  87           H        VAL  87  -6.295   9.414  -1.510
  639    HA   VAL  87           HA       VAL  87  -4.603  10.248   0.759
  640    HB   VAL  87           HB       VAL  87  -2.870  10.869  -0.933
  641   HG11  VAL  87          HG11      VAL  87  -2.634   8.806   0.289
  642   HG12  VAL  87          HG12      VAL  87  -2.119   8.558  -1.380
  643   HG13  VAL  87          HG13      VAL  87  -3.694   7.974  -0.847
  644   HG21  VAL  87          HG21      VAL  87  -4.337  11.056  -2.885
  645   HG22  VAL  87          HG22      VAL  87  -4.617   9.314  -2.839
  646   HG23  VAL  87          HG23      VAL  87  -3.004   9.940  -3.180
  647    H    LYS  88           H        LYS  88  -4.233  12.451   1.020
  648    HA   LYS  88           HA       LYS  88  -6.231  14.159  -0.170
  649    HB2  LYS  88           HB3      LYS  88  -5.499  15.855   1.416
  650    HB3  LYS  88           HB2      LYS  88  -5.743  14.325   2.241
  651    HG2  LYS  88           HG3      LYS  88  -3.334  13.952   2.276
  652    HG3  LYS  88           HG2      LYS  88  -3.082  15.464   1.412
  653    HD2  LYS  88           HD3      LYS  88  -4.271  16.610   3.313
  654    HD3  LYS  88           HD2      LYS  88  -4.170  15.083   4.191
  655    HE2  LYS  88           HE3      LYS  88  -1.891  16.768   3.172
  656    HE3  LYS  88           HE2      LYS  88  -2.333  16.481   4.854
  657    HZ1  LYS  88           HZ1      LYS  88  -0.443  15.121   4.185
  658    HZ2  LYS  88           HZ2      LYS  88  -1.361  14.417   2.954
  659    HZ3  LYS  88           HZ3      LYS  88  -1.776  14.144   4.567
  660    H    ALA  89           H        ALA  89  -5.938  15.090  -2.030
  661    HA   ALA  89           HA       ALA  89  -3.266  16.115  -2.736
  662    HB1  ALA  89           HB1      ALA  89  -3.701  14.045  -3.988
  663    HB2  ALA  89           HB2      ALA  89  -3.624  15.448  -5.054
  664    HB3  ALA  89           HB3      ALA  89  -5.187  14.751  -4.625
  665    H    LEU  90           H        LEU  90  -3.292  17.918  -4.214
  666    HA   LEU  90           HA       LEU  90  -5.552  19.661  -3.774
  667    HB2  LEU  90           HB3      LEU  90  -3.169  20.447  -3.663
  668    HB3  LEU  90           HB2      LEU  90  -3.046  20.159  -5.392
  669    HG   LEU  90           HG       LEU  90  -4.878  21.840  -5.733
  670   HD11  LEU  90          HD11      LEU  90  -5.326  23.398  -3.880
  671   HD12  LEU  90          HD12      LEU  90  -4.418  22.342  -2.797
  672   HD13  LEU  90          HD13      LEU  90  -5.907  21.766  -3.547
  673   HD21  LEU  90          HD21      LEU  90  -3.437  23.779  -5.364
  674   HD22  LEU  90          HD22      LEU  90  -2.528  22.425  -6.038
  675   HD23  LEU  90          HD23      LEU  90  -2.394  22.811  -4.323
  676    H    THR  91           H        THR  91  -7.267  19.352  -4.993
  677    HA   THR  91           HA       THR  91  -6.893  18.695  -7.843
  678    HB   THR  91           HB       THR  91  -9.107  17.556  -7.706
  679    HG1  THR  91           HG1      THR  91  -9.063  18.689  -5.235
  680   HG21  THR  91          HG21      THR  91  -7.020  16.521  -5.782
  681   HG22  THR  91          HG22      THR  91  -7.050  16.246  -7.521
  682   HG23  THR  91          HG23      THR  91  -8.317  15.566  -6.502
  683    H    THR  92           H        THR  92  -8.315  19.690  -9.336
  684    HA   THR  92           HA       THR  92  -9.530  22.121  -8.237
  685    HB   THR  92           HB       THR  92  -7.752  22.586  -9.834
  686    HG1  THR  92           HG1      THR  92  -9.194  23.719 -11.451
  687   HG21  THR  92          HG21      THR  92  -7.878  20.543 -11.178
  688   HG22  THR  92          HG22      THR  92  -7.946  21.985 -12.191
  689   HG23  THR  92          HG23      THR  92  -9.420  21.076 -11.847
  690    H    ASP  93           H        ASP  93 -11.602  22.125  -8.032
  691    HA   ASP  93           HA       ASP  93 -13.316  20.409  -9.638
  692    HB2  ASP  93           HB3      ASP  93 -13.794  20.685  -7.227
  693    HB3  ASP  93           HB2      ASP  93 -13.999  22.417  -7.466
  694    H    GLU  94           H        GLU  94 -13.084  21.228 -11.660
  695    HA   GLU  94           HA       GLU  94 -13.453  22.520 -13.472
  696    HB2  GLU  94           HB3      GLU  94 -15.201  24.101 -11.588
  697    HB3  GLU  94           HB2      GLU  94 -15.056  24.448 -13.307
  698    HG2  GLU  94           HG3      GLU  94 -16.131  21.947 -12.034
  699    HG3  GLU  94           HG2      GLU  94 -17.034  23.163 -12.931
  700    H    LYS  95           H        LYS  95 -13.352  25.010 -10.894
  701    HA   LYS  95           HA       LYS  95 -10.761  25.867 -11.974
  702    HB2  LYS  95           HB3      LYS  95 -13.127  27.675 -11.471
  703    HB3  LYS  95           HB2      LYS  95 -11.490  28.254 -11.728
  704    HG2  LYS  95           HG3      LYS  95 -11.486  27.248 -13.956
  705    HG3  LYS  95           HG2      LYS  95 -13.132  26.672 -13.691
  706    HD2  LYS  95           HD3      LYS  95 -13.891  28.984 -13.430
  707    HD3  LYS  95           HD2      LYS  95 -12.249  29.555 -13.724
  708    HE2  LYS  95           HE3      LYS  95 -13.939  27.970 -15.652
  709    HE3  LYS  95           HE2      LYS  95 -13.656  29.708 -15.730
  710    HZ1  LYS  95           HZ1      LYS  95 -11.575  27.600 -15.972
  711    HZ2  LYS  95           HZ2      LYS  95 -11.296  29.267 -16.038
  712    HZ3  LYS  95           HZ3      LYS  95 -12.211  28.514 -17.245
  713    H    GLN  96           H        GLN  96 -12.316  24.784  -9.348
  714    HA   GLN  96           HA       GLN  96 -11.025  26.634  -7.463
  715    HB2  GLN  96           HB3      GLN  96 -13.445  26.226  -7.143
  716    HB3  GLN  96           HB2      GLN  96 -13.120  24.511  -6.944
  717    HG2  GLN  96           HG3      GLN  96 -13.460  25.569  -4.800
  718    HG3  GLN  96           HG2      GLN  96 -11.800  24.991  -4.945
  719   HE21  GLN  96          HE21      GLN  96 -11.025  26.415  -3.395
  720   HE22  GLN  96          HE22      GLN  96 -10.881  28.110  -3.683
  721    H    ALA  97           H        ALA  97  -9.008  26.019  -7.001
  722    HA   ALA  97           HA       ALA  97  -8.247  23.233  -6.919
  723    HB1  ALA  97           HB1      ALA  97  -6.017  24.049  -6.375
  724    HB2  ALA  97           HB2      ALA  97  -6.650  25.684  -6.185
  725    HB3  ALA  97           HB3      ALA  97  -6.675  24.906  -7.769
  726    H    ALA  98           H        ALA  98  -8.862  22.046  -5.241
  727    HA   ALA  98           HA       ALA  98  -8.502  23.131  -2.540
  728    HB1  ALA  98           HB1      ALA  98 -10.863  23.371  -3.104
  729    HB2  ALA  98           HB2      ALA  98 -10.638  22.157  -1.844
  730    HB3  ALA  98           HB3      ALA  98 -10.948  21.657  -3.507
  731    H    TRP  99           H        TRP  99  -8.099  21.577  -0.935
  732    HA   TRP  99           HA       TRP  99  -6.787  19.195  -1.862
  733    HB2  TRP  99           HB3      TRP  99  -7.352  20.223   0.929
  734    HB3  TRP  99           HB2      TRP  99  -6.390  18.795   0.576
  735    HD1  TRP  99           HD1      TRP  99  -6.287  22.621   0.213
  736    HE1  TRP  99           HE1      TRP  99  -3.826  23.348  -0.053
  737    HE3  TRP  99           HE3      TRP  99  -4.129  18.007  -0.143
  738    HZ2  TRP  99           HZ2      TRP  99  -1.310  22.113  -0.378
  739    HZ3  TRP  99           HZ3      TRP  99  -1.689  17.866  -0.431
  740    HH2  TRP  99           HH2      TRP  99  -0.311  19.876  -0.545
  741    H    ARG 100           H        ARG 100  -7.791  17.355  -2.282
  742    HA   ARG 100           HA       ARG 100 -10.154  16.642  -0.675
  743    HB2  ARG 100           HB3      ARG 100  -9.802  16.224  -3.650
  744    HB3  ARG 100           HB2      ARG 100 -11.145  15.612  -2.698
  745    HG2  ARG 100           HG3      ARG 100 -11.707  17.969  -2.121
  746    HG3  ARG 100           HG2      ARG 100 -10.474  18.486  -3.267
  747    HD2  ARG 100           HD3      ARG 100 -12.644  18.525  -4.331
  748    HD3  ARG 100           HD2      ARG 100 -11.651  17.256  -5.047
  749    HE   ARG 100           HE       ARG 100 -12.925  15.742  -3.399
  750   HH11  ARG 100          HH11      ARG 100 -14.259  18.534  -5.049
  751   HH12  ARG 100          HH12      ARG 100 -15.888  17.949  -4.996
  752   HH21  ARG 100          HH21      ARG 100 -15.071  14.972  -3.310
  753   HH22  ARG 100          HH22      ARG 100 -16.356  15.937  -3.979
  754    H    PHE 101           H        PHE 101 -10.610  14.302  -0.707
  755    HA   PHE 101           HA       PHE 101  -8.096  12.801  -0.635
  756    HB2  PHE 101           HB3      PHE 101 -10.819  12.182   0.550
  757    HB3  PHE 101           HB2      PHE 101  -9.435  11.103   0.642
  758    HD1  PHE 101           HD1      PHE 101  -7.635  11.517   2.161
  759    HD2  PHE 101           HD2      PHE 101 -10.838  14.298   1.788
  760    HE1  PHE 101           HE1      PHE 101  -6.891  12.647   4.216
  761    HE2  PHE 101           HE2      PHE 101 -10.098  15.430   3.842
  762    HZ   PHE 101           HZ       PHE 101  -8.123  14.604   5.057
  763    H    ILE 102           H        ILE 102  -7.622  11.706  -2.405
  764    HA   ILE 102           HA       ILE 102  -9.840  10.660  -4.044
  765    HB   ILE 102           HB       ILE 102  -8.206  10.717  -5.952
  766   HG12  ILE 102          HG13      ILE 102  -6.595  12.438  -4.058
  767   HG13  ILE 102          HG12      ILE 102  -6.146  10.822  -4.584
  768   HG21  ILE 102          HG21      ILE 102  -8.919  13.334  -4.639
  769   HG22  ILE 102          HG22      ILE 102  -9.921  12.400  -5.753
  770   HG23  ILE 102          HG23      ILE 102  -8.428  13.143  -6.323
  771   HD11  ILE 102          HD11      ILE 102  -6.430  13.246  -6.343
  772   HD12  ILE 102          HD12      ILE 102  -6.005  11.624  -6.890
  773   HD13  ILE 102          HD13      ILE 102  -4.920  12.505  -5.812
  774    H    ARG 103           H        ARG 103  -9.577   8.620  -5.028
  775    HA   ARG 103           HA       ARG 103  -8.111   6.844  -3.255
  776    HB2  ARG 103           HB3      ARG 103  -9.463   5.060  -4.155
  777    HB3  ARG 103           HB2      ARG 103 -10.503   6.418  -3.752
  778    HG2  ARG 103           HG3      ARG 103 -10.362   7.054  -6.208
  779    HG3  ARG 103           HG2      ARG 103  -9.666   5.454  -6.462
  780    HD2  ARG 103           HD3      ARG 103 -12.019   5.297  -6.862
  781    HD3  ARG 103           HD2      ARG 103 -11.677   4.485  -5.330
  782    HE   ARG 103           HE       ARG 103 -12.451   7.267  -5.106
  783   HH11  ARG 103          HH11      ARG 103 -13.519   3.926  -5.069
  784   HH12  ARG 103          HH12      ARG 103 -15.019   4.289  -4.274
  785   HH21  ARG 103          HH21      ARG 103 -14.423   7.735  -4.059
  786   HH22  ARG 103          HH22      ARG 103 -15.528   6.441  -3.690
  787    H    ILE 104           H        ILE 104  -6.469   5.581  -3.787
  788    HA   ILE 104           HA       ILE 104  -5.665   5.389  -6.607
  789    HB   ILE 104           HB       ILE 104  -3.279   5.424  -5.869
  790   HG12  ILE 104          HG13      ILE 104  -4.423   6.465  -3.269
  791   HG13  ILE 104          HG12      ILE 104  -3.694   4.880  -3.488
  792   HG21  ILE 104          HG21      ILE 104  -3.131   7.855  -5.631
  793   HG22  ILE 104          HG22      ILE 104  -4.857   7.924  -5.284
  794   HG23  ILE 104          HG23      ILE 104  -4.297   7.393  -6.870
  795   HD11  ILE 104          HD11      ILE 104  -2.161   6.445  -2.438
  796   HD12  ILE 104          HD12      ILE 104  -2.294   7.517  -3.831
  797   HD13  ILE 104          HD13      ILE 104  -1.564   5.922  -4.014
  798    H    ASP 105           H        ASP 105  -4.589   3.473  -7.175
  799    HA   ASP 105           HA       ASP 105  -5.417   1.122  -5.836
  800    HB2  ASP 105           HB3      ASP 105  -3.347   1.583  -8.005
  801    HB3  ASP 105           HB2      ASP 105  -3.797  -0.019  -7.423
  802    H    THR 106           H        THR 106  -4.552   0.142  -4.128
  803    HA   THR 106           HA       THR 106  -2.080   1.281  -3.054
  804    HB   THR 106           HB       THR 106  -3.936  -0.550  -1.554
  805    HG1  THR 106           HG1      THR 106  -4.490   1.901  -2.598
  806   HG21  THR 106          HG21      THR 106  -2.214   1.780  -0.686
  807   HG22  THR 106          HG22      THR 106  -1.783   0.077  -0.519
  808   HG23  THR 106          HG23      THR 106  -3.159   0.731   0.370
  809    H    ALA 107           H        ALA 107  -3.624  -1.914  -3.414
  810    HA   ALA 107           HA       ALA 107  -1.184  -3.179  -4.159
  811    HB1  ALA 107           HB1      ALA 107  -0.734  -2.963  -1.764
  812    HB2  ALA 107           HB2      ALA 107  -0.957  -4.653  -2.215
  813    HB3  ALA 107           HB3      ALA 107  -2.254  -3.778  -1.400
  814    H    CYS 108           H        CYS 108  -1.509  -5.458  -4.629
  815    HA   CYS 108           HA       CYS 108  -4.352  -6.087  -5.022
  816    HB2  CYS 108           HB3      CYS 108  -3.013  -6.015  -7.096
  817    HB3  CYS 108           HB2      CYS 108  -1.926  -7.238  -6.432
  818    H    VAL 109           H        VAL 109  -5.207  -7.511  -3.696
  819    HA   VAL 109           HA       VAL 109  -3.407  -9.312  -2.227
  820    HB   VAL 109           HB       VAL 109  -5.151  -9.484  -0.528
  821   HG11  VAL 109          HG11      VAL 109  -3.550  -7.680  -0.298
  822   HG12  VAL 109          HG12      VAL 109  -5.130  -7.167   0.291
  823   HG13  VAL 109          HG13      VAL 109  -4.561  -6.628  -1.289
  824   HG21  VAL 109          HG21      VAL 109  -6.742  -7.572  -2.240
  825   HG22  VAL 109          HG22      VAL 109  -7.188  -8.142  -0.630
  826   HG23  VAL 109          HG23      VAL 109  -7.113  -9.277  -1.979
  827    H    CYS 110           H        CYS 110  -3.967 -11.499  -1.976
  828    HA   CYS 110           HA       CYS 110  -5.726 -12.532  -4.075
  829    HB2  CYS 110           HB3      CYS 110  -3.483 -13.486  -4.039
  830    HB3  CYS 110           HB2      CYS 110  -3.660 -13.920  -2.347
  831    H    VAL 111           H        VAL 111  -7.777 -12.526  -3.349
  832    HA   VAL 111           HA       VAL 111  -8.372 -13.030  -0.583
  833    HB   VAL 111           HB       VAL 111 -10.719 -12.802  -1.179
  834   HG11  VAL 111          HG11      VAL 111 -10.684 -10.524  -2.087
  835   HG12  VAL 111          HG12      VAL 111  -8.998 -10.744  -2.555
  836   HG13  VAL 111          HG13      VAL 111  -9.451 -10.762  -0.849
  837   HG21  VAL 111          HG21      VAL 111  -9.816 -12.656  -4.049
  838   HG22  VAL 111          HG22      VAL 111 -11.461 -12.421  -3.459
  839   HG23  VAL 111          HG23      VAL 111 -10.686 -13.999  -3.311
  840    H    LEU 112           H        LEU 112  -9.057 -14.886   0.349
  841    HA   LEU 112           HA       LEU 112  -9.103 -17.256  -1.386
  842    HB2  LEU 112           HB3      LEU 112  -8.544 -17.029   1.578
  843    HB3  LEU 112           HB2      LEU 112  -8.611 -18.541   0.686
  844    HG   LEU 112           HG       LEU 112  -6.582 -16.336   0.253
  845   HD11  LEU 112          HD11      LEU 112  -6.241 -17.500   2.357
  846   HD12  LEU 112          HD12      LEU 112  -4.999 -17.955   1.192
  847   HD13  LEU 112          HD13      LEU 112  -6.332 -19.056   1.531
  848   HD21  LEU 112          HD21      LEU 112  -7.042 -17.524  -1.814
  849   HD22  LEU 112          HD22      LEU 112  -6.829 -19.071  -0.994
  850   HD23  LEU 112          HD23      LEU 112  -5.460 -17.979  -1.187
  851    H    SER 113           H        SER 113 -10.832 -18.541  -1.442
  852    HA   SER 113           HA       SER 113 -12.900 -18.220   0.616
  853    HB2  SER 113           HB3      SER 113 -14.613 -18.549  -1.212
  854    HB3  SER 113           HB2      SER 113 -13.759 -17.007  -1.279
  855    HG   SER 113           HG       SER 113 -12.316 -18.116  -2.822
  856    H    ARG 114           H        ARG 114 -14.062 -20.134   1.076
  857    HA   ARG 114           HA       ARG 114 -12.450 -22.493   0.730
  858    HB2  ARG 114           HB3      ARG 114 -13.653 -21.852   2.846
  859    HB3  ARG 114           HB2      ARG 114 -15.164 -22.243   2.039
  860    HG2  ARG 114           HG3      ARG 114 -14.438 -24.562   1.790
  861    HG3  ARG 114           HG2      ARG 114 -12.908 -24.169   2.576
  862    HD2  ARG 114           HD3      ARG 114 -15.637 -23.889   3.833
  863    HD3  ARG 114           HD2      ARG 114 -14.516 -25.217   4.122
  864    HE   ARG 114           HE       ARG 114 -12.962 -23.322   4.902
  865   HH11  ARG 114          HH11      ARG 114 -16.443 -23.355   5.319
  866   HH12  ARG 114          HH12      ARG 114 -16.399 -22.396   6.764
  867   HH21  ARG 114          HH21      ARG 114 -12.915 -22.067   6.811
  868   HH22  ARG 114          HH22      ARG 114 -14.403 -21.669   7.611
  869    H    LYS 115           H        LYS 115 -14.378 -21.075  -1.348
  870    HA   LYS 115           HA       LYS 115 -15.282 -21.679  -3.328
  871    HB2  LYS 115           HB3      LYS 115 -14.649 -24.537  -2.553
  872    HB3  LYS 115           HB2      LYS 115 -15.142 -23.995  -4.149
  873    HG2  LYS 115           HG3      LYS 115 -13.059 -22.464  -3.999
  874    HG3  LYS 115           HG2      LYS 115 -12.558 -23.570  -2.717
  875    HD2  LYS 115           HD3      LYS 115 -13.258 -24.350  -5.541
  876    HD3  LYS 115           HD2      LYS 115 -11.630 -24.238  -4.874
  877    HE2  LYS 115           HE3      LYS 115 -12.157 -25.998  -3.274
  878    HE3  LYS 115           HE2      LYS 115 -13.797 -26.095  -3.916
  879    HZ1  LYS 115           HZ1      LYS 115 -11.346 -26.607  -5.507
  880    HZ2  LYS 115           HZ2      LYS 115 -12.947 -26.840  -6.004
  881    HZ3  LYS 115           HZ3      LYS 115 -12.289 -27.817  -4.795
  882    H    ALA 116           H        ALA 116 -16.223 -24.050  -0.844
  883    HA   ALA 116           HA       ALA 116 -18.960 -24.101  -1.666
  884    HB1  ALA 116           HB1      ALA 116 -17.732 -24.916   0.969
  885    HB2  ALA 116           HB2      ALA 116 -17.938 -25.961  -0.436
  886    HB3  ALA 116           HB3      ALA 116 -19.352 -25.327   0.407
  887    H    THR 117           H        THR 117 -17.033 -22.210   0.517
  888    HA   THR 117           HA       THR 117 -19.351 -20.478   1.011
  889    HB   THR 117           HB       THR 117 -18.285 -19.913   3.227
  890    HG1  THR 117           HG1      THR 117 -16.260 -20.716   3.166
  891   HG21  THR 117          HG21      THR 117 -19.199 -22.767   2.861
  892   HG22  THR 117          HG22      THR 117 -20.250 -21.367   3.075
  893   HG23  THR 117          HG23      THR 117 -19.178 -21.874   4.380
  894    H    ARG 118           H        ARG 118 -18.873 -18.254   1.238
  895    HA   ARG 118           HA       ARG 118 -16.216 -17.275   0.882
  896    HB2  ARG 118           HB3      ARG 118 -16.421 -16.204  -1.225
  897    HB3  ARG 118           HB2      ARG 118 -16.933 -17.857  -1.479
  898    HG2  ARG 118           HG3      ARG 118 -18.841 -15.562  -1.093
  899    HG3  ARG 118           HG2      ARG 118 -18.261 -16.099  -2.665
  900    HD2  ARG 118           HD3      ARG 118 -20.293 -17.192  -2.488
  901    HD3  ARG 118           HD2      ARG 118 -19.165 -18.421  -1.921
  902    HE   ARG 118           HE       ARG 118 -20.093 -16.888   0.263
  903   HH11  ARG 118          HH11      ARG 118 -21.149 -19.335  -2.010
  904   HH12  ARG 118          HH12      ARG 118 -22.356 -19.986  -0.950
  905   HH21  ARG 118          HH21      ARG 118 -21.678 -17.757   1.674
  906   HH22  ARG 118          HH22      ARG 118 -22.657 -19.090   1.145
  907    H1   SER   1           H1       SER   1 -27.207  -0.023   4.484
  908    H2   SER   1           H2       SER   1 -28.150  -1.147   3.647
  909    H3   SER   1           H3       SER   1 -27.961   0.418   3.038
  910    HA   SER   1           HA       SER   1 -25.628   0.048   2.685
  911    HB2  SER   1           HB3      SER   1 -24.896  -2.417   2.924
  912    HB3  SER   1           HB2      SER   1 -25.042  -1.463   4.399
  913    HG   SER   1           HG       SER   1 -26.149  -3.723   4.043
  914    H    SER   2           H        SER   2 -27.294   0.543   0.872
  915    HA   SER   2           HA       SER   2 -28.340  -1.581  -0.674
  916    HB2  SER   2           HB3      SER   2 -28.518   0.273  -2.452
  917    HB3  SER   2           HB2      SER   2 -29.388   0.519  -0.937
  918    HG   SER   2           HG       SER   2 -27.809   2.217  -1.951
  919    H    THR   3           H        THR   3 -25.469   0.462  -1.086
  920    HA   THR   3           HA       THR   3 -24.506  -1.228  -3.239
  921    HB   THR   3           HB       THR   3 -22.475   0.322  -3.072
  922    HG1  THR   3           HG1      THR   3 -23.346   1.003  -0.840
  923   HG21  THR   3          HG21      THR   3 -25.183   1.516  -3.669
  924   HG22  THR   3          HG22      THR   3 -24.183   0.593  -4.790
  925   HG23  THR   3          HG23      THR   3 -23.637   2.167  -4.209
  926    H    HIS   4           H        HIS   4 -23.804  -3.175  -2.573
  927    HA   HIS   4           HA       HIS   4 -21.724  -3.197  -0.521
  928    HB2  HIS   4           HB3      HIS   4 -22.688  -5.379   0.356
  929    HB3  HIS   4           HB2      HIS   4 -23.560  -3.914   0.774
  930    HD1  HIS   4           HD1      HIS   4 -25.983  -3.777   0.106
  931    HD2  HIS   4           HD2      HIS   4 -24.026  -7.029  -1.593
  932    HE1  HIS   4           HE1      HIS   4 -27.784  -5.187  -0.930
  933    HE2  HIS   4           HE2      HIS   4 -26.594  -7.217  -1.823
  934    HA   PRO   5           HA       PRO   5 -20.247  -5.652  -4.061
  935    HB2  PRO   5           HB3      PRO   5 -17.834  -4.527  -4.277
  936    HB3  PRO   5           HB2      PRO   5 -19.277  -3.708  -4.892
  937    HG2  PRO   5           HG3      PRO   5 -17.748  -3.225  -2.371
  938    HG3  PRO   5           HG2      PRO   5 -18.491  -2.049  -3.467
  939    HD2  PRO   5           HD3      PRO   5 -19.607  -2.948  -1.086
  940    HD3  PRO   5           HD2      PRO   5 -20.509  -2.191  -2.412
  941    H    VAL   6           H        VAL   6 -20.391  -6.595  -1.414
  942    HA   VAL   6           HA       VAL   6 -19.471  -8.073   0.050
  943    HB   VAL   6           HB       VAL   6 -17.369  -8.641  -2.039
  944   HG11  VAL   6          HG11      VAL   6 -17.487 -10.922  -1.146
  945   HG12  VAL   6          HG12      VAL   6 -18.682 -10.389   0.036
  946   HG13  VAL   6          HG13      VAL   6 -17.039  -9.750   0.094
  947   HG21  VAL   6          HG21      VAL   6 -19.532  -8.626  -3.158
  948   HG22  VAL   6          HG22      VAL   6 -20.178  -9.733  -1.945
  949   HG23  VAL   6          HG23      VAL   6 -18.897 -10.267  -3.035
  950    H    PHE   7           H        PHE   7 -18.697  -5.384   0.259
  951    HA   PHE   7           HA       PHE   7 -17.158  -3.935   1.095
  952    HB2  PHE   7           HB3      PHE   7 -17.314  -5.601   2.975
  953    HB3  PHE   7           HB2      PHE   7 -15.906  -6.415   2.307
  954    HD1  PHE   7           HD1      PHE   7 -13.827  -5.863   3.139
  955    HD2  PHE   7           HD2      PHE   7 -16.991  -3.030   3.432
  956    HE1  PHE   7           HE1      PHE   7 -12.364  -4.368   4.432
  957    HE2  PHE   7           HE2      PHE   7 -15.534  -1.529   4.726
  958    HZ   PHE   7           HZ       PHE   7 -13.217  -2.193   5.227
  959    H    HIS   8           H        HIS   8 -16.703  -4.369  -1.441
  960    HA   HIS   8           HA       HIS   8 -15.225  -4.426  -3.162
  961    HB2  HIS   8           HB3      HIS   8 -14.222  -2.596  -1.698
  962    HB3  HIS   8           HB2      HIS   8 -13.098  -3.811  -1.101
  963    HD1  HIS   8           HD1      HIS   8 -14.025  -1.986  -4.270
  964    HD2  HIS   8           HD2      HIS   8 -10.944  -4.320  -2.742
  965    HE1  HIS   8           HE1      HIS   8 -12.168  -1.838  -5.954
  966    HE2  HIS   8           HE2      HIS   8 -10.270  -3.163  -4.953
  967    H    MET   9           H        MET   9 -15.902  -6.829  -2.381
  968    HA   MET   9           HA       MET   9 -15.377  -9.025  -2.588
  969    HB2  MET   9           HB3      MET   9 -13.717  -8.325  -4.309
  970    HB3  MET   9           HB2      MET   9 -12.514  -8.171  -3.039
  971    HG2  MET   9           HG3      MET   9 -12.229 -10.266  -4.187
  972    HG3  MET   9           HG2      MET   9 -12.753 -10.559  -2.532
  973    HE1  MET   9           HE1      MET   9 -14.865  -9.426  -5.677
  974    HE2  MET   9           HE2      MET   9 -15.460 -10.985  -6.248
  975    HE3  MET   9           HE3      MET   9 -13.737 -10.617  -6.320
  976    H    GLY  10           H        GLY  10 -13.212  -7.079  -0.607
  977    HA2  GLY  10           HA3      GLY  10 -13.654  -7.616   1.829
  978    HA3  GLY  10           HA2      GLY  10 -13.228  -9.261   1.382
  979    H    GLU  11           H        GLU  11 -11.785  -8.461   3.338
  980    HA   GLU  11           HA       GLU  11  -9.273  -7.433   2.206
  981    HB2  GLU  11           HB3      GLU  11  -8.575  -6.984   4.502
  982    HB3  GLU  11           HB2      GLU  11 -10.116  -6.207   4.168
  983    HG2  GLU  11           HG3      GLU  11  -9.851  -8.831   5.613
  984    HG3  GLU  11           HG2      GLU  11  -9.916  -7.269   6.424
  985    H    PHE  12           H        PHE  12 -10.322 -10.096   1.793
  986    HA   PHE  12           HA       PHE  12  -8.994 -11.974   3.462
  987    HB2  PHE  12           HB3      PHE  12 -10.046 -12.277   0.638
  988    HB3  PHE  12           HB2      PHE  12  -9.509 -13.606   1.659
  989    HD1  PHE  12           HD1      PHE  12 -12.151 -11.171   1.029
  990    HD2  PHE  12           HD2      PHE  12 -10.837 -14.348   3.535
  991    HE1  PHE  12           HE1      PHE  12 -14.423 -11.383   1.947
  992    HE2  PHE  12           HE2      PHE  12 -13.106 -14.564   4.456
  993    HZ   PHE  12           HZ       PHE  12 -14.904 -13.081   3.662
  994    H    SER  13           H        SER  13  -6.950 -12.637   3.436
  995    HA   SER  13           HA       SER  13  -5.359 -12.462   1.025
  996    HB2  SER  13           HB3      SER  13  -5.110 -10.218   2.085
  997    HB3  SER  13           HB2      SER  13  -4.519 -10.996   3.547
  998    HG   SER  13           HG       SER  13  -2.886 -10.197   2.020
  999    H    VAL  14           H        VAL  14  -3.259 -13.526   1.314
 1000    HA   VAL  14           HA       VAL  14  -3.506 -15.913   2.879
 1001    HB   VAL  14           HB       VAL  14  -1.247 -16.461   1.970
 1002   HG11  VAL  14          HG11      VAL  14  -3.330 -15.571  -0.019
 1003   HG12  VAL  14          HG12      VAL  14  -3.205 -17.155   0.747
 1004   HG13  VAL  14          HG13      VAL  14  -1.968 -16.625  -0.393
 1005   HG21  VAL  14          HG21      VAL  14  -0.227 -15.030   0.305
 1006   HG22  VAL  14          HG22      VAL  14  -0.407 -14.145   1.822
 1007   HG23  VAL  14          HG23      VAL  14  -1.522 -13.848   0.489
 1008    H    CYS  15           H        CYS  15  -2.191 -12.820   3.376
 1009    HA   CYS  15           HA       CYS  15  -0.921 -13.747   5.863
 1010    HB2  CYS  15           HB3      CYS  15  -0.083 -11.488   4.032
 1011    HB3  CYS  15           HB2      CYS  15   0.523 -11.678   5.678
 1012    H    ASP  16           H        ASP  16  -1.854 -12.999   7.640
 1013    HA   ASP  16           HA       ASP  16  -4.178 -11.460   7.630
 1014    HB2  ASP  16           HB3      ASP  16  -2.231 -11.888   9.921
 1015    HB3  ASP  16           HB2      ASP  16  -3.887 -11.307  10.083
 1016    H    SER  17           H        SER  17  -4.424  -9.405   7.157
 1017    HA   SER  17           HA       SER  17  -2.290  -7.518   7.895
 1018    HB2  SER  17           HB3      SER  17  -4.019  -7.414   5.409
 1019    HB3  SER  17           HB2      SER  17  -2.727  -6.287   5.834
 1020    HG   SER  17           HG       SER  17  -2.344  -9.079   5.452
 1021    H    VAL  18           H        VAL  18  -2.925  -5.798   9.046
 1022    HA   VAL  18           HA       VAL  18  -5.821  -5.363   9.316
 1023    HB   VAL  18           HB       VAL  18  -4.824  -6.127  11.396
 1024   HG11  VAL  18          HG11      VAL  18  -3.165  -4.763  12.599
 1025   HG12  VAL  18          HG12      VAL  18  -3.004  -3.737  11.173
 1026   HG13  VAL  18          HG13      VAL  18  -2.537  -5.435  11.094
 1027   HG21  VAL  18          HG21      VAL  18  -6.668  -4.583  11.573
 1028   HG22  VAL  18          HG22      VAL  18  -5.568  -3.208  11.461
 1029   HG23  VAL  18          HG23      VAL  18  -5.509  -4.273  12.865
 1030    H    SER  19           H        SER  19  -6.491  -3.610   8.276
 1031    HA   SER  19           HA       SER  19  -4.661  -1.411   7.758
 1032    HB2  SER  19           HB3      SER  19  -7.547  -1.805   6.901
 1033    HB3  SER  19           HB2      SER  19  -6.471  -0.514   6.345
 1034    HG   SER  19           HG       SER  19  -5.115  -2.130   5.446
 1035    H    VAL  20           H        VAL  20  -4.464   0.187   9.158
 1036    HA   VAL  20           HA       VAL  20  -6.780   0.869  10.853
 1037    HB   VAL  20           HB       VAL  20  -3.849   1.180  11.520
 1038   HG11  VAL  20          HG11      VAL  20  -5.157   2.881  12.594
 1039   HG12  VAL  20          HG12      VAL  20  -4.670   1.683  13.793
 1040   HG13  VAL  20          HG13      VAL  20  -6.317   1.682  13.165
 1041   HG21  VAL  20          HG21      VAL  20  -4.475  -1.162  11.501
 1042   HG22  VAL  20          HG22      VAL  20  -5.857  -0.821  12.542
 1043   HG23  VAL  20          HG23      VAL  20  -4.217  -0.610  13.156
 1044    H    TRP  21           H        TRP  21  -7.393   2.975  10.914
 1045    HA   TRP  21           HA       TRP  21  -5.842   4.860   9.283
 1046    HB2  TRP  21           HB3      TRP  21  -8.726   4.922  10.205
 1047    HB3  TRP  21           HB2      TRP  21  -7.938   6.267   9.385
 1048    HD1  TRP  21           HD1      TRP  21  -9.146   2.668   8.738
 1049    HE1  TRP  21           HE1      TRP  21  -9.411   2.337   6.198
 1050    HE3  TRP  21           HE3      TRP  21  -7.180   7.115   7.124
 1051    HZ2  TRP  21           HZ2      TRP  21  -8.865   3.772   3.830
 1052    HZ3  TRP  21           HZ3      TRP  21  -7.092   7.554   4.701
 1053    HH2  TRP  21           HH2      TRP  21  -7.916   5.915   3.092
 1054    H    VAL  22           H        VAL  22  -4.315   5.595  10.620
 1055    HA   VAL  22           HA       VAL  22  -4.997   6.308  13.370
 1056    HB   VAL  22           HB       VAL  22  -2.283   6.375  12.047
 1057   HG11  VAL  22          HG11      VAL  22  -3.105   6.302  14.945
 1058   HG12  VAL  22          HG12      VAL  22  -2.415   7.678  14.084
 1059   HG13  VAL  22          HG13      VAL  22  -1.447   6.229  14.350
 1060   HG21  VAL  22          HG21      VAL  22  -1.886   4.184  13.097
 1061   HG22  VAL  22          HG22      VAL  22  -3.153   4.125  11.875
 1062   HG23  VAL  22          HG23      VAL  22  -3.579   4.130  13.586
 1063    H    GLY  23           H        GLY  23  -5.803   8.310  13.595
 1064    HA2  GLY  23           HA3      GLY  23  -4.740  10.452  11.878
 1065    HA3  GLY  23           HA2      GLY  23  -6.259  10.513  12.772
 1066    H    ASP  24           H        ASP  24  -3.743   9.187  14.583
 1067    HA   ASP  24           HA       ASP  24  -3.073  11.785  15.781
 1068    HB2  ASP  24           HB3      ASP  24  -3.953   9.304  17.277
 1069    HB3  ASP  24           HB2      ASP  24  -3.205  10.701  18.046
 1070    H    LYS  25           H        LYS  25  -1.608   9.975  13.978
 1071    HA   LYS  25           HA       LYS  25   0.443   8.730  15.549
 1072    HB2  LYS  25           HB3      LYS  25  -0.218   8.004  13.227
 1073    HB3  LYS  25           HB2      LYS  25   0.524   9.474  12.615
 1074    HG2  LYS  25           HG3      LYS  25   2.687   8.770  13.390
 1075    HG3  LYS  25           HG2      LYS  25   1.987   7.348  14.169
 1076    HD2  LYS  25           HD3      LYS  25   1.238   6.560  11.935
 1077    HD3  LYS  25           HD2      LYS  25   2.063   7.938  11.209
 1078    HE2  LYS  25           HE3      LYS  25   4.196   7.142  12.110
 1079    HE3  LYS  25           HE2      LYS  25   3.377   5.767  12.854
 1080    HZ1  LYS  25           HZ1      LYS  25   4.438   5.145  10.781
 1081    HZ2  LYS  25           HZ2      LYS  25   3.549   6.308   9.937
 1082    HZ3  LYS  25           HZ3      LYS  25   2.754   4.990  10.642
 1083    H    THR  26           H        THR  26   1.818   9.943  16.707
 1084    HA   THR  26           HA       THR  26   2.280  12.698  15.865
 1085    HB   THR  26           HB       THR  26   1.491  12.350  18.164
 1086    HG1  THR  26           HG1      THR  26   3.982  13.513  17.604
 1087   HG21  THR  26          HG21      THR  26   4.108  10.896  18.546
 1088   HG22  THR  26          HG22      THR  26   2.493  10.197  18.655
 1089   HG23  THR  26          HG23      THR  26   3.021  11.384  19.846
 1090    H    THR  27           H        THR  27   3.859   9.753  15.641
 1091    HA   THR  27           HA       THR  27   6.325  11.156  14.949
 1092    HB   THR  27           HB       THR  27   7.569   9.093  15.940
 1093    HG1  THR  27           HG1      THR  27   5.046   9.000  17.193
 1094   HG21  THR  27          HG21      THR  27   6.466  11.285  17.693
 1095   HG22  THR  27          HG22      THR  27   7.923  11.370  16.703
 1096   HG23  THR  27          HG23      THR  27   7.856  10.272  18.082
 1097    H    ALA  28           H        ALA  28   7.242  10.453  13.118
 1098    HA   ALA  28           HA       ALA  28   6.644   7.762  12.151
 1099    HB1  ALA  28           HB1      ALA  28   6.076  10.210  10.484
 1100    HB2  ALA  28           HB2      ALA  28   4.860   9.163  11.216
 1101    HB3  ALA  28           HB3      ALA  28   5.928   8.530   9.963
 1102    H    THR  29           H        THR  29   8.007   7.174  10.291
 1103    HA   THR  29           HA       THR  29  10.626   8.435  10.579
 1104    HB   THR  29           HB       THR  29   9.977   5.872   9.125
 1105    HG1  THR  29           HG1      THR  29   9.794   6.348  11.717
 1106   HG21  THR  29          HG21      THR  29  12.348   5.394   9.459
 1107   HG22  THR  29          HG22      THR  29  12.552   6.936  10.294
 1108   HG23  THR  29          HG23      THR  29  12.142   6.910   8.578
 1109    H    ASP  30           H        ASP  30  11.215   9.883   9.201
 1110    HA   ASP  30           HA       ASP  30   9.863  10.525   6.801
 1111    HB2  ASP  30           HB3      ASP  30  11.075  12.190   8.126
 1112    HB3  ASP  30           HB2      ASP  30  12.591  11.334   7.848
 1113    H    ILE  31           H        ILE  31  10.971  10.658   4.643
 1114    HA   ILE  31           HA       ILE  31  11.718   8.104   3.766
 1115    HB   ILE  31           HB       ILE  31  10.681   9.736   2.279
 1116   HG12  ILE  31          HG13      ILE  31  13.452   9.031   1.286
 1117   HG13  ILE  31          HG12      ILE  31  12.090   7.914   1.324
 1118   HG21  ILE  31          HG21      ILE  31  13.282  11.252   2.457
 1119   HG22  ILE  31          HG22      ILE  31  11.728  11.762   3.118
 1120   HG23  ILE  31          HG23      ILE  31  11.943  11.629   1.373
 1121   HD11  ILE  31          HD11      ILE  31  12.424   8.832  -0.897
 1122   HD12  ILE  31          HD12      ILE  31  12.235  10.467  -0.262
 1123   HD13  ILE  31          HD13      ILE  31  10.874   9.346  -0.232
 1124    H    LYS  32           H        LYS  32  13.628  10.782   4.929
 1125    HA   LYS  32           HA       LYS  32  16.134   9.758   3.963
 1126    HB2  LYS  32           HB3      LYS  32  15.492  11.875   6.019
 1127    HB3  LYS  32           HB2      LYS  32  17.103  11.540   5.395
 1128    HG2  LYS  32           HG3      LYS  32  16.460  12.233   3.194
 1129    HG3  LYS  32           HG2      LYS  32  14.774  12.380   3.688
 1130    HD2  LYS  32           HD3      LYS  32  15.352  14.174   5.202
 1131    HD3  LYS  32           HD2      LYS  32  17.058  14.017   4.777
 1132    HE2  LYS  32           HE3      LYS  32  16.566  14.645   2.489
 1133    HE3  LYS  32           HE2      LYS  32  14.845  14.710   2.856
 1134    HZ1  LYS  32           HZ1      LYS  32  15.245  16.538   4.353
 1135    HZ2  LYS  32           HZ2      LYS  32  15.879  16.910   2.831
 1136    HZ3  LYS  32           HZ3      LYS  32  16.913  16.450   4.085
 1137    H    GLY  33           H        GLY  33  14.089   8.938   6.506
 1138    HA2  GLY  33           HA3      GLY  33  14.493   6.991   7.812
 1139    HA3  GLY  33           HA2      GLY  33  16.222   7.289   7.668
 1140    H    LYS  34           H        LYS  34  14.425  10.066   8.381
 1141    HA   LYS  34           HA       LYS  34  15.445  10.063  11.114
 1142    HB2  LYS  34           HB3      LYS  34  14.090  12.253   9.531
 1143    HB3  LYS  34           HB2      LYS  34  14.857  12.445  11.098
 1144    HG2  LYS  34           HG3      LYS  34  17.018  11.985  10.137
 1145    HG3  LYS  34           HG2      LYS  34  16.280  11.637   8.574
 1146    HD2  LYS  34           HD3      LYS  34  15.472  13.919   8.432
 1147    HD3  LYS  34           HD2      LYS  34  16.164  14.280  10.012
 1148    HE2  LYS  34           HE3      LYS  34  17.740  13.388   7.608
 1149    HE3  LYS  34           HE2      LYS  34  17.553  15.064   8.109
 1150    HZ1  LYS  34           HZ1      LYS  34  18.598  14.479  10.231
 1151    HZ2  LYS  34           HZ2      LYS  34  19.624  14.199   8.917
 1152    HZ3  LYS  34           HZ3      LYS  34  18.848  12.900   9.673
 1153    H    GLU  35           H        GLU  35  14.132  10.113  12.914
 1154    HA   GLU  35           HA       GLU  35  11.313   9.576  12.507
 1155    HB2  GLU  35           HB3      GLU  35  12.527   8.319  14.240
 1156    HB3  GLU  35           HB2      GLU  35  12.911   9.825  15.062
 1157    HG2  GLU  35           HG3      GLU  35  10.561  10.218  15.502
 1158    HG3  GLU  35           HG2      GLU  35  10.136   8.755  14.619
 1159    H    VAL  36           H        VAL  36   9.927  11.178  12.281
 1160    HA   VAL  36           HA       VAL  36  10.621  13.779  13.462
 1161    HB   VAL  36           HB       VAL  36   9.291  14.817  11.637
 1162   HG11  VAL  36          HG11      VAL  36  11.612  13.097  10.774
 1163   HG12  VAL  36          HG12      VAL  36  11.702  14.726  11.447
 1164   HG13  VAL  36          HG13      VAL  36  10.970  14.465   9.863
 1165   HG21  VAL  36          HG21      VAL  36   8.738  13.500   9.661
 1166   HG22  VAL  36          HG22      VAL  36   7.886  12.896  11.082
 1167   HG23  VAL  36          HG23      VAL  36   9.301  12.037  10.469
 1168    H    THR  37           H        THR  37   8.899  15.108  14.164
 1169    HA   THR  37           HA       THR  37   6.812  13.552  15.438
 1170    HB   THR  37           HB       THR  37   7.416  16.494  15.740
 1171    HG1  THR  37           HG1      THR  37   8.961  14.480  16.406
 1172   HG21  THR  37          HG21      THR  37   5.206  15.814  16.551
 1173   HG22  THR  37          HG22      THR  37   6.268  16.248  17.891
 1174   HG23  THR  37          HG23      THR  37   5.949  14.551  17.532
 1175    H    VAL  38           H        VAL  38   5.060  13.206  14.248
 1176    HA   VAL  38           HA       VAL  38   4.155  15.066  12.244
 1177    HB   VAL  38           HB       VAL  38   2.664  12.657  13.292
 1178   HG11  VAL  38          HG11      VAL  38   2.597  14.002  10.596
 1179   HG12  VAL  38          HG12      VAL  38   1.403  14.226  11.874
 1180   HG13  VAL  38          HG13      VAL  38   1.605  12.646  11.123
 1181   HG21  VAL  38          HG21      VAL  38   4.718  12.726  11.084
 1182   HG22  VAL  38          HG22      VAL  38   3.705  11.349  11.512
 1183   HG23  VAL  38          HG23      VAL  38   4.906  11.946  12.654
 1184    H    LEU  39           H        LEU  39   2.456  16.476  12.425
 1185    HA   LEU  39           HA       LEU  39   1.710  17.184  15.123
 1186    HB2  LEU  39           HB3      LEU  39   1.005  18.432  12.465
 1187    HB3  LEU  39           HB2      LEU  39   0.580  19.105  14.030
 1188    HG   LEU  39           HG       LEU  39   3.401  18.673  13.046
 1189   HD11  LEU  39          HD11      LEU  39   1.796  21.209  13.306
 1190   HD12  LEU  39          HD12      LEU  39   2.245  20.422  11.794
 1191   HD13  LEU  39          HD13      LEU  39   3.494  21.095  12.840
 1192   HD21  LEU  39          HD21      LEU  39   2.309  20.011  15.513
 1193   HD22  LEU  39          HD22      LEU  39   3.992  20.066  14.992
 1194   HD23  LEU  39          HD23      LEU  39   3.262  18.530  15.451
 1195    H    ALA  40           H        ALA  40   0.577  14.923  13.158
 1196    HA   ALA  40           HA       ALA  40  -1.282  13.641  13.056
 1197    HB1  ALA  40           HB1      ALA  40  -3.020  13.841  14.738
 1198    HB2  ALA  40           HB2      ALA  40  -2.370  15.400  15.249
 1199    HB3  ALA  40           HB3      ALA  40  -1.424  13.931  15.482
 1200    H    GLU  41           H        GLU  41  -2.034  17.079  13.332
 1201    HA   GLU  41           HA       GLU  41  -3.865  16.788  11.046
 1202    HB2  GLU  41           HB3      GLU  41  -4.209  18.705  13.365
 1203    HB3  GLU  41           HB2      GLU  41  -5.328  18.448  12.033
 1204    HG2  GLU  41           HG3      GLU  41  -5.755  16.186  12.805
 1205    HG3  GLU  41           HG2      GLU  41  -4.595  16.403  14.113
 1206    H    VAL  42           H        VAL  42  -3.866  18.565   9.587
 1207    HA   VAL  42           HA       VAL  42  -1.462  20.217   9.816
 1208    HB   VAL  42           HB       VAL  42  -1.666  20.705   7.459
 1209   HG11  VAL  42          HG11      VAL  42  -0.566  18.628   8.055
 1210   HG12  VAL  42          HG12      VAL  42  -1.412  18.466   6.518
 1211   HG13  VAL  42          HG13      VAL  42  -2.106  17.774   7.982
 1212   HG21  VAL  42          HG21      VAL  42  -3.426  19.780   6.052
 1213   HG22  VAL  42          HG22      VAL  42  -4.100  20.851   7.282
 1214   HG23  VAL  42          HG23      VAL  42  -4.219  19.102   7.474
 1215    H    ASN  43           H        ASN  43  -1.594  22.267  10.387
 1216    HA   ASN  43           HA       ASN  43  -4.169  23.429  10.912
 1217    HB2  ASN  43           HB3      ASN  43  -2.971  25.266  11.923
 1218    HB3  ASN  43           HB2      ASN  43  -2.200  23.768  12.429
 1219   HD21  ASN  43          HD21      ASN  43  -0.136  23.272  11.650
 1220   HD22  ASN  43          HD22      ASN  43   0.866  24.468  10.906
 1221    H    ILE  44           H        ILE  44  -4.939  25.404  10.024
 1222    HA   ILE  44           HA       ILE  44  -4.713  25.287   7.199
 1223    HB   ILE  44           HB       ILE  44  -6.871  25.680   8.175
 1224   HG12  ILE  44          HG13      ILE  44  -5.977  28.164   6.696
 1225   HG13  ILE  44          HG12      ILE  44  -6.392  26.631   5.934
 1226   HG21  ILE  44          HG21      ILE  44  -6.232  26.856  10.189
 1227   HG22  ILE  44          HG22      ILE  44  -7.449  27.775   9.307
 1228   HG23  ILE  44          HG23      ILE  44  -5.757  28.265   9.241
 1229   HD11  ILE  44          HD11      ILE  44  -8.675  26.836   6.787
 1230   HD12  ILE  44          HD12      ILE  44  -8.224  28.206   5.770
 1231   HD13  ILE  44          HD13      ILE  44  -8.255  28.381   7.525
 1232    H    ASN  45           H        ASN  45  -2.355  25.815   7.217
 1233    HA   ASN  45           HA       ASN  45  -1.916  28.678   6.862
 1234    HB2  ASN  45           HB3      ASN  45  -0.158  26.277   6.281
 1235    HB3  ASN  45           HB2      ASN  45   0.316  27.935   5.938
 1236   HD21  ASN  45          HD21      ASN  45  -0.937  28.994   8.369
 1237   HD22  ASN  45          HD22      ASN  45   0.077  28.499   9.681
 1238    H    ASN  46           H        ASN  46  -3.444  26.264   5.381
 1239    HA   ASN  46           HA       ASN  46  -3.920  27.727   2.990
 1240    HB2  ASN  46           HB3      ASN  46  -1.835  26.618   2.290
 1241    HB3  ASN  46           HB2      ASN  46  -2.495  25.056   2.762
 1242   HD21  ASN  46          HD21      ASN  46  -4.363  27.553   1.150
 1243   HD22  ASN  46          HD22      ASN  46  -4.542  26.702  -0.345
 1244    H    SER  47           H        SER  47  -4.063  24.549   4.547
 1245    HA   SER  47           HA       SER  47  -6.966  24.628   4.435
 1246    HB2  SER  47           HB3      SER  47  -6.948  22.205   3.659
 1247    HB3  SER  47           HB2      SER  47  -6.489  23.388   2.434
 1248    HG   SER  47           HG       SER  47  -4.780  22.177   2.244
 1249    H    VAL  48           H        VAL  48  -7.930  23.056   5.946
 1250    HA   VAL  48           HA       VAL  48  -6.008  22.107   7.955
 1251    HB   VAL  48           HB       VAL  48  -7.112  23.984   8.948
 1252   HG11  VAL  48          HG11      VAL  48  -9.557  24.073   9.252
 1253   HG12  VAL  48          HG12      VAL  48  -9.713  22.670   8.195
 1254   HG13  VAL  48          HG13      VAL  48  -9.066  24.185   7.563
 1255   HG21  VAL  48          HG21      VAL  48  -6.707  22.124  10.429
 1256   HG22  VAL  48          HG22      VAL  48  -8.262  21.409  10.000
 1257   HG23  VAL  48          HG23      VAL  48  -8.206  22.936  10.880
 1258    H    PHE  49           H        PHE  49  -5.944  20.013   7.950
 1259    HA   PHE  49           HA       PHE  49  -8.399  18.442   7.941
 1260    HB2  PHE  49           HB3      PHE  49  -6.178  18.121   5.908
 1261    HB3  PHE  49           HB2      PHE  49  -7.327  16.837   6.269
 1262    HD1  PHE  49           HD1      PHE  49  -6.755  19.939   4.502
 1263    HD2  PHE  49           HD2      PHE  49  -9.724  17.151   5.737
 1264    HE1  PHE  49           HE1      PHE  49  -8.316  20.858   2.829
 1265    HE2  PHE  49           HE2      PHE  49 -11.285  18.066   4.071
 1266    HZ   PHE  49           HZ       PHE  49 -10.581  19.921   2.615
 1267    H    ARG  50           H        ARG  50  -8.228  16.610   9.169
 1268    HA   ARG  50           HA       ARG  50  -5.791  16.192  10.645
 1269    HB2  ARG  50           HB3      ARG  50  -7.840  15.837  11.852
 1270    HB3  ARG  50           HB2      ARG  50  -8.433  14.720  10.630
 1271    HG2  ARG  50           HG3      ARG  50  -6.880  13.054  11.261
 1272    HG3  ARG  50           HG2      ARG  50  -5.973  14.183  12.264
 1273    HD2  ARG  50           HD3      ARG  50  -8.837  13.435  12.792
 1274    HD3  ARG  50           HD2      ARG  50  -7.471  12.573  13.495
 1275    HE   ARG  50           HE       ARG  50  -7.924  15.462  13.938
 1276   HH11  ARG  50          HH11      ARG  50  -7.204  12.250  15.144
 1277   HH12  ARG  50          HH12      ARG  50  -6.875  12.786  16.758
 1278   HH21  ARG  50          HH21      ARG  50  -7.523  16.166  16.067
 1279   HH22  ARG  50          HH22      ARG  50  -7.088  15.014  17.293
 1280    H    GLN  51           H        GLN  51  -4.221  14.775  10.185
 1281    HA   GLN  51           HA       GLN  51  -4.352  13.502   7.592
 1282    HB2  GLN  51           HB3      GLN  51  -2.312  14.638   9.130
 1283    HB3  GLN  51           HB2      GLN  51  -1.968  12.914   9.152
 1284    HG2  GLN  51           HG3      GLN  51  -2.287  14.656   6.720
 1285    HG3  GLN  51           HG2      GLN  51  -0.786  13.974   7.342
 1286   HE21  GLN  51          HE21      GLN  51  -2.009  11.384   7.959
 1287   HE22  GLN  51          HE22      GLN  51  -2.263  10.596   6.436
 1288    H    TYR  52           H        TYR  52  -5.862  11.818   7.956
 1289    HA   TYR  52           HA       TYR  52  -5.309   9.781   9.899
 1290    HB2  TYR  52           HB3      TYR  52  -7.084   9.693   7.439
 1291    HB3  TYR  52           HB2      TYR  52  -7.038   8.472   8.706
 1292    HD1  TYR  52           HD1      TYR  52  -8.329  11.710   7.719
 1293    HD2  TYR  52           HD2      TYR  52  -7.850   9.027  10.986
 1294    HE1  TYR  52           HE1      TYR  52 -10.042  12.942   8.975
 1295    HE2  TYR  52           HE2      TYR  52  -9.563  10.257  12.251
 1296    HH   TYR  52           HH       TYR  52 -10.608  12.418  12.324
 1297    H    PHE  53           H        PHE  53  -3.785   8.304   9.749
 1298    HA   PHE  53           HA       PHE  53  -2.508   7.841   7.167
 1299    HB2  PHE  53           HB3      PHE  53  -1.687   7.102   9.986
 1300    HB3  PHE  53           HB2      PHE  53  -0.778   6.645   8.547
 1301    HD1  PHE  53           HD1      PHE  53   0.146   8.454   7.088
 1302    HD2  PHE  53           HD2      PHE  53  -1.428   9.215  10.961
 1303    HE1  PHE  53           HE1      PHE  53   1.339  10.602   7.140
 1304    HE2  PHE  53           HE2      PHE  53  -0.241  11.368  11.026
 1305    HZ   PHE  53           HZ       PHE  53   1.140  12.064   9.110
 1306    H    PHE  54           H        PHE  54  -3.139   6.197   5.999
 1307    HA   PHE  54           HA       PHE  54  -4.603   4.003   7.170
 1308    HB2  PHE  54           HB3      PHE  54  -4.558   3.197   4.708
 1309    HB3  PHE  54           HB2      PHE  54  -5.482   4.644   5.085
 1310    HD1  PHE  54           HD1      PHE  54  -2.634   3.281   3.285
 1311    HD2  PHE  54           HD2      PHE  54  -4.630   6.860   4.439
 1312    HE1  PHE  54           HE1      PHE  54  -1.389   4.522   1.570
 1313    HE2  PHE  54           HE2      PHE  54  -3.387   8.109   2.723
 1314    HZ   PHE  54           HZ       PHE  54  -1.765   6.945   1.287
 1315    H    GLU  55           H        GLU  55  -3.224   2.856   8.420
 1316    HA   GLU  55           HA       GLU  55  -0.762   1.870   7.149
 1317    HB2  GLU  55           HB3      GLU  55  -1.380   1.949  10.111
 1318    HB3  GLU  55           HB2      GLU  55   0.170   1.590   9.358
 1319    HG2  GLU  55           HG3      GLU  55  -0.027   3.981   8.375
 1320    HG3  GLU  55           HG2      GLU  55  -1.231   4.220   9.642
 1321    H    THR  56           H        THR  56  -1.127  -0.021   6.277
 1322    HA   THR  56           HA       THR  56  -2.807  -1.972   7.667
 1323    HB   THR  56           HB       THR  56  -1.534  -2.183   4.929
 1324    HG1  THR  56           HG1      THR  56  -3.105  -0.867   4.405
 1325   HG21  THR  56          HG21      THR  56  -2.033  -4.355   5.947
 1326   HG22  THR  56          HG22      THR  56  -3.121  -4.027   4.596
 1327   HG23  THR  56          HG23      THR  56  -3.691  -3.837   6.254
 1328    H    LYS  57           H        LYS  57  -1.748  -3.029   9.182
 1329    HA   LYS  57           HA       LYS  57   1.106  -3.600   8.778
 1330    HB2  LYS  57           HB3      LYS  57  -0.539  -3.561  11.321
 1331    HB3  LYS  57           HB2      LYS  57   1.192  -3.869  11.232
 1332    HG2  LYS  57           HG3      LYS  57   1.528  -1.615  10.313
 1333    HG3  LYS  57           HG2      LYS  57  -0.201  -1.309  10.464
 1334    HD2  LYS  57           HD3      LYS  57   0.887  -0.324  12.344
 1335    HD3  LYS  57           HD2      LYS  57   0.023  -1.752  12.912
 1336    HE2  LYS  57           HE3      LYS  57   2.113  -3.026  12.834
 1337    HE3  LYS  57           HE2      LYS  57   2.967  -1.580  12.300
 1338    HZ1  LYS  57           HZ1      LYS  57   1.562  -1.904  14.896
 1339    HZ2  LYS  57           HZ2      LYS  57   2.351  -0.502  14.377
 1340    HZ3  LYS  57           HZ3      LYS  57   3.239  -1.913  14.666
 1341    H    CYS  58           H        CYS  58   1.928  -5.662   9.366
 1342    HA   CYS  58           HA       CYS  58   0.042  -7.744   8.628
 1343    HB2  CYS  58           HB3      CYS  58   2.424  -7.401   7.643
 1344    HB3  CYS  58           HB2      CYS  58   2.965  -8.205   9.111
 1345    H    ARG  59           H        ARG  59  -0.839  -9.090  10.013
 1346    HA   ARG  59           HA       ARG  59   0.113  -9.102  12.784
 1347    HB2  ARG  59           HB3      ARG  59  -2.444 -10.156  11.566
 1348    HB3  ARG  59           HB2      ARG  59  -2.053 -10.203  13.276
 1349    HG2  ARG  59           HG3      ARG  59  -1.975  -7.744  13.300
 1350    HG3  ARG  59           HG2      ARG  59  -2.443  -7.735  11.600
 1351    HD2  ARG  59           HD3      ARG  59  -4.379  -7.365  13.025
 1352    HD3  ARG  59           HD2      ARG  59  -4.519  -8.893  12.169
 1353    HE   ARG  59           HE       ARG  59  -3.342  -9.324  14.693
 1354   HH11  ARG  59          HH11      ARG  59  -6.411  -8.499  13.238
 1355   HH12  ARG  59          HH12      ARG  59  -7.354  -9.180  14.524
 1356   HH21  ARG  59          HH21      ARG  59  -4.575 -10.238  16.391
 1357   HH22  ARG  59          HH22      ARG  59  -6.309 -10.175  16.320
 1358    H    ALA  60           H        ALA  60   1.183 -10.598  10.327
 1359    HA   ALA  60           HA       ALA  60   1.547 -13.152  11.678
 1360    HB1  ALA  60           HB1      ALA  60   0.541 -12.961   8.834
 1361    HB2  ALA  60           HB2      ALA  60  -0.388 -13.528  10.221
 1362    HB3  ALA  60           HB3      ALA  60   1.014 -14.443   9.666
 1363    H    SER  61           H        SER  61   3.176 -14.490  10.390
 1364    HA   SER  61           HA       SER  61   5.015 -12.872   8.793
 1365    HB2  SER  61           HB3      SER  61   5.887 -14.550  11.161
 1366    HB3  SER  61           HB2      SER  61   6.956 -13.681  10.059
 1367    HG   SER  61           HG       SER  61   5.011 -12.080  11.112
 1368    H    ASN  62           H        ASN  62   4.370 -16.085  10.156
 1369    HA   ASN  62           HA       ASN  62   4.540 -17.176   7.446
 1370    HB2  ASN  62           HB3      ASN  62   5.792 -18.505   9.870
 1371    HB3  ASN  62           HB2      ASN  62   5.692 -19.202   8.259
 1372   HD21  ASN  62          HD21      ASN  62   6.980 -18.282   6.581
 1373   HD22  ASN  62          HD22      ASN  62   8.386 -17.358   6.962
 1374    HA   PRO  63           HA       PRO  63   0.419 -17.954   9.294
 1375    HB2  PRO  63           HB3      PRO  63   0.115 -18.855   6.461
 1376    HB3  PRO  63           HB2      PRO  63  -0.972 -17.871   7.453
 1377    HG2  PRO  63           HG3      PRO  63   0.555 -16.733   5.597
 1378    HG3  PRO  63           HG2      PRO  63   0.297 -15.946   7.163
 1379    HD2  PRO  63           HD3      PRO  63   2.703 -17.396   6.143
 1380    HD3  PRO  63           HD2      PRO  63   2.604 -15.987   7.225
 1381    H    VAL  64           H        VAL  64   2.383 -20.166   7.322
 1382    HA   VAL  64           HA       VAL  64   1.318 -22.328   9.011
 1383    HB   VAL  64           HB       VAL  64   1.700 -23.947   7.196
 1384   HG11  VAL  64          HG11      VAL  64  -0.192 -23.298   5.780
 1385   HG12  VAL  64          HG12      VAL  64  -0.119 -21.668   6.453
 1386   HG13  VAL  64          HG13      VAL  64  -0.518 -23.036   7.493
 1387   HG21  VAL  64          HG21      VAL  64   2.234 -21.536   5.473
 1388   HG22  VAL  64          HG22      VAL  64   2.093 -23.203   4.915
 1389   HG23  VAL  64          HG23      VAL  64   3.428 -22.733   5.967
 1390    H    GLU  65           H        GLU  65   2.969 -24.329   8.586
 1391    HA   GLU  65           HA       GLU  65   5.065 -23.895  10.263
 1392    HB2  GLU  65           HB3      GLU  65   6.033 -26.014   9.307
 1393    HB3  GLU  65           HB2      GLU  65   4.351 -26.114   9.804
 1394    HG2  GLU  65           HG3      GLU  65   3.730 -25.710   7.403
 1395    HG3  GLU  65           HG2      GLU  65   5.437 -25.914   7.009
 1396    H    SER  66           H        SER  66   5.253 -23.753   6.706
 1397    HA   SER  66           HA       SER  66   7.676 -22.162   6.972
 1398    HB2  SER  66           HB3      SER  66   8.404 -24.551   6.787
 1399    HB3  SER  66           HB2      SER  66   7.597 -24.637   5.222
 1400    HG   SER  66           HG       SER  66   9.803 -23.006   5.954
 1401    H    GLY  67           H        GLY  67   5.381 -21.027   6.314
 1402    HA2  GLY  67           HA3      GLY  67   5.821 -19.590   4.082
 1403    HA3  GLY  67           HA2      GLY  67   5.020 -21.020   3.441
 1404    H    CYS  68           H        CYS  68   3.323 -19.642   2.725
 1405    HA   CYS  68           HA       CYS  68   1.614 -18.519   4.821
 1406    HB2  CYS  68           HB3      CYS  68   1.554 -18.187   1.808
 1407    HB3  CYS  68           HB2      CYS  68   0.424 -17.418   2.922
 1408    H    ARG  69           H        ARG  69  -0.760 -18.863   4.568
 1409    HA   ARG  69           HA       ARG  69  -1.292 -21.653   4.524
 1410    HB2  ARG  69           HB3      ARG  69  -3.092 -19.241   4.768
 1411    HB3  ARG  69           HB2      ARG  69  -3.710 -20.888   4.786
 1412    HG2  ARG  69           HG3      ARG  69  -2.517 -21.393   6.788
 1413    HG3  ARG  69           HG2      ARG  69  -1.635 -19.869   6.714
 1414    HD2  ARG  69           HD3      ARG  69  -4.614 -20.159   7.094
 1415    HD3  ARG  69           HD2      ARG  69  -3.447 -19.812   8.372
 1416    HE   ARG  69           HE       ARG  69  -4.084 -18.004   6.124
 1417   HH11  ARG  69          HH11      ARG  69  -2.980 -18.531   9.417
 1418   HH12  ARG  69          HH12      ARG  69  -2.890 -16.836   9.780
 1419   HH21  ARG  69          HH21      ARG  69  -3.959 -15.787   6.616
 1420   HH22  ARG  69          HH22      ARG  69  -3.434 -15.278   8.199
 1421    H    GLY  70           H        GLY  70  -1.881 -22.923   2.913
 1422    HA2  GLY  70           HA3      GLY  70  -3.210 -23.430   0.991
 1423    HA3  GLY  70           HA2      GLY  70  -3.146 -21.726   0.542
 1424    H    ILE  71           H        ILE  71  -0.251 -21.613   1.125
 1425    HA   ILE  71           HA       ILE  71   0.640 -22.208  -1.521
 1426    HB   ILE  71           HB       ILE  71   2.197 -21.282   0.899
 1427   HG12  ILE  71          HG13      ILE  71   0.425 -19.714   0.232
 1428   HG13  ILE  71          HG12      ILE  71   2.023 -19.047  -0.079
 1429   HG21  ILE  71          HG21      ILE  71   3.665 -22.293  -0.744
 1430   HG22  ILE  71          HG22      ILE  71   3.897 -20.544  -0.704
 1431   HG23  ILE  71          HG23      ILE  71   2.972 -21.281  -2.013
 1432   HD11  ILE  71          HD11      ILE  71   1.787 -19.636  -2.450
 1433   HD12  ILE  71          HD12      ILE  71   0.518 -18.542  -1.897
 1434   HD13  ILE  71          HD13      ILE  71   0.168 -20.255  -2.120
 1435    H    ASP  72           H        ASP  72   1.866 -23.858  -2.253
 1436    HA   ASP  72           HA       ASP  72   2.279 -26.197  -0.682
 1437    HB2  ASP  72           HB3      ASP  72   3.245 -25.382  -3.422
 1438    HB3  ASP  72           HB2      ASP  72   3.737 -26.895  -2.675
 1439    H    SER  73           H        SER  73   3.584 -25.798   1.062
 1440    HA   SER  73           HA       SER  73   5.991 -24.334   1.002
 1441    HB2  SER  73           HB3      SER  73   4.660 -24.954   3.067
 1442    HB3  SER  73           HB2      SER  73   5.328 -26.583   2.922
 1443    HG   SER  73           HG       SER  73   6.748 -24.155   3.334
 1444    H    LYS  74           H        LYS  74   5.213 -27.449  -0.134
 1445    HA   LYS  74           HA       LYS  74   7.729 -28.700   0.029
 1446    HB2  LYS  74           HB3      LYS  74   5.375 -29.068  -1.808
 1447    HB3  LYS  74           HB2      LYS  74   6.828 -30.039  -1.957
 1448    HG2  LYS  74           HG3      LYS  74   6.507 -31.021   0.163
 1449    HG3  LYS  74           HG2      LYS  74   5.261 -29.851   0.599
 1450    HD2  LYS  74           HD3      LYS  74   4.337 -32.059  -0.015
 1451    HD3  LYS  74           HD2      LYS  74   3.773 -30.764  -1.067
 1452    HE2  LYS  74           HE3      LYS  74   5.478 -31.405  -2.721
 1453    HE3  LYS  74           HE2      LYS  74   5.956 -32.745  -1.684
 1454    HZ1  LYS  74           HZ1      LYS  74   4.444 -33.446  -3.440
 1455    HZ2  LYS  74           HZ2      LYS  74   3.267 -32.368  -2.883
 1456    HZ3  LYS  74           HZ3      LYS  74   3.743 -33.670  -1.917
 1457    H    HIS  75           H        HIS  75   6.446 -26.299  -2.134
 1458    HA   HIS  75           HA       HIS  75   8.892 -26.512  -3.770
 1459    HB2  HIS  75           HB3      HIS  75   6.807 -27.157  -4.984
 1460    HB3  HIS  75           HB2      HIS  75   6.174 -25.541  -4.688
 1461    HD1  HIS  75           HD1      HIS  75   8.548 -27.434  -6.845
 1462    HD2  HIS  75           HD2      HIS  75   7.363 -23.497  -6.246
 1463    HE1  HIS  75           HE1      HIS  75   9.423 -26.156  -8.825
 1464    HE2  HIS  75           HE2      HIS  75   8.504 -23.829  -8.540
 1465    H    TRP  76           H        TRP  76   6.764 -24.455  -1.964
 1466    HA   TRP  76           HA       TRP  76   8.452 -22.143  -2.645
 1467    HB2  TRP  76           HB3      TRP  76   5.468 -22.197  -2.151
 1468    HB3  TRP  76           HB2      TRP  76   6.423 -20.720  -2.256
 1469    HD1  TRP  76           HD1      TRP  76   4.453 -23.058  -4.333
 1470    HE1  TRP  76           HE1      TRP  76   4.731 -22.492  -6.828
 1471    HE3  TRP  76           HE3      TRP  76   8.450 -19.886  -4.003
 1472    HZ2  TRP  76           HZ2      TRP  76   6.427 -20.912  -8.439
 1473    HZ3  TRP  76           HZ3      TRP  76   9.337 -18.888  -6.068
 1474    HH2  TRP  76           HH2      TRP  76   8.346 -19.393  -8.240
 1475    H    ASN  77           H        ASN  77   9.368 -21.154  -0.978
 1476    HA   ASN  77           HA       ASN  77   8.199 -21.513   1.697
 1477    HB2  ASN  77           HB3      ASN  77  10.593 -21.990   1.630
 1478    HB3  ASN  77           HB2      ASN  77  10.910 -20.442   0.858
 1479   HD21  ASN  77          HD21      ASN  77   9.996 -22.035   3.832
 1480   HD22  ASN  77          HD22      ASN  77  10.342 -20.696   4.872
 1481    H    SER  78           H        SER  78   7.345 -19.764   2.755
 1482    HA   SER  78           HA       SER  78   7.202 -17.290   1.176
 1483    HB2  SER  78           HB3      SER  78   4.826 -18.329   2.686
 1484    HB3  SER  78           HB2      SER  78   4.877 -17.218   1.316
 1485    HG   SER  78           HG       SER  78   5.683 -19.096   0.096
 1486    H    TYR  79           H        TYR  79   6.962 -15.386   2.307
 1487    HA   TYR  79           HA       TYR  79   6.740 -15.495   5.211
 1488    HB2  TYR  79           HB3      TYR  79   9.183 -15.475   4.707
 1489    HB3  TYR  79           HB2      TYR  79   8.962 -13.964   3.825
 1490    HD1  TYR  79           HD1      TYR  79   9.015 -11.898   4.972
 1491    HD2  TYR  79           HD2      TYR  79   8.599 -15.511   7.180
 1492    HE1  TYR  79           HE1      TYR  79   9.313 -10.647   7.070
 1493    HE2  TYR  79           HE2      TYR  79   8.900 -14.273   9.279
 1494    HH   TYR  79           HH       TYR  79   9.798 -12.229  10.104
 1495    H    CYS  80           H        CYS  80   5.553 -13.860   6.014
 1496    HA   CYS  80           HA       CYS  80   4.292 -12.069   4.134
 1497    HB2  CYS  80           HB3      CYS  80   3.953 -12.321   7.134
 1498    HB3  CYS  80           HB2      CYS  80   2.907 -11.399   6.051
 1499    H    THR  81           H        THR  81   5.232 -10.261   3.540
 1500    HA   THR  81           HA       THR  81   6.936  -8.827   5.472
 1501    HB   THR  81           HB       THR  81   7.188  -8.805   2.456
 1502    HG1  THR  81           HG1      THR  81   7.698 -10.845   3.685
 1503   HG21  THR  81          HG21      THR  81   9.094  -7.847   4.597
 1504   HG22  THR  81          HG22      THR  81   8.055  -6.803   3.627
 1505   HG23  THR  81          HG23      THR  81   9.332  -7.742   2.855
 1506    H    THR  82           H        THR  82   6.310  -6.786   5.961
 1507    HA   THR  82           HA       THR  82   3.995  -5.696   4.604
 1508    HB   THR  82           HB       THR  82   5.534  -4.473   6.897
 1509    HG1  THR  82           HG1      THR  82   4.796  -6.383   7.705
 1510   HG21  THR  82          HG21      THR  82   4.037  -2.934   5.715
 1511   HG22  THR  82          HG22      THR  82   3.430  -3.294   7.331
 1512   HG23  THR  82          HG23      THR  82   2.703  -4.067   5.924
 1513    H    THR  83           H        THR  83   4.181  -4.422   2.897
 1514    HA   THR  83           HA       THR  83   6.617  -3.051   2.234
 1515    HB   THR  83           HB       THR  83   3.879  -2.654   1.006
 1516    HG1  THR  83           HG1      THR  83   5.869  -4.525   0.183
 1517   HG21  THR  83          HG21      THR  83   5.145  -2.067  -1.001
 1518   HG22  THR  83          HG22      THR  83   6.659  -2.344  -0.141
 1519   HG23  THR  83          HG23      THR  83   5.599  -1.023   0.347
 1520    H    HIS  84           H        HIS  84   7.006  -0.826   2.374
 1521    HA   HIS  84           HA       HIS  84   5.028   0.711   3.932
 1522    HB2  HIS  84           HB3      HIS  84   8.053   0.933   4.021
 1523    HB3  HIS  84           HB2      HIS  84   6.942   2.020   4.850
 1524    HD1  HIS  84           HD1      HIS  84   6.221   1.344   7.148
 1525    HD2  HIS  84           HD2      HIS  84   7.947  -1.805   5.051
 1526    HE1  HIS  84           HE1      HIS  84   6.437  -0.533   8.799
 1527    HE2  HIS  84           HE2      HIS  84   7.597  -2.381   7.545
 1528    H    THR  85           H        THR  85   4.480   2.708   3.183
 1529    HA   THR  85           HA       THR  85   5.808   3.570   0.694
 1530    HB   THR  85           HB       THR  85   3.454   2.742   0.365
 1531    HG1  THR  85           HG1      THR  85   3.079   4.319  -1.095
 1532   HG21  THR  85          HG21      THR  85   2.738   5.192   1.988
 1533   HG22  THR  85          HG22      THR  85   2.495   3.516   2.483
 1534   HG23  THR  85          HG23      THR  85   1.603   4.165   1.108
 1535    H    PHE  86           H        PHE  86   5.213   6.041   0.317
 1536    HA   PHE  86           HA       PHE  86   5.835   7.384   2.863
 1537    HB2  PHE  86           HB3      PHE  86   7.012   7.941   0.127
 1538    HB3  PHE  86           HB2      PHE  86   7.254   8.965   1.543
 1539    HD1  PHE  86           HD1      PHE  86   8.285   5.970  -0.185
 1540    HD2  PHE  86           HD2      PHE  86   8.454   8.059   3.519
 1541    HE1  PHE  86           HE1      PHE  86  10.196   4.578   0.509
 1542    HE2  PHE  86           HE2      PHE  86  10.364   6.678   4.217
 1543    HZ   PHE  86           HZ       PHE  86  11.236   4.937   2.716
 1544    H    VAL  87           H        VAL  87   4.506   8.950   3.420
 1545    HA   VAL  87           HA       VAL  87   2.828  10.189   1.333
 1546    HB   VAL  87           HB       VAL  87   1.084  10.490   3.100
 1547   HG11  VAL  87          HG11      VAL  87   0.860   8.687   1.516
 1548   HG12  VAL  87          HG12      VAL  87   0.330   8.138   3.106
 1549   HG13  VAL  87          HG13      VAL  87   1.911   7.660   2.489
 1550   HG21  VAL  87          HG21      VAL  87   2.538  10.316   5.060
 1551   HG22  VAL  87          HG22      VAL  87   2.822   8.614   4.697
 1552   HG23  VAL  87          HG23      VAL  87   1.206   9.164   5.138
 1553    H    LYS  88           H        LYS  88   2.455  12.405   1.479
 1554    HA   LYS  88           HA       LYS  88   4.448  13.863   2.974
 1555    HB2  LYS  88           HB3      LYS  88   3.721  15.822   1.726
 1556    HB3  LYS  88           HB2      LYS  88   3.972  14.471   0.634
 1557    HG2  LYS  88           HG3      LYS  88   1.564  14.111   0.515
 1558    HG3  LYS  88           HG2      LYS  88   1.304  15.439   1.640
 1559    HD2  LYS  88           HD3      LYS  88   2.507  16.914  -0.011
 1560    HD3  LYS  88           HD2      LYS  88   2.410  15.572  -1.154
 1561    HE2  LYS  88           HE3      LYS  88   0.126  17.046   0.140
 1562    HE3  LYS  88           HE2      LYS  88   0.577  17.069  -1.563
 1563    HZ1  LYS  88           HZ1      LYS  88  -1.318  15.611  -1.157
 1564    HZ2  LYS  88           HZ2      LYS  88  -0.401  14.692  -0.076
 1565    HZ3  LYS  88           HZ3      LYS  88   0.017  14.723  -1.711
 1566    H    ALA  89           H        ALA  89   4.144  14.438   4.973
 1567    HA   ALA  89           HA       ALA  89   1.464  15.316   5.834
 1568    HB1  ALA  89           HB1      ALA  89   1.897  13.052   6.690
 1569    HB2  ALA  89           HB2      ALA  89   1.808  14.236   7.993
 1570    HB3  ALA  89           HB3      ALA  89   3.375  13.630   7.458
 1571    H    LEU  90           H        LEU  90   1.479  16.817   7.621
 1572    HA   LEU  90           HA       LEU  90   3.740  18.609   7.522
 1573    HB2  LEU  90           HB3      LEU  90   1.358  19.404   7.544
 1574    HB3  LEU  90           HB2      LEU  90   1.225  18.806   9.190
 1575    HG   LEU  90           HG       LEU  90   3.056  20.394   9.842
 1576   HD11  LEU  90          HD11      LEU  90   3.515  22.265   8.311
 1577   HD12  LEU  90          HD12      LEU  90   2.615  21.427   7.046
 1578   HD13  LEU  90          HD13      LEU  90   4.098  20.721   7.688
 1579   HD21  LEU  90          HD21      LEU  90   1.614  22.368   9.831
 1580   HD22  LEU  90          HD22      LEU  90   0.704  20.912  10.238
 1581   HD23  LEU  90          HD23      LEU  90   0.578  21.609   8.623
 1582    H    THR  91           H        THR  91   5.452  18.084   8.676
 1583    HA   THR  91           HA       THR  91   5.061  16.913  11.353
 1584    HB   THR  91           HB       THR  91   7.275  15.817  11.023
 1585    HG1  THR  91           HG1      THR  91   7.243  17.383   8.805
 1586   HG21  THR  91          HG21      THR  91   5.200  15.154   8.927
 1587   HG22  THR  91          HG22      THR  91   5.219  14.566  10.588
 1588   HG23  THR  91          HG23      THR  91   6.492  14.082   9.471
 1589    H    THR  92           H        THR  92   6.466  17.618  13.012
 1590    HA   THR  92           HA       THR  92   7.688  20.208  12.382
 1591    HB   THR  92           HB       THR  92   5.907  20.376  14.029
 1592    HG1  THR  92           HG1      THR  92   7.325  21.204  15.824
 1593   HG21  THR  92          HG21      THR  92   6.021  18.115  14.969
 1594   HG22  THR  92          HG22      THR  92   6.078  19.344  16.232
 1595   HG23  THR  92          HG23      THR  92   7.555  18.516  15.740
 1596    H    ASP  93           H        ASP  93   9.766  20.249  12.197
 1597    HA   ASP  93           HA       ASP  93  11.465  18.263  13.478
 1598    HB2  ASP  93           HB3      ASP  93  11.961  18.971  11.160
 1599    HB3  ASP  93           HB2      ASP  93  12.162  20.630  11.711
 1600    H    GLU  94           H        GLU  94  11.236  18.703  15.612
 1601    HA   GLU  94           HA       GLU  94  11.583  19.643  17.630
 1602    HB2  GLU  94           HB3      GLU  94  13.339  21.540  16.078
 1603    HB3  GLU  94           HB2      GLU  94  13.184  21.569  17.829
 1604    HG2  GLU  94           HG3      GLU  94  14.255  19.326  16.139
 1605    HG3  GLU  94           HG2      GLU  94  15.166  20.373  17.222
 1606    H    LYS  95           H        LYS  95  11.486  22.556  15.542
 1607    HA   LYS  95           HA       LYS  95   8.894  23.208  16.754
 1608    HB2  LYS  95           HB3      LYS  95  11.265  25.073  16.601
 1609    HB3  LYS  95           HB2      LYS  95   9.627  25.597  16.956
 1610    HG2  LYS  95           HG3      LYS  95   9.612  24.197  18.959
 1611    HG3  LYS  95           HG2      LYS  95  11.260  23.678  18.601
 1612    HD2  LYS  95           HD3      LYS  95  12.019  25.998  18.775
 1613    HD3  LYS  95           HD2      LYS  95  10.374  26.504  19.161
 1614    HE2  LYS  95           HE3      LYS  95  12.055  24.590  20.770
 1615    HE3  LYS  95           HE2      LYS  95  11.767  26.282  21.170
 1616    HZ1  LYS  95           HZ1      LYS  95   9.691  24.161  21.008
 1617    HZ2  LYS  95           HZ2      LYS  95   9.404  25.784  21.374
 1618    HZ3  LYS  95           HZ3      LYS  95  10.314  24.830  22.431
 1619    H    GLN  96           H        GLN  96  10.457  22.622  13.982
 1620    HA   GLN  96           HA       GLN  96   9.182  24.789  12.460
 1621    HB2  GLN  96           HB3      GLN  96  11.604  24.449  12.091
 1622    HB3  GLN  96           HB2      GLN  96  11.286  22.798  11.581
 1623    HG2  GLN  96           HG3      GLN  96  11.643  24.227   9.669
 1624    HG3  GLN  96           HG2      GLN  96   9.983  23.632   9.690
 1625   HE21  GLN  96          HE21      GLN  96   9.213  25.302   8.420
 1626   HE22  GLN  96          HE22      GLN  96   9.068  26.921   9.004
 1627    H    ALA  97           H        ALA  97   7.173  24.266  11.877
 1628    HA   ALA  97           HA       ALA  97   6.415  21.541  11.287
 1629    HB1  ALA  97           HB1      ALA  97   4.189  22.449  10.886
 1630    HB2  ALA  97           HB2      ALA  97   4.827  24.090  11.003
 1631    HB3  ALA  97           HB3      ALA  97   4.840  23.034  12.416
 1632    H    ALA  98           H        ALA  98   7.041  20.684   9.423
 1633    HA   ALA  98           HA       ALA  98   6.698  22.250   6.970
 1634    HB1  ALA  98           HB1      ALA  98   9.057  22.383   7.576
 1635    HB2  ALA  98           HB2      ALA  98   8.839  21.420   6.115
 1636    HB3  ALA  98           HB3      ALA  98   9.143  20.623   7.659
 1637    H    TRP  99           H        TRP  99   6.308  21.025   5.104
 1638    HA   TRP  99           HA       TRP  99   4.995  18.508   5.568
 1639    HB2  TRP  99           HB3      TRP  99   5.568  20.021   3.007
 1640    HB3  TRP  99           HB2      TRP  99   4.603  18.555   3.096
 1641    HD1  TRP  99           HD1      TRP  99   4.501  22.253   4.152
 1642    HE1  TRP  99           HE1      TRP  99   2.040  22.917   4.530
 1643    HE3  TRP  99           HE3      TRP  99   2.344  17.652   3.641
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.477  21.646   4.609
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.098  17.460   3.884
 1646    HH2  TRP  99           HH2      TRP  99  -1.477  19.418   4.357
 1647    H    ARG 100           H        ARG 100   5.990  16.620   5.639
 1648    HA   ARG 100           HA       ARG 100   8.366  16.209   3.950
 1649    HB2  ARG 100           HB3      ARG 100   7.992  15.257   6.796
 1650    HB3  ARG 100           HB2      ARG 100   9.344  14.825   5.758
 1651    HG2  ARG 100           HG3      ARG 100   9.910  17.249   5.626
 1652    HG3  ARG 100           HG2      ARG 100   8.667  17.547   6.838
 1653    HD2  ARG 100           HD3      ARG 100  10.829  17.386   7.906
 1654    HD3  ARG 100           HD2      ARG 100   9.834  16.011   8.371
 1655    HE   ARG 100           HE       ARG 100  11.118  14.824   6.484
 1656   HH11  ARG 100          HH11      ARG 100  12.441  17.264   8.623
 1657   HH12  ARG 100          HH12      ARG 100  14.071  16.694   8.471
 1658   HH21  ARG 100          HH21      ARG 100  13.268  14.084   6.265
 1659   HH22  ARG 100          HH22      ARG 100  14.545  14.915   7.103
 1660    H    PHE 101           H        PHE 101   8.818  13.913   3.541
 1661    HA   PHE 101           HA       PHE 101   6.311  12.441   3.194
 1662    HB2  PHE 101           HB3      PHE 101   9.040  12.050   1.932
 1663    HB3  PHE 101           HB2      PHE 101   7.656  11.007   1.636
 1664    HD1  PHE 101           HD1      PHE 101   5.868  11.694   0.205
 1665    HD2  PHE 101           HD2      PHE 101   9.065  14.357   1.104
 1666    HE1  PHE 101           HE1      PHE 101   5.135  13.181  -1.612
 1667    HE2  PHE 101           HE2      PHE 101   8.337  15.849  -0.711
 1668    HZ   PHE 101           HZ       PHE 101   6.369  15.261  -2.071
 1669    H    ILE 102           H        ILE 102   5.827  11.039   4.727
 1670    HA   ILE 102           HA       ILE 102   8.038   9.711   6.163
 1671    HB   ILE 102           HB       ILE 102   6.390   9.420   8.038
 1672   HG12  ILE 102          HG13      ILE 102   4.787  11.458   6.483
 1673   HG13  ILE 102          HG12      ILE 102   4.337   9.772   6.701
 1674   HG21  ILE 102          HG21      ILE 102   7.106  12.233   7.233
 1675   HG22  ILE 102          HG22      ILE 102   8.104  11.111   8.161
 1676   HG23  ILE 102          HG23      ILE 102   6.605  11.737   8.849
 1677   HD11  ILE 102          HD11      ILE 102   4.609  11.831   8.877
 1678   HD12  ILE 102          HD12      ILE 102   4.186  10.136   9.114
 1679   HD13  ILE 102          HD13      ILE 102   3.103  11.199   8.212
 1680    H    ARG 103           H        ARG 103   7.763   7.525   6.756
 1681    HA   ARG 103           HA       ARG 103   6.311   6.107   4.677
 1682    HB2  ARG 103           HB3      ARG 103   7.662   4.186   5.243
 1683    HB3  ARG 103           HB2      ARG 103   8.701   5.596   5.097
 1684    HG2  ARG 103           HG3      ARG 103   8.546   5.776   7.627
 1685    HG3  ARG 103           HG2      ARG 103   7.850   4.156   7.584
 1686    HD2  ARG 103           HD3      ARG 103  10.201   3.929   7.960
 1687    HD3  ARG 103           HD2      ARG 103   9.871   3.413   6.304
 1688    HE   ARG 103           HE       ARG 103  10.645   6.184   6.605
 1689   HH11  ARG 103          HH11      ARG 103  11.707   2.907   5.965
 1690   HH12  ARG 103          HH12      ARG 103  13.200   3.401   5.229
 1691   HH21  ARG 103          HH21      ARG 103  12.620   6.833   5.666
 1692   HH22  ARG 103          HH22      ARG 103  13.716   5.629   5.053
 1693    H    ILE 104           H        ILE 104   4.669   4.771   4.957
 1694    HA   ILE 104           HA       ILE 104   3.851   4.060   7.688
 1695    HB   ILE 104           HB       ILE 104   1.469   4.232   6.954
 1696   HG12  ILE 104          HG13      ILE 104   2.627   5.734   4.598
 1697   HG13  ILE 104          HG12      ILE 104   1.900   4.134   4.517
 1698   HG21  ILE 104          HG21      ILE 104   1.319   6.667   7.166
 1699   HG22  ILE 104          HG22      ILE 104   3.049   6.797   6.851
 1700   HG23  ILE 104          HG23      ILE 104   2.477   5.982   8.307
 1701   HD11  ILE 104          HD11      ILE 104   0.368   5.862   3.763
 1702   HD12  ILE 104          HD12      ILE 104   0.493   6.666   5.328
 1703   HD13  ILE 104          HD13      ILE 104  -0.237   5.064   5.213
 1704    H    ASP 105           H        ASP 105   2.778   2.072   7.886
 1705    HA   ASP 105           HA       ASP 105   3.609   0.006   6.144
 1706    HB2  ASP 105           HB3      ASP 105   1.522   0.063   8.345
 1707    HB3  ASP 105           HB2      ASP 105   1.984  -1.407   7.487
 1708    H    THR 106           H        THR 106   2.756  -0.640   4.280
 1709    HA   THR 106           HA       THR 106   0.290   0.680   3.418
 1710    HB   THR 106           HB       THR 106   2.154  -0.849   1.619
 1711    HG1  THR 106           HG1      THR 106   2.701   1.371   3.099
 1712   HG21  THR 106          HG21      THR 106   0.437   1.603   1.188
 1713   HG22  THR 106          HG22      THR 106   0.008  -0.038   0.706
 1714   HG23  THR 106          HG23      THR 106   1.388   0.766  -0.040
 1715    H    ALA 107           H        ALA 107   1.834  -2.529   3.193
 1716    HA   ALA 107           HA       ALA 107  -0.612  -3.908   3.681
 1717    HB1  ALA 107           HB1      ALA 107  -1.049  -3.258   1.364
 1718    HB2  ALA 107           HB2      ALA 107  -0.825  -5.002   1.499
 1719    HB3  ALA 107           HB3      ALA 107   0.476  -3.993   0.865
 1720    H    CYS 108           H        CYS 108  -0.290  -6.239   3.722
 1721    HA   CYS 108           HA       CYS 108   2.550  -6.930   4.018
 1722    HB2  CYS 108           HB3      CYS 108   1.198  -7.240   6.059
 1723    HB3  CYS 108           HB2      CYS 108   0.115  -8.318   5.176
 1724    H    VAL 109           H        VAL 109   3.416  -8.081   2.453
 1725    HA   VAL 109           HA       VAL 109   1.629  -9.584   0.669
 1726    HB   VAL 109           HB       VAL 109   3.382  -9.444  -1.020
 1727   HG11  VAL 109          HG11      VAL 109   1.777  -7.628  -0.924
 1728   HG12  VAL 109          HG12      VAL 109   3.360  -7.016  -1.403
 1729   HG13  VAL 109          HG13      VAL 109   2.783  -6.775   0.247
 1730   HG21  VAL 109          HG21      VAL 109   4.960  -7.876   1.021
 1731   HG22  VAL 109          HG22      VAL 109   5.417  -8.142  -0.662
 1732   HG23  VAL 109          HG23      VAL 109   5.335  -9.505   0.457
 1733    H    CYS 110           H        CYS 110   2.195 -11.688   0.021
 1734    HA   CYS 110           HA       CYS 110   3.937 -13.090   1.911
 1735    HB2  CYS 110           HB3      CYS 110   1.695 -14.019   1.684
 1736    HB3  CYS 110           HB2      CYS 110   1.884 -14.135  -0.057
 1737    H    VAL 111           H        VAL 111   5.994 -12.950   1.209
 1738    HA   VAL 111           HA       VAL 111   6.602 -12.938  -1.600
 1739    HB   VAL 111           HB       VAL 111   8.947 -12.822  -0.961
 1740   HG11  VAL 111          HG11      VAL 111   8.906 -10.753   0.351
 1741   HG12  VAL 111          HG12      VAL 111   7.218 -11.056   0.763
 1742   HG13  VAL 111          HG13      VAL 111   7.677 -10.757  -0.913
 1743   HG21  VAL 111          HG21      VAL 111   8.028 -13.206   1.884
 1744   HG22  VAL 111          HG22      VAL 111   9.676 -12.866   1.356
 1745   HG23  VAL 111          HG23      VAL 111   8.906 -14.391   0.917
 1746    H    LEU 112           H        LEU 112   7.308 -14.593  -2.852
 1747    HA   LEU 112           HA       LEU 112   7.332 -17.241  -1.579
 1748    HB2  LEU 112           HB3      LEU 112   6.791 -16.473  -4.454
 1749    HB3  LEU 112           HB2      LEU 112   6.856 -18.123  -3.856
 1750    HG   LEU 112           HG       LEU 112   4.822 -16.035  -3.036
 1751   HD11  LEU 112          HD11      LEU 112   4.490 -16.792  -5.316
 1752   HD12  LEU 112          HD12      LEU 112   3.243 -17.453  -4.260
 1753   HD13  LEU 112          HD13      LEU 112   4.578 -18.474  -4.792
 1754   HD21  LEU 112          HD21      LEU 112   5.271 -17.580  -1.218
 1755   HD22  LEU 112          HD22      LEU 112   5.064 -18.952  -2.307
 1756   HD23  LEU 112          HD23      LEU 112   3.692 -17.913  -1.927
 1757    H    SER 113           H        SER 113   9.062 -18.519  -1.750
 1758    HA   SER 113           HA       SER 113  11.141 -17.823  -3.704
 1759    HB2  SER 113           HB3      SER 113  12.843 -18.487  -1.945
 1760    HB3  SER 113           HB2      SER 113  11.997 -16.973  -1.623
 1761    HG   SER 113           HG       SER 113  10.520 -18.348  -0.326
 1762    H    ARG 114           H        ARG 114  12.303 -19.615  -4.508
 1763    HA   ARG 114           HA       ARG 114  10.698 -22.001  -4.604
 1764    HB2  ARG 114           HB3      ARG 114  11.912 -20.983  -6.558
 1765    HB3  ARG 114           HB2      ARG 114  13.418 -21.517  -5.829
 1766    HG2  ARG 114           HG3      ARG 114  12.694 -23.841  -6.014
 1767    HG3  ARG 114           HG2      ARG 114  11.166 -23.310  -6.722
 1768    HD2  ARG 114           HD3      ARG 114  13.902 -22.802  -7.890
 1769    HD3  ARG 114           HD2      ARG 114  12.783 -24.055  -8.426
 1770    HE   ARG 114           HE       ARG 114  11.233 -22.039  -8.840
 1771   HH11  ARG 114          HH11      ARG 114  14.710 -22.007  -9.247
 1772   HH12  ARG 114          HH12      ARG 114  14.678 -20.808 -10.498
 1773   HH21  ARG 114          HH21      ARG 114  11.189 -20.454 -10.492
 1774   HH22  ARG 114          HH22      ARG 114  12.677 -19.938 -11.216
 1775    H    LYS 115           H        LYS 115  12.614 -20.991  -2.290
 1776    HA   LYS 115           HA       LYS 115  13.508 -21.947  -0.450
 1777    HB2  LYS 115           HB3      LYS 115  12.877 -24.614  -1.738
 1778    HB3  LYS 115           HB2      LYS 115  13.358 -24.373  -0.065
 1779    HG2  LYS 115           HG3      LYS 115  11.273 -22.839   0.049
 1780    HG3  LYS 115           HG2      LYS 115  10.784 -23.693  -1.416
 1781    HD2  LYS 115           HD3      LYS 115  11.464 -24.972   1.222
 1782    HD3  LYS 115           HD2      LYS 115   9.842 -24.739   0.577
 1783    HE2  LYS 115           HE3      LYS 115  10.380 -26.184  -1.310
 1784    HE3  LYS 115           HE2      LYS 115  12.016 -26.395  -0.684
 1785    HZ1  LYS 115           HZ1      LYS 115   9.553 -27.182   0.768
 1786    HZ2  LYS 115           HZ2      LYS 115  11.148 -27.495   1.236
 1787    HZ3  LYS 115           HZ3      LYS 115  10.508 -28.247  -0.138
 1788    H    ALA 116           H        ALA 116  14.461 -23.822  -3.325
 1789    HA   ALA 116           HA       ALA 116  17.192 -24.024  -2.503
 1790    HB1  ALA 116           HB1      ALA 116  15.983 -24.341  -5.253
 1791    HB2  ALA 116           HB2      ALA 116  16.181 -25.628  -4.061
 1792    HB3  ALA 116           HB3      ALA 116  17.599 -24.848  -4.763
 1793    H    THR 117           H        THR 117  15.279 -21.761  -4.315
 1794    HA   THR 117           HA       THR 117  17.602 -19.974  -4.469
 1795    HB   THR 117           HB       THR 117  16.546 -19.011  -6.551
 1796    HG1  THR 117           HG1      THR 117  14.525 -19.815  -6.660
 1797   HG21  THR 117          HG21      THR 117  17.470 -21.881  -6.709
 1798   HG22  THR 117          HG22      THR 117  18.517 -20.464  -6.662
 1799   HG23  THR 117          HG23      THR 117  17.453 -20.727  -8.042
 1800    H    ARG 118           H        ARG 118  17.124 -17.741  -4.290
 1801    HA   ARG 118           HA       ARG 118  14.464 -16.850  -3.768
 1802    HB2  ARG 118           HB3      ARG 118  14.655 -16.190  -1.496
 1803    HB3  ARG 118           HB2      ARG 118  15.166 -17.861  -1.551
 1804    HG2  ARG 118           HG3      ARG 118  17.073 -15.537  -1.495
 1805    HG3  ARG 118           HG2      ARG 118  16.485 -16.353  -0.051
 1806    HD2  ARG 118           HD3      ARG 118  18.521 -17.392  -0.420
 1807    HD3  ARG 118           HD2      ARG 118  17.395 -18.499  -1.201
 1808    HE   ARG 118           HE       ARG 118  18.319 -16.604  -3.078
 1809   HH11  ARG 118          HH11      ARG 118  19.401 -19.408  -1.275
 1810   HH12  ARG 118          HH12      ARG 118  20.616 -19.841  -2.436
 1811   HH21  ARG 118          HH21      ARG 118  19.917 -17.184  -4.610
 1812   HH22  ARG 118          HH22      ARG 118  20.904 -18.584  -4.331
  Start of MODEL    7
    1    H1   SER   1           H1       SER   1  24.759  -9.219 -14.210
    2    H2   SER   1           H2       SER   1  25.670 -10.571 -14.658
    3    H3   SER   1           H3       SER   1  26.025  -9.750 -13.227
    4    HA   SER   1           HA       SER   1  23.959 -10.392 -12.256
    5    HB2  SER   1           HB3      SER   1  23.483 -11.897 -14.842
    6    HB3  SER   1           HB2      SER   1  22.409 -11.848 -13.445
    7    HG   SER   1           HG       SER   1  22.297 -10.267 -15.465
    8    H    SER   2           H        SER   2  25.641 -11.277 -10.985
    9    HA   SER   2           HA       SER   2  26.163 -14.116 -11.562
   10    HB2  SER   2           HB3      SER   2  28.353 -13.734 -10.290
   11    HB3  SER   2           HB2      SER   2  28.248 -13.040 -11.910
   12    HG   SER   2           HG       SER   2  29.066 -11.490 -10.518
   13    H    THR   3           H        THR   3  26.658 -11.901  -8.820
   14    HA   THR   3           HA       THR   3  25.912 -13.950  -6.949
   15    HB   THR   3           HB       THR   3  26.156 -11.979  -5.297
   16    HG1  THR   3           HG1      THR   3  25.982 -10.303  -6.865
   17   HG21  THR   3          HG21      THR   3  28.507 -12.836  -6.992
   18   HG22  THR   3          HG22      THR   3  27.860 -13.707  -5.602
   19   HG23  THR   3          HG23      THR   3  28.605 -12.125  -5.382
   20    H    HIS   4           H        HIS   4  23.850 -14.481  -6.676
   21    HA   HIS   4           HA       HIS   4  21.942 -12.388  -6.035
   22    HB2  HIS   4           HB3      HIS   4  20.225 -13.238  -7.582
   23    HB3  HIS   4           HB2      HIS   4  21.634 -12.653  -8.449
   24    HD1  HIS   4           HD1      HIS   4  23.271 -14.587  -9.401
   25    HD2  HIS   4           HD2      HIS   4  19.482 -15.799  -8.180
   26    HE1  HIS   4           HE1      HIS   4  22.905 -16.836 -10.458
   27    HE2  HIS   4           HE2      HIS   4  20.599 -17.541  -9.731
   28    HA   PRO   5           HA       PRO   5  21.055 -15.767  -3.211
   29    HB2  PRO   5           HB3      PRO   5  19.887 -14.315  -1.302
   30    HB3  PRO   5           HB2      PRO   5  21.629 -14.194  -1.588
   31    HG2  PRO   5           HG3      PRO   5  19.432 -12.348  -2.428
   32    HG3  PRO   5           HG2      PRO   5  21.048 -11.955  -1.822
   33    HD2  PRO   5           HD3      PRO   5  20.308 -11.977  -4.498
   34    HD3  PRO   5           HD2      PRO   5  21.975 -12.096  -3.901
   35    H    VAL   6           H        VAL   6  19.502 -16.031  -5.288
   36    HA   VAL   6           HA       VAL   6  17.429 -16.423  -6.157
   37    HB   VAL   6           HB       VAL   6  16.509 -16.631  -3.283
   38   HG11  VAL   6          HG11      VAL   6  14.704 -16.684  -4.901
   39   HG12  VAL   6          HG12      VAL   6  14.924 -18.281  -4.186
   40   HG13  VAL   6          HG13      VAL   6  15.527 -17.950  -5.810
   41   HG21  VAL   6          HG21      VAL   6  18.526 -17.961  -3.551
   42   HG22  VAL   6          HG22      VAL   6  17.839 -18.745  -4.974
   43   HG23  VAL   6          HG23      VAL   6  17.112 -19.005  -3.389
   44    H    PHE   7           H        PHE   7  17.814 -14.004  -6.561
   45    HA   PHE   7           HA       PHE   7  17.188 -11.836  -6.635
   46    HB2  PHE   7           HB3      PHE   7  14.533 -13.029  -5.814
   47    HB3  PHE   7           HB2      PHE   7  14.744 -11.341  -6.251
   48    HD1  PHE   7           HD1      PHE   7  14.750 -14.792  -7.503
   49    HD2  PHE   7           HD2      PHE   7  14.986 -10.671  -8.522
   50    HE1  PHE   7           HE1      PHE   7  14.366 -15.360  -9.861
   51    HE2  PHE   7           HE2      PHE   7  14.607 -11.228 -10.886
   52    HZ   PHE   7           HZ       PHE   7  14.295 -13.573 -11.558
   53    H    HIS   8           H        HIS   8  14.771 -12.068  -4.231
   54    HA   HIS   8           HA       HIS   8  16.600 -11.598  -2.010
   55    HB2  HIS   8           HB3      HIS   8  15.953  -9.353  -2.960
   56    HB3  HIS   8           HB2      HIS   8  14.275  -9.744  -2.613
   57    HD1  HIS   8           HD1      HIS   8  17.524  -8.921  -0.895
   58    HD2  HIS   8           HD2      HIS   8  13.487  -9.337   0.008
   59    HE1  HIS   8           HE1      HIS   8  17.253  -8.016   1.436
   60    HE2  HIS   8           HE2      HIS   8  14.772  -8.081   1.866
   61    H    MET   9           H        MET   9  14.485 -13.444  -3.282
   62    HA   MET   9           HA       MET   9  12.505 -14.482  -2.897
   63    HB2  MET   9           HB3      MET   9  12.542 -15.905  -0.913
   64    HB3  MET   9           HB2      MET   9  14.100 -15.876  -1.718
   65    HG2  MET   9           HG3      MET   9  14.913 -14.294  -0.015
   66    HG3  MET   9           HG2      MET   9  13.361 -14.416   0.808
   67    HE1  MET   9           HE1      MET   9  15.395 -17.278  -1.020
   68    HE2  MET   9           HE2      MET   9  16.339 -17.915   0.325
   69    HE3  MET   9           HE3      MET   9  16.630 -16.278  -0.260
   70    H    GLY  10           H        GLY  10  12.061 -11.850  -2.685
   71    HA2  GLY  10           HA3      GLY  10   9.886 -11.810  -0.701
   72    HA3  GLY  10           HA2      GLY  10  11.027 -10.472  -0.721
   73    H    GLU  11           H        GLU  11  11.107 -11.124  -3.773
   74    HA   GLU  11           HA       GLU  11   8.834  -9.402  -4.452
   75    HB2  GLU  11           HB3      GLU  11   9.998  -9.138  -6.651
   76    HB3  GLU  11           HB2      GLU  11  10.921  -8.555  -5.271
   77    HG2  GLU  11           HG3      GLU  11  11.352 -11.279  -6.465
   78    HG3  GLU  11           HG2      GLU  11  12.193  -9.842  -7.041
   79    H    PHE  12           H        PHE  12   9.164 -12.498  -4.036
   80    HA   PHE  12           HA       PHE  12   8.005 -13.467  -6.505
   81    HB2  PHE  12           HB3      PHE  12   8.568 -14.817  -3.856
   82    HB3  PHE  12           HB2      PHE  12   7.777 -15.626  -5.204
   83    HD1  PHE  12           HD1      PHE  12  10.912 -13.847  -4.279
   84    HD2  PHE  12           HD2      PHE  12   9.021 -16.658  -6.857
   85    HE1  PHE  12           HE1      PHE  12  13.098 -14.454  -5.220
   86    HE2  PHE  12           HE2      PHE  12  11.207 -17.270  -7.798
   87    HZ   PHE  12           HZ       PHE  12  13.249 -16.170  -6.980
   88    H    SER  13           H        SER  13   6.306 -11.838  -6.309
   89    HA   SER  13           HA       SER  13   4.329 -12.063  -4.262
   90    HB2  SER  13           HB3      SER  13   3.074 -10.489  -5.854
   91    HB3  SER  13           HB2      SER  13   4.620  -9.911  -5.246
   92    HG   SER  13           HG       SER  13   4.736 -11.378  -7.591
   93    H    VAL  14           H        VAL  14   2.528 -13.271  -4.232
   94    HA   VAL  14           HA       VAL  14   2.092 -15.406  -5.982
   95    HB   VAL  14           HB       VAL  14  -0.146 -15.606  -4.931
   96   HG11  VAL  14          HG11      VAL  14   2.121 -15.061  -3.018
   97   HG12  VAL  14          HG12      VAL  14   1.776 -16.588  -3.828
   98   HG13  VAL  14          HG13      VAL  14   0.649 -15.950  -2.631
   99   HG21  VAL  14          HG21      VAL  14   0.599 -13.062  -3.490
  100   HG22  VAL  14          HG22      VAL  14  -0.820 -14.059  -3.178
  101   HG23  VAL  14          HG23      VAL  14  -0.655 -13.220  -4.720
  102    H    CYS  15           H        CYS  15   1.129 -12.112  -6.144
  103    HA   CYS  15           HA       CYS  15  -0.142 -12.614  -8.741
  104    HB2  CYS  15           HB3      CYS  15  -0.940 -10.490  -6.727
  105    HB3  CYS  15           HB2      CYS  15  -1.669 -10.743  -8.315
  106    H    ASP  16           H        ASP  16   1.044 -11.718 -10.301
  107    HA   ASP  16           HA       ASP  16   3.326 -10.189  -9.882
  108    HB2  ASP  16           HB3      ASP  16   1.600 -10.394 -12.364
  109    HB3  ASP  16           HB2      ASP  16   3.191  -9.640 -12.329
  110    H    SER  17           H        SER  17   3.575  -8.188  -9.214
  111    HA   SER  17           HA       SER  17   1.494  -6.208  -9.846
  112    HB2  SER  17           HB3      SER  17   3.010  -6.465  -7.232
  113    HB3  SER  17           HB2      SER  17   1.787  -5.248  -7.609
  114    HG   SER  17           HG       SER  17   1.339  -8.059  -7.569
  115    H    VAL  18           H        VAL  18   2.203  -4.063 -10.131
  116    HA   VAL  18           HA       VAL  18   5.116  -3.789 -10.494
  117    HB   VAL  18           HB       VAL  18   4.021  -3.939 -12.660
  118   HG11  VAL  18          HG11      VAL  18   2.377  -1.583 -11.758
  119   HG12  VAL  18          HG12      VAL  18   1.795  -3.219 -12.068
  120   HG13  VAL  18          HG13      VAL  18   2.412  -2.237 -13.395
  121   HG21  VAL  18          HG21      VAL  18   5.954  -2.491 -12.499
  122   HG22  VAL  18          HG22      VAL  18   4.928  -1.136 -12.027
  123   HG23  VAL  18          HG23      VAL  18   4.792  -1.825 -13.644
  124    H    SER  19           H        SER  19   6.062  -2.071  -9.547
  125    HA   SER  19           HA       SER  19   4.372  -0.238  -8.038
  126    HB2  SER  19           HB3      SER  19   7.390  -0.535  -8.045
  127    HB3  SER  19           HB2      SER  19   6.437   0.413  -6.901
  128    HG   SER  19           HG       SER  19   5.509  -1.488  -6.139
  129    H    VAL  20           H        VAL  20   3.944   1.773  -8.691
  130    HA   VAL  20           HA       VAL  20   5.555   2.892 -10.894
  131    HB   VAL  20           HB       VAL  20   2.561   3.145 -10.594
  132   HG11  VAL  20          HG11      VAL  20   3.543   5.065 -11.683
  133   HG12  VAL  20          HG12      VAL  20   2.648   4.098 -12.854
  134   HG13  VAL  20          HG13      VAL  20   4.409   4.016 -12.807
  135   HG21  VAL  20          HG21      VAL  20   2.398   1.683 -12.549
  136   HG22  VAL  20          HG22      VAL  20   3.160   0.864 -11.185
  137   HG23  VAL  20          HG23      VAL  20   4.147   1.457 -12.521
  138    H    TRP  21           H        TRP  21   6.130   4.991 -10.689
  139    HA   TRP  21           HA       TRP  21   5.011   6.506  -8.436
  140    HB2  TRP  21           HB3      TRP  21   7.515   6.971 -10.081
  141    HB3  TRP  21           HB2      TRP  21   6.940   8.059  -8.823
  142    HD1  TRP  21           HD1      TRP  21   8.687   4.710  -9.321
  143    HE1  TRP  21           HE1      TRP  21   9.635   3.913  -7.070
  144    HE3  TRP  21           HE3      TRP  21   6.518   8.187  -6.248
  145    HZ2  TRP  21           HZ2      TRP  21   9.483   4.653  -4.351
  146    HZ3  TRP  21           HZ3      TRP  21   6.975   8.066  -3.831
  147    HH2  TRP  21           HH2      TRP  21   8.426   6.337  -2.905
  148    H    VAL  22           H        VAL  22   3.153   7.317  -9.213
  149    HA   VAL  22           HA       VAL  22   2.985   8.365 -11.908
  150    HB   VAL  22           HB       VAL  22   0.897   8.354  -9.720
  151   HG11  VAL  22          HG11      VAL  22   0.664   8.796 -12.691
  152   HG12  VAL  22          HG12      VAL  22   0.388   9.987 -11.419
  153   HG13  VAL  22          HG13      VAL  22  -0.697   8.607 -11.586
  154   HG21  VAL  22          HG21      VAL  22  -0.020   6.384 -10.842
  155   HG22  VAL  22          HG22      VAL  22   1.617   6.089 -10.254
  156   HG23  VAL  22          HG23      VAL  22   1.336   6.394 -11.969
  157    H    GLY  23           H        GLY  23   3.838  10.334 -12.251
  158    HA2  GLY  23           HA3      GLY  23   3.593  12.370 -10.148
  159    HA3  GLY  23           HA2      GLY  23   4.678  12.446 -11.535
  160    H    ASP  24           H        ASP  24   1.469  11.423 -12.124
  161    HA   ASP  24           HA       ASP  24   0.180  13.892 -12.524
  162    HB2  ASP  24           HB3      ASP  24   1.872  14.133 -14.332
  163    HB3  ASP  24           HB2      ASP  24   1.295  12.628 -15.046
  164    H    LYS  25           H        LYS  25  -1.423  12.621 -11.494
  165    HA   LYS  25           HA       LYS  25  -2.353  10.222 -12.849
  166    HB2  LYS  25           HB3      LYS  25  -2.060  10.412 -10.332
  167    HB3  LYS  25           HB2      LYS  25  -3.482  11.446 -10.332
  168    HG2  LYS  25           HG3      LYS  25  -4.809   9.630 -11.281
  169    HG3  LYS  25           HG2      LYS  25  -3.386   8.587 -11.278
  170    HD2  LYS  25           HD3      LYS  25  -3.253   8.881  -8.816
  171    HD3  LYS  25           HD2      LYS  25  -4.756   9.795  -8.883
  172    HE2  LYS  25           HE3      LYS  25  -4.356   6.894  -9.631
  173    HE3  LYS  25           HE2      LYS  25  -5.260   7.528  -8.255
  174    HZ1  LYS  25           HZ1      LYS  25  -5.963   7.769 -11.125
  175    HZ2  LYS  25           HZ2      LYS  25  -6.754   8.620  -9.901
  176    HZ3  LYS  25           HZ3      LYS  25  -6.810   6.933  -9.926
  177    H    THR  26           H        THR  26  -3.106  13.508 -12.718
  178    HA   THR  26           HA       THR  26  -4.653  14.858 -13.595
  179    HB   THR  26           HB       THR  26  -5.952  14.198 -15.536
  180    HG1  THR  26           HG1      THR  26  -5.059  11.563 -14.901
  181   HG21  THR  26          HG21      THR  26  -3.132  13.139 -15.540
  182   HG22  THR  26          HG22      THR  26  -3.640  14.793 -15.883
  183   HG23  THR  26          HG23      THR  26  -4.082  13.488 -16.982
  184    H    THR  27           H        THR  27  -6.308  11.748 -12.981
  185    HA   THR  27           HA       THR  27  -8.318  13.280 -11.491
  186    HB   THR  27           HB       THR  27  -9.988  11.505 -12.409
  187    HG1  THR  27           HG1      THR  27  -8.302  11.649 -14.681
  188   HG21  THR  27          HG21      THR  27 -10.577  12.990 -14.270
  189   HG22  THR  27          HG22      THR  27  -9.012  13.790 -14.121
  190   HG23  THR  27          HG23      THR  27 -10.187  13.899 -12.809
  191    H    ALA  28           H        ALA  28  -9.138  12.299  -9.692
  192    HA   ALA  28           HA       ALA  28  -8.571   9.493  -9.208
  193    HB1  ALA  28           HB1      ALA  28  -6.552  10.672  -8.429
  194    HB2  ALA  28           HB2      ALA  28  -7.411   9.835  -7.137
  195    HB3  ALA  28           HB3      ALA  28  -7.556  11.586  -7.305
  196    H    THR  29           H        THR  29  -9.699   8.668  -7.341
  197    HA   THR  29           HA       THR  29 -12.193  10.144  -6.959
  198    HB   THR  29           HB       THR  29 -11.607   7.222  -6.459
  199    HG1  THR  29           HG1      THR  29 -12.168   8.633  -8.733
  200   HG21  THR  29          HG21      THR  29 -14.221   8.735  -6.536
  201   HG22  THR  29          HG22      THR  29 -13.449   8.078  -5.091
  202   HG23  THR  29          HG23      THR  29 -14.045   6.990  -6.346
  203    H    ASP  30           H        ASP  30 -12.534  11.151  -5.157
  204    HA   ASP  30           HA       ASP  30 -10.892  10.892  -2.831
  205    HB2  ASP  30           HB3      ASP  30 -11.901  13.043  -3.446
  206    HB3  ASP  30           HB2      ASP  30 -13.516  12.353  -3.290
  207    H    ILE  31           H        ILE  31 -11.842  10.495  -0.648
  208    HA   ILE  31           HA       ILE  31 -12.839   7.906  -0.433
  209    HB   ILE  31           HB       ILE  31 -11.563   8.989   1.346
  210   HG12  ILE  31          HG13      ILE  31 -14.334   8.229   2.304
  211   HG13  ILE  31          HG12      ILE  31 -13.046   7.089   1.924
  212   HG21  ILE  31          HG21      ILE  31 -12.590  10.657   2.817
  213   HG22  ILE  31          HG22      ILE  31 -14.013  10.694   1.775
  214   HG23  ILE  31          HG23      ILE  31 -12.454  11.241   1.157
  215   HD11  ILE  31          HD11      ILE  31 -11.690   8.041   3.722
  216   HD12  ILE  31          HD12      ILE  31 -13.236   7.430   4.316
  217   HD13  ILE  31          HD13      ILE  31 -12.994   9.164   4.103
  218    H    LYS  32           H        LYS  32 -14.544  10.890  -0.862
  219    HA   LYS  32           HA       LYS  32 -17.079   9.876   0.092
  220    HB2  LYS  32           HB3      LYS  32 -16.511  12.334  -1.564
  221    HB3  LYS  32           HB2      LYS  32 -17.981  11.997  -0.654
  222    HG2  LYS  32           HG3      LYS  32 -16.768  12.153   1.423
  223    HG3  LYS  32           HG2      LYS  32 -15.249  12.370   0.553
  224    HD2  LYS  32           HD3      LYS  32 -16.511  14.372  -0.543
  225    HD3  LYS  32           HD2      LYS  32 -17.533  14.259   0.891
  226    HE2  LYS  32           HE3      LYS  32 -15.825  15.821   1.399
  227    HE3  LYS  32           HE2      LYS  32 -15.428  14.335   2.261
  228    HZ1  LYS  32           HZ1      LYS  32 -13.448  15.134   1.262
  229    HZ2  LYS  32           HZ2      LYS  32 -14.199  15.353  -0.235
  230    HZ3  LYS  32           HZ3      LYS  32 -13.928  13.786   0.347
  231    H    GLY  33           H        GLY  33 -15.279   9.262  -2.592
  232    HA2  GLY  33           HA3      GLY  33 -15.912   7.916  -4.396
  233    HA3  GLY  33           HA2      GLY  33 -17.602   8.255  -4.030
  234    H    LYS  34           H        LYS  34 -15.503  10.944  -4.136
  235    HA   LYS  34           HA       LYS  34 -16.867  11.883  -6.533
  236    HB2  LYS  34           HB3      LYS  34 -15.084  13.345  -4.585
  237    HB3  LYS  34           HB2      LYS  34 -15.960  14.089  -5.911
  238    HG2  LYS  34           HG3      LYS  34 -17.190  12.706  -3.537
  239    HG3  LYS  34           HG2      LYS  34 -17.082  14.446  -3.786
  240    HD2  LYS  34           HD3      LYS  34 -18.432  14.200  -5.837
  241    HD3  LYS  34           HD2      LYS  34 -18.607  12.480  -5.487
  242    HE2  LYS  34           HE3      LYS  34 -19.753  12.994  -3.412
  243    HE3  LYS  34           HE2      LYS  34 -19.500  14.715  -3.676
  244    HZ1  LYS  34           HZ1      LYS  34 -21.730  14.075  -4.297
  245    HZ2  LYS  34           HZ2      LYS  34 -21.138  12.912  -5.371
  246    HZ3  LYS  34           HZ3      LYS  34 -20.870  14.551  -5.676
  247    H    GLU  35           H        GLU  35 -15.905  12.081  -8.447
  248    HA   GLU  35           HA       GLU  35 -13.101  11.382  -8.726
  249    HB2  GLU  35           HB3      GLU  35 -14.943  10.579 -10.286
  250    HB3  GLU  35           HB2      GLU  35 -15.041  12.228 -10.881
  251    HG2  GLU  35           HG3      GLU  35 -13.678  11.195 -12.425
  252    HG3  GLU  35           HG2      GLU  35 -12.526  11.978 -11.352
  253    H    VAL  36           H        VAL  36 -11.594  12.920  -8.539
  254    HA   VAL  36           HA       VAL  36 -12.351  15.681  -9.220
  255    HB   VAL  36           HB       VAL  36 -10.858  16.455  -7.400
  256   HG11  VAL  36          HG11      VAL  36 -12.352  15.866  -5.543
  257   HG12  VAL  36          HG12      VAL  36 -13.075  14.604  -6.542
  258   HG13  VAL  36          HG13      VAL  36 -13.244  16.300  -7.001
  259   HG21  VAL  36          HG21      VAL  36  -9.417  14.484  -7.254
  260   HG22  VAL  36          HG22      VAL  36 -10.770  13.543  -6.623
  261   HG23  VAL  36          HG23      VAL  36 -10.119  14.889  -5.687
  262    H    THR  37           H        THR  37 -10.634  17.091  -9.836
  263    HA   THR  37           HA       THR  37  -8.703  15.788 -11.536
  264    HB   THR  37           HB       THR  37  -9.061  18.746 -11.048
  265    HG1  THR  37           HG1      THR  37 -10.592  16.909 -12.475
  266   HG21  THR  37          HG21      THR  37  -6.993  18.136 -12.201
  267   HG22  THR  37          HG22      THR  37  -8.100  18.959 -13.298
  268   HG23  THR  37          HG23      THR  37  -7.915  17.207 -13.384
  269    H    VAL  38           H        VAL  38  -6.753  15.251 -10.870
  270    HA   VAL  38           HA       VAL  38  -5.727  16.280  -8.357
  271    HB   VAL  38           HB       VAL  38  -4.628  14.147 -10.201
  272   HG11  VAL  38          HG11      VAL  38  -2.862  15.163  -8.869
  273   HG12  VAL  38          HG12      VAL  38  -3.201  13.524  -8.308
  274   HG13  VAL  38          HG13      VAL  38  -3.807  14.910  -7.401
  275   HG21  VAL  38          HG21      VAL  38  -6.773  13.541  -9.200
  276   HG22  VAL  38          HG22      VAL  38  -6.130  13.904  -7.598
  277   HG23  VAL  38          HG23      VAL  38  -5.460  12.570  -8.537
  278    H    LEU  39           H        LEU  39  -4.158  17.746  -8.175
  279    HA   LEU  39           HA       LEU  39  -2.998  18.861 -10.594
  280    HB2  LEU  39           HB3      LEU  39  -2.664  19.698  -7.705
  281    HB3  LEU  39           HB2      LEU  39  -2.109  20.596  -9.108
  282    HG   LEU  39           HG       LEU  39  -4.995  20.041  -8.418
  283   HD11  LEU  39          HD11      LEU  39  -3.378  22.576  -8.235
  284   HD12  LEU  39          HD12      LEU  39  -3.960  21.615  -6.876
  285   HD13  LEU  39          HD13      LEU  39  -5.110  22.432  -7.933
  286   HD21  LEU  39          HD21      LEU  39  -4.666  20.194 -10.813
  287   HD22  LEU  39          HD22      LEU  39  -3.766  21.696 -10.614
  288   HD23  LEU  39          HD23      LEU  39  -5.483  21.636 -10.216
  289    H    ALA  40           H        ALA  40  -1.232  17.939 -11.374
  290    HA   ALA  40           HA       ALA  40   0.464  16.198  -9.930
  291    HB1  ALA  40           HB1      ALA  40   1.016  17.675 -12.502
  292    HB2  ALA  40           HB2      ALA  40   0.224  16.105 -12.371
  293    HB3  ALA  40           HB3      ALA  40   1.909  16.284 -11.889
  294    H    GLU  41           H        GLU  41   0.461  19.593 -10.612
  295    HA   GLU  41           HA       GLU  41   2.799  19.931  -8.867
  296    HB2  GLU  41           HB3      GLU  41   1.744  21.796 -11.003
  297    HB3  GLU  41           HB2      GLU  41   3.152  22.089  -9.990
  298    HG2  GLU  41           HG3      GLU  41   4.333  20.266 -10.989
  299    HG3  GLU  41           HG2      GLU  41   2.896  19.766 -11.881
  300    H    VAL  42           H        VAL  42   2.258  20.626  -6.908
  301    HA   VAL  42           HA       VAL  42  -0.450  21.639  -6.538
  302    HB   VAL  42           HB       VAL  42  -0.174  21.161  -4.167
  303   HG11  VAL  42          HG11      VAL  42   0.027  18.741  -4.290
  304   HG12  VAL  42          HG12      VAL  42   0.779  18.873  -5.880
  305   HG13  VAL  42          HG13      VAL  42  -0.898  19.366  -5.655
  306   HG21  VAL  42          HG21      VAL  42   2.201  21.712  -3.940
  307   HG22  VAL  42          HG22      VAL  42   2.623  20.259  -4.847
  308   HG23  VAL  42          HG23      VAL  42   1.834  20.119  -3.278
  309    H    ASN  43           H        ASN  43  -0.956  23.561  -5.703
  310    HA   ASN  43           HA       ASN  43   1.209  25.524  -5.471
  311    HB2  ASN  43           HB3      ASN  43  -1.777  25.874  -5.884
  312    HB3  ASN  43           HB2      ASN  43  -0.643  27.207  -5.681
  313   HD21  ASN  43          HD21      ASN  43  -1.718  24.653  -7.794
  314   HD22  ASN  43          HD22      ASN  43  -0.923  25.225  -9.216
  315    H    ILE  44           H        ILE  44   1.917  25.413  -3.401
  316    HA   ILE  44           HA       ILE  44  -0.114  25.526  -1.269
  317    HB   ILE  44           HB       ILE  44   2.811  24.801  -0.987
  318   HG12  ILE  44          HG13      ILE  44   0.379  22.995  -1.047
  319   HG13  ILE  44          HG12      ILE  44   1.571  23.138  -2.337
  320   HG21  ILE  44          HG21      ILE  44   1.791  25.721   1.039
  321   HG22  ILE  44          HG22      ILE  44   2.161  24.008   1.229
  322   HG23  ILE  44          HG23      ILE  44   0.500  24.525   0.935
  323   HD11  ILE  44          HD11      ILE  44   1.961  21.142  -1.022
  324   HD12  ILE  44          HD12      ILE  44   2.080  22.108   0.448
  325   HD13  ILE  44          HD13      ILE  44   3.295  22.278  -0.819
  326    H    ASN  45           H        ASN  45  -0.488  27.732  -1.464
  327    HA   ASN  45           HA       ASN  45  -0.270  29.923  -0.956
  328    HB2  ASN  45           HB3      ASN  45   0.370  29.051   1.280
  329    HB3  ASN  45           HB2      ASN  45   2.054  29.019   0.770
  330   HD21  ASN  45          HD21      ASN  45  -0.283  31.560   0.003
  331   HD22  ASN  45          HD22      ASN  45   0.510  32.796   0.912
  332    H    ASN  46           H        ASN  46   0.480  29.689  -3.307
  333    HA   ASN  46           HA       ASN  46   1.638  30.664  -4.997
  334    HB2  ASN  46           HB3      ASN  46   3.059  32.225  -2.830
  335    HB3  ASN  46           HB2      ASN  46   2.999  32.632  -4.538
  336   HD21  ASN  46          HD21      ASN  46   1.058  33.415  -5.419
  337   HD22  ASN  46          HD22      ASN  46  -0.194  34.058  -4.411
  338    H    SER  47           H        SER  47   2.736  28.311  -3.421
  339    HA   SER  47           HA       SER  47   5.418  28.389  -4.614
  340    HB2  SER  47           HB3      SER  47   5.534  28.594  -2.117
  341    HB3  SER  47           HB2      SER  47   4.707  27.043  -1.988
  342    HG   SER  47           HG       SER  47   6.836  26.571  -1.869
  343    H    VAL  48           H        VAL  48   5.592  26.888  -6.138
  344    HA   VAL  48           HA       VAL  48   3.585  24.755  -6.204
  345    HB   VAL  48           HB       VAL  48   5.364  25.722  -8.444
  346   HG11  VAL  48          HG11      VAL  48   4.581  23.442  -8.749
  347   HG12  VAL  48          HG12      VAL  48   3.802  24.531  -9.895
  348   HG13  VAL  48          HG13      VAL  48   2.918  23.964  -8.477
  349   HG21  VAL  48          HG21      VAL  48   2.497  26.423  -7.839
  350   HG22  VAL  48          HG22      VAL  48   3.375  26.872  -9.300
  351   HG23  VAL  48          HG23      VAL  48   3.883  27.508  -7.735
  352    H    PHE  49           H        PHE  49   4.116  22.705  -5.948
  353    HA   PHE  49           HA       PHE  49   6.838  21.804  -6.591
  354    HB2  PHE  49           HB3      PHE  49   5.302  21.124  -4.067
  355    HB3  PHE  49           HB2      PHE  49   6.729  20.248  -4.607
  356    HD1  PHE  49           HD1      PHE  49   5.517  22.968  -2.685
  357    HD2  PHE  49           HD2      PHE  49   8.877  21.619  -4.917
  358    HE1  PHE  49           HE1      PHE  49   6.959  24.559  -1.476
  359    HE2  PHE  49           HE2      PHE  49  10.321  23.208  -3.719
  360    HZ   PHE  49           HZ       PHE  49   9.362  24.678  -1.994
  361    H    ARG  50           H        ARG  50   6.838  19.917  -7.774
  362    HA   ARG  50           HA       ARG  50   4.240  18.854  -8.464
  363    HB2  ARG  50           HB3      ARG  50   5.236  17.733 -10.244
  364    HB3  ARG  50           HB2      ARG  50   6.164  19.216 -10.122
  365    HG2  ARG  50           HG3      ARG  50   7.972  18.045  -9.045
  366    HG3  ARG  50           HG2      ARG  50   7.024  16.557  -9.003
  367    HD2  ARG  50           HD3      ARG  50   6.913  16.631 -11.485
  368    HD3  ARG  50           HD2      ARG  50   8.002  18.017 -11.452
  369    HE   ARG  50           HE       ARG  50   9.273  16.038 -10.023
  370   HH11  ARG  50          HH11      ARG  50   8.038  16.412 -13.280
  371   HH12  ARG  50          HH12      ARG  50   9.207  15.339 -13.978
  372   HH21  ARG  50          HH21      ARG  50  10.804  14.636 -10.938
  373   HH22  ARG  50          HH22      ARG  50  10.787  14.329 -12.646
  374    H    GLN  51           H        GLN  51   3.575  16.718  -8.190
  375    HA   GLN  51           HA       GLN  51   4.868  15.451  -5.865
  376    HB2  GLN  51           HB3      GLN  51   1.918  15.734  -6.467
  377    HB3  GLN  51           HB2      GLN  51   2.591  14.828  -5.118
  378    HG2  GLN  51           HG3      GLN  51   2.891  17.789  -5.578
  379    HG3  GLN  51           HG2      GLN  51   1.803  17.022  -4.417
  380   HE21  GLN  51          HE21      GLN  51   4.039  18.907  -4.026
  381   HE22  GLN  51          HE22      GLN  51   5.114  18.125  -2.915
  382    H    TYR  52           H        TYR  52   4.619  13.193  -5.636
  383    HA   TYR  52           HA       TYR  52   3.934  11.771  -8.125
  384    HB2  TYR  52           HB3      TYR  52   5.995  10.791  -6.146
  385    HB3  TYR  52           HB2      TYR  52   5.754  10.280  -7.811
  386    HD1  TYR  52           HD1      TYR  52   6.567  11.704  -9.673
  387    HD2  TYR  52           HD2      TYR  52   7.294  12.717  -5.604
  388    HE1  TYR  52           HE1      TYR  52   8.318  13.281 -10.379
  389    HE2  TYR  52           HE2      TYR  52   9.042  14.295  -6.301
  390    HH   TYR  52           HH       TYR  52  10.493  14.738  -8.140
  391    H    PHE  53           H        PHE  53   2.935   9.737  -7.865
  392    HA   PHE  53           HA       PHE  53   2.053   9.105  -5.122
  393    HB2  PHE  53           HB3      PHE  53   0.501   8.665  -7.691
  394    HB3  PHE  53           HB2      PHE  53  -0.052   8.266  -6.067
  395    HD1  PHE  53           HD1      PHE  53  -0.336  10.164  -4.410
  396    HD2  PHE  53           HD2      PHE  53   0.134  10.780  -8.592
  397    HE1  PHE  53           HE1      PHE  53  -1.285  12.422  -4.179
  398    HE2  PHE  53           HE2      PHE  53  -0.816  13.038  -8.373
  399    HZ   PHE  53           HZ       PHE  53  -1.523  13.862  -6.164
  400    H    PHE  54           H        PHE  54   2.722   7.188  -4.420
  401    HA   PHE  54           HA       PHE  54   4.005   5.363  -6.262
  402    HB2  PHE  54           HB3      PHE  54   5.089   5.831  -4.110
  403    HB3  PHE  54           HB2      PHE  54   3.671   5.240  -3.249
  404    HD1  PHE  54           HD1      PHE  54   3.449   2.958  -2.732
  405    HD2  PHE  54           HD2      PHE  54   6.384   4.207  -5.551
  406    HE1  PHE  54           HE1      PHE  54   4.407   0.695  -2.732
  407    HE2  PHE  54           HE2      PHE  54   7.346   1.945  -5.555
  408    HZ   PHE  54           HZ       PHE  54   6.357   0.184  -4.146
  409    H    GLU  55           H        GLU  55   2.583   4.234  -7.433
  410    HA   GLU  55           HA       GLU  55   0.406   2.850  -6.032
  411    HB2  GLU  55           HB3      GLU  55   0.937   3.195  -8.993
  412    HB3  GLU  55           HB2      GLU  55  -0.356   2.207  -8.335
  413    HG2  GLU  55           HG3      GLU  55  -1.075   4.422  -7.156
  414    HG3  GLU  55           HG2      GLU  55  -0.091   5.178  -8.418
  415    H    THR  56           H        THR  56   0.049   0.619  -6.518
  416    HA   THR  56           HA       THR  56   2.228  -0.821  -7.805
  417    HB   THR  56           HB       THR  56   1.067  -1.718  -5.152
  418    HG1  THR  56           HG1      THR  56   2.848   0.086  -5.476
  419   HG21  THR  56          HG21      THR  56   2.800  -3.466  -5.276
  420   HG22  THR  56          HG22      THR  56   3.251  -2.893  -6.883
  421   HG23  THR  56          HG23      THR  56   1.652  -3.582  -6.609
  422    H    LYS  57           H        LYS  57   1.186  -1.547  -9.503
  423    HA   LYS  57           HA       LYS  57  -1.707  -1.981  -9.267
  424    HB2  LYS  57           HB3      LYS  57  -0.117  -1.532 -11.800
  425    HB3  LYS  57           HB2      LYS  57  -1.855  -1.352 -11.574
  426    HG2  LYS  57           HG3      LYS  57  -1.449   0.565 -10.090
  427    HG3  LYS  57           HG2      LYS  57   0.282   0.398 -10.363
  428    HD2  LYS  57           HD3      LYS  57  -0.333   2.071 -11.850
  429    HD3  LYS  57           HD2      LYS  57  -0.321   0.624 -12.858
  430    HE2  LYS  57           HE3      LYS  57  -2.289   1.948 -13.322
  431    HE3  LYS  57           HE2      LYS  57  -2.747   0.426 -12.566
  432    HZ1  LYS  57           HZ1      LYS  57  -3.105   1.529 -10.504
  433    HZ2  LYS  57           HZ2      LYS  57  -3.929   2.409 -11.686
  434    HZ3  LYS  57           HZ3      LYS  57  -2.454   2.985 -11.076
  435    H    CYS  58           H        CYS  58  -2.669  -3.778 -10.297
  436    HA   CYS  58           HA       CYS  58  -0.973  -6.095 -10.045
  437    HB2  CYS  58           HB3      CYS  58  -3.478  -5.743  -9.273
  438    HB3  CYS  58           HB2      CYS  58  -3.826  -6.298 -10.904
  439    H    ARG  59           H        ARG  59   0.143  -6.853 -11.650
  440    HA   ARG  59           HA       ARG  59  -0.364  -6.160 -14.388
  441    HB2  ARG  59           HB3      ARG  59   1.594  -8.048 -13.076
  442    HB3  ARG  59           HB2      ARG  59   1.545  -7.759 -14.806
  443    HG2  ARG  59           HG3      ARG  59   2.158  -5.467 -14.503
  444    HG3  ARG  59           HG2      ARG  59   2.015  -5.613 -12.752
  445    HD2  ARG  59           HD3      ARG  59   4.366  -5.704 -13.647
  446    HD3  ARG  59           HD2      ARG  59   3.891  -7.065 -12.633
  447    HE   ARG  59           HE       ARG  59   3.682  -7.322 -15.548
  448   HH11  ARG  59          HH11      ARG  59   5.331  -8.173 -12.568
  449   HH12  ARG  59          HH12      ARG  59   6.056  -9.604 -13.227
  450   HH21  ARG  59          HH21      ARG  59   4.665  -9.194 -16.425
  451   HH22  ARG  59          HH22      ARG  59   5.677 -10.186 -15.422
  452    H    ALA  60           H        ALA  60  -0.923  -8.912 -12.302
  453    HA   ALA  60           HA       ALA  60  -2.469 -10.175 -14.451
  454    HB1  ALA  60           HB1      ALA  60  -0.543 -11.649 -12.653
  455    HB2  ALA  60           HB2      ALA  60  -0.279 -11.289 -14.358
  456    HB3  ALA  60           HB3      ALA  60  -1.585 -12.371 -13.878
  457    H    SER  61           H        SER  61  -4.487 -10.227 -13.748
  458    HA   SER  61           HA       SER  61  -5.223 -10.156 -11.002
  459    HB2  SER  61           HB3      SER  61  -6.625  -9.241 -12.859
  460    HB3  SER  61           HB2      SER  61  -6.940 -10.894 -13.388
  461    HG   SER  61           HG       SER  61  -7.758 -11.208 -11.163
  462    H    ASN  62           H        ASN  62  -4.591 -12.653 -13.299
  463    HA   ASN  62           HA       ASN  62  -4.658 -14.611 -11.156
  464    HB2  ASN  62           HB3      ASN  62  -6.358 -14.800 -13.629
  465    HB3  ASN  62           HB2      ASN  62  -5.712 -16.266 -12.901
  466   HD21  ASN  62          HD21      ASN  62  -6.351 -16.806 -10.772
  467   HD22  ASN  62          HD22      ASN  62  -7.828 -16.203 -10.106
  468    HA   PRO  63           HA       PRO  63  -0.745 -14.633 -13.573
  469    HB2  PRO  63           HB3      PRO  63  -0.003 -16.231 -11.174
  470    HB3  PRO  63           HB2      PRO  63   0.858 -14.894 -11.948
  471    HG2  PRO  63           HG3      PRO  63  -0.472 -14.552  -9.648
  472    HG3  PRO  63           HG2      PRO  63  -0.415 -13.284 -10.883
  473    HD2  PRO  63           HD3      PRO  63  -2.646 -15.118 -10.149
  474    HD3  PRO  63           HD2      PRO  63  -2.706 -13.444 -10.745
  475    H    VAL  64           H        VAL  64  -2.260 -17.368 -11.887
  476    HA   VAL  64           HA       VAL  64  -1.367 -19.091 -14.098
  477    HB   VAL  64           HB       VAL  64  -1.512 -21.015 -12.557
  478   HG11  VAL  64          HG11      VAL  64   0.315 -18.810 -11.611
  479   HG12  VAL  64          HG12      VAL  64   0.645 -19.962 -12.907
  480   HG13  VAL  64          HG13      VAL  64   0.504 -20.524 -11.242
  481   HG21  VAL  64          HG21      VAL  64  -1.974 -18.928 -10.436
  482   HG22  VAL  64          HG22      VAL  64  -1.654 -20.638 -10.138
  483   HG23  VAL  64          HG23      VAL  64  -3.127 -20.149 -10.974
  484    H    GLU  65           H        GLU  65  -2.891 -20.810 -14.688
  485    HA   GLU  65           HA       GLU  65  -5.516 -19.630 -14.871
  486    HB2  GLU  65           HB3      GLU  65  -4.334 -20.664 -16.819
  487    HB3  GLU  65           HB2      GLU  65  -4.538 -22.231 -16.053
  488    HG2  GLU  65           HG3      GLU  65  -6.972 -21.929 -16.127
  489    HG3  GLU  65           HG2      GLU  65  -6.738 -20.390 -16.953
  490    H    SER  66           H        SER  66  -5.803 -19.908 -12.516
  491    HA   SER  66           HA       SER  66  -7.791 -21.748 -11.949
  492    HB2  SER  66           HB3      SER  66  -5.724 -23.330 -12.034
  493    HB3  SER  66           HB2      SER  66  -5.285 -22.594 -10.492
  494    HG   SER  66           HG       SER  66  -7.053 -23.442  -9.549
  495    H    GLY  67           H        GLY  67  -5.038 -19.979 -10.660
  496    HA2  GLY  67           HA3      GLY  67  -6.708 -18.266  -9.114
  497    HA3  GLY  67           HA2      GLY  67  -5.845 -19.421  -8.096
  498    H    CYS  68           H        CYS  68  -4.020 -18.627  -7.286
  499    HA   CYS  68           HA       CYS  68  -2.340 -16.989  -9.056
  500    HB2  CYS  68           HB3      CYS  68  -1.554 -15.756  -7.036
  501    HB3  CYS  68           HB2      CYS  68  -3.271 -15.509  -7.365
  502    H    ARG  69           H        ARG  69  -0.014 -16.909  -7.727
  503    HA   ARG  69           HA       ARG  69   0.895 -19.586  -8.162
  504    HB2  ARG  69           HB3      ARG  69   2.401 -17.188  -7.084
  505    HB3  ARG  69           HB2      ARG  69   3.132 -18.698  -7.613
  506    HG2  ARG  69           HG3      ARG  69   2.234 -18.262  -9.893
  507    HG3  ARG  69           HG2      ARG  69   1.665 -16.695  -9.316
  508    HD2  ARG  69           HD3      ARG  69   3.797 -16.430 -10.436
  509    HD3  ARG  69           HD2      ARG  69   3.974 -16.094  -8.712
  510    HE   ARG  69           HE       ARG  69   4.569 -18.808  -9.249
  511   HH11  ARG  69          HH11      ARG  69   5.889 -15.588  -9.623
  512   HH12  ARG  69          HH12      ARG  69   7.537 -16.128  -9.628
  513   HH21  ARG  69          HH21      ARG  69   6.730 -19.525  -9.265
  514   HH22  ARG  69          HH22      ARG  69   8.018 -18.376  -9.439
  515    H    GLY  70           H        GLY  70   1.238 -21.173  -6.731
  516    HA2  GLY  70           HA3      GLY  70   2.170 -22.002  -4.714
  517    HA3  GLY  70           HA2      GLY  70   1.817 -20.464  -3.948
  518    H    ILE  71           H        ILE  71  -0.902 -20.249  -4.650
  519    HA   ILE  71           HA       ILE  71  -2.037 -21.554  -2.456
  520    HB   ILE  71           HB       ILE  71  -3.407 -20.332  -4.850
  521   HG12  ILE  71          HG13      ILE  71  -1.972 -18.772  -3.605
  522   HG13  ILE  71          HG12      ILE  71  -3.673 -18.366  -3.424
  523   HG21  ILE  71          HG21      ILE  71  -4.547 -21.062  -2.156
  524   HG22  ILE  71          HG22      ILE  71  -4.910 -21.851  -3.691
  525   HG23  ILE  71          HG23      ILE  71  -5.390 -20.174  -3.425
  526   HD11  ILE  71          HD11      ILE  71  -2.509 -18.107  -1.329
  527   HD12  ILE  71          HD12      ILE  71  -1.952 -19.778  -1.399
  528   HD13  ILE  71          HD13      ILE  71  -3.671 -19.428  -1.213
  529    H    ASP  72           H        ASP  72  -2.935 -23.483  -2.158
  530    HA   ASP  72           HA       ASP  72  -3.104 -25.447  -4.218
  531    HB2  ASP  72           HB3      ASP  72  -2.755 -26.093  -1.873
  532    HB3  ASP  72           HB2      ASP  72  -4.324 -25.418  -1.441
  533    H    SER  73           H        SER  73  -4.463 -24.998  -5.844
  534    HA   SER  73           HA       SER  73  -6.901 -23.558  -5.401
  535    HB2  SER  73           HB3      SER  73  -5.359 -23.399  -7.459
  536    HB3  SER  73           HB2      SER  73  -6.132 -24.895  -7.990
  537    HG   SER  73           HG       SER  73  -7.881 -22.937  -7.151
  538    H    LYS  74           H        LYS  74  -6.076 -26.744  -5.048
  539    HA   LYS  74           HA       LYS  74  -8.404 -28.057  -5.973
  540    HB2  LYS  74           HB3      LYS  74  -6.330 -29.247  -5.363
  541    HB3  LYS  74           HB2      LYS  74  -6.546 -28.774  -3.689
  542    HG2  LYS  74           HG3      LYS  74  -8.722 -30.039  -3.723
  543    HG3  LYS  74           HG2      LYS  74  -8.233 -30.670  -5.296
  544    HD2  LYS  74           HD3      LYS  74  -6.673 -30.961  -2.736
  545    HD3  LYS  74           HD2      LYS  74  -7.669 -32.214  -3.472
  546    HE2  LYS  74           HE3      LYS  74  -6.237 -32.178  -5.453
  547    HE3  LYS  74           HE2      LYS  74  -5.253 -30.916  -4.717
  548    HZ1  LYS  74           HZ1      LYS  74  -5.620 -33.654  -3.630
  549    HZ2  LYS  74           HZ2      LYS  74  -4.654 -32.441  -2.958
  550    HZ3  LYS  74           HZ3      LYS  74  -4.252 -33.103  -4.460
  551    H    HIS  75           H        HIS  75  -7.510 -26.500  -2.948
  552    HA   HIS  75           HA       HIS  75 -10.188 -26.974  -1.870
  553    HB2  HIS  75           HB3      HIS  75  -7.678 -25.859  -0.608
  554    HB3  HIS  75           HB2      HIS  75  -9.226 -25.948   0.223
  555    HD1  HIS  75           HD1      HIS  75  -6.488 -28.133  -1.166
  556    HD2  HIS  75           HD2      HIS  75  -9.873 -28.436   1.246
  557    HE1  HIS  75           HE1      HIS  75  -6.397 -30.436  -0.139
  558    HE2  HIS  75           HE2      HIS  75  -8.477 -30.613   1.273
  559    H    TRP  76           H        TRP  76  -8.084 -24.385  -2.962
  560    HA   TRP  76           HA       TRP  76 -10.198 -22.455  -2.272
  561    HB2  TRP  76           HB3      TRP  76  -7.203 -22.009  -2.315
  562    HB3  TRP  76           HB2      TRP  76  -8.414 -20.780  -1.952
  563    HD1  TRP  76           HD1      TRP  76  -6.377 -23.489  -0.358
  564    HE1  TRP  76           HE1      TRP  76  -6.962 -23.669   2.143
  565    HE3  TRP  76           HE3      TRP  76 -10.553 -20.530  -0.273
  566    HZ2  TRP  76           HZ2      TRP  76  -8.924 -22.694   3.910
  567    HZ3  TRP  76           HZ3      TRP  76 -11.720 -20.206   1.869
  568    HH2  TRP  76           HH2      TRP  76 -10.922 -21.267   3.916
  569    H    ASN  77           H        ASN  77 -10.981 -21.222  -3.839
  570    HA   ASN  77           HA       ASN  77  -9.607 -21.105  -6.427
  571    HB2  ASN  77           HB3      ASN  77 -12.051 -21.528  -6.461
  572    HB3  ASN  77           HB2      ASN  77 -12.319 -20.019  -5.597
  573   HD21  ASN  77          HD21      ASN  77 -13.529 -19.056  -7.187
  574   HD22  ASN  77          HD22      ASN  77 -12.871 -18.574  -8.714
  575    H    SER  78           H        SER  78  -8.683 -19.190  -7.159
  576    HA   SER  78           HA       SER  78  -8.551 -17.088  -5.105
  577    HB2  SER  78           HB3      SER  78  -6.191 -17.963  -6.762
  578    HB3  SER  78           HB2      SER  78  -6.193 -16.973  -5.305
  579    HG   SER  78           HG       SER  78  -6.682 -18.753  -4.096
  580    H    TYR  79           H        TYR  79  -8.342 -15.007  -5.761
  581    HA   TYR  79           HA       TYR  79  -7.605 -14.414  -8.481
  582    HB2  TYR  79           HB3      TYR  79  -9.506 -12.900  -8.905
  583    HB3  TYR  79           HB2      TYR  79 -10.033 -14.570  -8.726
  584    HD1  TYR  79           HD1      TYR  79 -10.185 -11.198  -7.333
  585    HD2  TYR  79           HD2      TYR  79 -11.321 -15.260  -6.756
  586    HE1  TYR  79           HE1      TYR  79 -11.858 -10.488  -5.676
  587    HE2  TYR  79           HE2      TYR  79 -12.995 -14.560  -5.096
  588    HH   TYR  79           HH       TYR  79 -13.379 -12.642  -3.562
  589    H    CYS  80           H        CYS  80  -6.829 -12.287  -8.724
  590    HA   CYS  80           HA       CYS  80  -5.811 -11.288  -6.183
  591    HB2  CYS  80           HB3      CYS  80  -4.963 -10.582  -9.001
  592    HB3  CYS  80           HB2      CYS  80  -4.086 -10.221  -7.511
  593    H    THR  81           H        THR  81  -6.331  -9.390  -5.331
  594    HA   THR  81           HA       THR  81  -7.891  -7.485  -6.952
  595    HB   THR  81           HB       THR  81  -8.382  -8.210  -4.046
  596    HG1  THR  81           HG1      THR  81  -9.069  -9.761  -5.705
  597   HG21  THR  81          HG21      THR  81  -8.893  -5.858  -4.538
  598   HG22  THR  81          HG22      THR  81 -10.361  -6.785  -4.231
  599   HG23  THR  81          HG23      THR  81  -9.915  -6.362  -5.885
  600    H    THR  82           H        THR  82  -7.261  -5.361  -6.746
  601    HA   THR  82           HA       THR  82  -4.756  -4.915  -5.427
  602    HB   THR  82           HB       THR  82  -5.039  -2.564  -6.325
  603    HG1  THR  82           HG1      THR  82  -7.035  -2.159  -6.886
  604   HG21  THR  82          HG21      THR  82  -4.543  -3.224  -8.625
  605   HG22  THR  82          HG22      THR  82  -5.145  -4.847  -8.292
  606   HG23  THR  82          HG23      THR  82  -3.700  -4.256  -7.470
  607    H    THR  83           H        THR  83  -4.357  -3.896  -3.591
  608    HA   THR  83           HA       THR  83  -6.602  -2.952  -1.987
  609    HB   THR  83           HB       THR  83  -3.700  -3.040  -1.150
  610    HG1  THR  83           HG1      THR  83  -5.583  -5.123  -1.406
  611   HG21  THR  83          HG21      THR  83  -4.627  -3.248   1.085
  612   HG22  THR  83          HG22      THR  83  -6.262  -3.302   0.431
  613   HG23  THR  83          HG23      THR  83  -5.308  -1.827   0.293
  614    H    HIS  84           H        HIS  84  -7.054  -0.843  -1.807
  615    HA   HIS  84           HA       HIS  84  -5.031   1.059  -2.761
  616    HB2  HIS  84           HB3      HIS  84  -7.142   2.483  -3.387
  617    HB3  HIS  84           HB2      HIS  84  -6.562   1.229  -4.474
  618    HD1  HIS  84           HD1      HIS  84  -8.150  -0.550  -5.117
  619    HD2  HIS  84           HD2      HIS  84  -9.508   1.671  -1.868
  620    HE1  HIS  84           HE1      HIS  84 -10.524  -1.299  -4.719
  621    HE2  HIS  84           HE2      HIS  84 -11.347   0.113  -2.801
  622    H    THR  85           H        THR  85  -4.643   2.831  -1.626
  623    HA   THR  85           HA       THR  85  -6.120   3.119   0.912
  624    HB   THR  85           HB       THR  85  -3.700   2.475   1.133
  625    HG1  THR  85           HG1      THR  85  -3.700   3.608   2.925
  626   HG21  THR  85          HG21      THR  85  -2.789   3.648  -0.793
  627   HG22  THR  85          HG22      THR  85  -1.992   4.199   0.681
  628   HG23  THR  85          HG23      THR  85  -3.228   5.201  -0.082
  629    H    PHE  86           H        PHE  86  -6.091   5.434   1.738
  630    HA   PHE  86           HA       PHE  86  -6.738   7.170  -0.537
  631    HB2  PHE  86           HB3      PHE  86  -7.685   7.285   2.343
  632    HB3  PHE  86           HB2      PHE  86  -8.090   8.483   1.111
  633    HD1  PHE  86           HD1      PHE  86  -9.498   7.847  -0.813
  634    HD2  PHE  86           HD2      PHE  86  -8.797   5.189   2.439
  635    HE1  PHE  86           HE1      PHE  86 -11.424   6.486  -1.515
  636    HE2  PHE  86           HE2      PHE  86 -10.718   3.822   1.741
  637    HZ   PHE  86           HZ       PHE  86 -12.036   4.467  -0.236
  638    H    VAL  87           H        VAL  87  -5.331   8.681  -1.009
  639    HA   VAL  87           HA       VAL  87  -3.455   9.541   1.086
  640    HB   VAL  87           HB       VAL  87  -1.905  10.139  -0.748
  641   HG11  VAL  87          HG11      VAL  87  -2.859   7.283  -0.853
  642   HG12  VAL  87          HG12      VAL  87  -1.766   7.955   0.354
  643   HG13  VAL  87          HG13      VAL  87  -1.267   7.869  -1.334
  644   HG21  VAL  87          HG21      VAL  87  -2.332   9.362  -3.019
  645   HG22  VAL  87          HG22      VAL  87  -3.554  10.529  -2.515
  646   HG23  VAL  87          HG23      VAL  87  -3.933   8.807  -2.539
  647    H    LYS  88           H        LYS  88  -2.784  11.720   1.111
  648    HA   LYS  88           HA       LYS  88  -4.980  13.534   0.583
  649    HB2  LYS  88           HB3      LYS  88  -2.330  14.015   1.971
  650    HB3  LYS  88           HB2      LYS  88  -3.711  15.107   1.967
  651    HG2  LYS  88           HG3      LYS  88  -4.982  13.685   3.324
  652    HG3  LYS  88           HG2      LYS  88  -3.915  12.315   3.039
  653    HD2  LYS  88           HD3      LYS  88  -2.140  13.450   4.291
  654    HD3  LYS  88           HD2      LYS  88  -3.225  14.816   4.571
  655    HE2  LYS  88           HE3      LYS  88  -3.073  13.244   6.487
  656    HE3  LYS  88           HE2      LYS  88  -4.706  13.464   5.863
  657    HZ1  LYS  88           HZ1      LYS  88  -4.445  11.383   4.632
  658    HZ2  LYS  88           HZ2      LYS  88  -4.295  11.148   6.297
  659    HZ3  LYS  88           HZ3      LYS  88  -2.916  11.161   5.316
  660    H    ALA  89           H        ALA  89  -5.091  14.412  -1.366
  661    HA   ALA  89           HA       ALA  89  -2.595  15.424  -2.571
  662    HB1  ALA  89           HB1      ALA  89  -4.849  14.086  -4.064
  663    HB2  ALA  89           HB2      ALA  89  -3.277  13.366  -3.716
  664    HB3  ALA  89           HB3      ALA  89  -3.388  14.772  -4.775
  665    H    LEU  90           H        LEU  90  -2.695  17.433  -3.447
  666    HA   LEU  90           HA       LEU  90  -5.011  19.032  -2.925
  667    HB2  LEU  90           HB3      LEU  90  -2.687  19.922  -2.788
  668    HB3  LEU  90           HB2      LEU  90  -2.537  19.711  -4.527
  669    HG   LEU  90           HG       LEU  90  -4.468  21.314  -4.791
  670   HD11  LEU  90          HD11      LEU  90  -4.924  22.808  -2.890
  671   HD12  LEU  90          HD12      LEU  90  -3.950  21.762  -1.858
  672   HD13  LEU  90          HD13      LEU  90  -5.434  21.148  -2.587
  673   HD21  LEU  90          HD21      LEU  90  -1.979  22.341  -3.436
  674   HD22  LEU  90          HD22      LEU  90  -3.097  23.302  -4.404
  675   HD23  LEU  90          HD23      LEU  90  -2.167  22.007  -5.159
  676    H    THR  91           H        THR  91  -6.736  19.045  -4.168
  677    HA   THR  91           HA       THR  91  -6.418  18.440  -7.036
  678    HB   THR  91           HB       THR  91  -8.622  17.332  -6.948
  679    HG1  THR  91           HG1      THR  91  -8.435  18.149  -4.253
  680   HG21  THR  91          HG21      THR  91  -6.637  15.939  -6.674
  681   HG22  THR  91          HG22      THR  91  -7.952  15.330  -5.671
  682   HG23  THR  91          HG23      THR  91  -6.638  16.249  -4.939
  683    H    THR  92           H        THR  92  -8.294  19.244  -8.352
  684    HA   THR  92           HA       THR  92  -9.462  21.659  -7.155
  685    HB   THR  92           HB       THR  92  -7.791  22.406  -8.720
  686    HG1  THR  92           HG1      THR  92  -9.663  23.637  -8.766
  687   HG21  THR  92          HG21      THR  92  -7.816  21.819 -11.084
  688   HG22  THR  92          HG22      THR  92  -9.177  20.733 -10.815
  689   HG23  THR  92          HG23      THR  92  -7.611  20.377 -10.091
  690    H    ASP  93           H        ASP  93 -11.528  21.304  -6.838
  691    HA   ASP  93           HA       ASP  93 -12.975  19.312  -8.323
  692    HB2  ASP  93           HB3      ASP  93 -13.376  19.718  -5.901
  693    HB3  ASP  93           HB2      ASP  93 -14.010  21.311  -6.299
  694    H    GLU  94           H        GLU  94 -13.108  22.843  -8.031
  695    HA   GLU  94           HA       GLU  94 -14.467  22.893 -10.641
  696    HB2  GLU  94           HB3      GLU  94 -15.032  24.536  -8.191
  697    HB3  GLU  94           HB2      GLU  94 -15.433  25.142  -9.790
  698    HG2  GLU  94           HG3      GLU  94 -16.422  22.547  -8.640
  699    HG3  GLU  94           HG2      GLU  94 -17.312  24.063  -8.614
  700    H    LYS  95           H        LYS  95 -13.070  25.418  -8.548
  701    HA   LYS  95           HA       LYS  95 -11.275  26.104 -10.783
  702    HB2  LYS  95           HB3      LYS  95 -12.710  28.006  -8.921
  703    HB3  LYS  95           HB2      LYS  95 -11.520  28.479 -10.124
  704    HG2  LYS  95           HG3      LYS  95 -12.982  27.633 -11.895
  705    HG3  LYS  95           HG2      LYS  95 -14.178  27.185 -10.680
  706    HD2  LYS  95           HD3      LYS  95 -14.327  29.538  -9.991
  707    HD3  LYS  95           HD2      LYS  95 -13.187  29.971 -11.266
  708    HE2  LYS  95           HE3      LYS  95 -14.755  29.079 -12.936
  709    HE3  LYS  95           HE2      LYS  95 -15.892  28.697 -11.648
  710    HZ1  LYS  95           HZ1      LYS  95 -16.456  30.776 -12.723
  711    HZ2  LYS  95           HZ2      LYS  95 -14.935  31.414 -12.366
  712    HZ3  LYS  95           HZ3      LYS  95 -16.014  31.056 -11.116
  713    H    GLN  96           H        GLN  96 -11.785  26.420  -7.287
  714    HA   GLN  96           HA       GLN  96  -9.042  27.129  -6.803
  715    HB2  GLN  96           HB3      GLN  96 -11.313  26.423  -4.938
  716    HB3  GLN  96           HB2      GLN  96  -9.723  26.936  -4.394
  717    HG2  GLN  96           HG3      GLN  96 -11.563  28.573  -6.121
  718    HG3  GLN  96           HG2      GLN  96 -11.380  28.750  -4.377
  719   HE21  GLN  96          HE21      GLN  96  -9.949  29.316  -7.486
  720   HE22  GLN  96          HE22      GLN  96  -8.656  30.318  -6.934
  721    H    ALA  97           H        ALA  97  -8.017  25.820  -4.844
  722    HA   ALA  97           HA       ALA  97  -8.060  22.985  -5.638
  723    HB1  ALA  97           HB1      ALA  97  -6.060  24.116  -6.498
  724    HB2  ALA  97           HB2      ALA  97  -5.657  22.888  -5.299
  725    HB3  ALA  97           HB3      ALA  97  -5.633  24.596  -4.855
  726    H    ALA  98           H        ALA  98  -8.227  21.530  -4.059
  727    HA   ALA  98           HA       ALA  98  -7.689  22.298  -1.289
  728    HB1  ALA  98           HB1      ALA  98  -9.837  21.392  -0.535
  729    HB2  ALA  98           HB2      ALA  98 -10.305  21.110  -2.212
  730    HB3  ALA  98           HB3      ALA  98 -10.065  22.756  -1.629
  731    H    TRP  99           H        TRP  99  -7.171  20.564   0.049
  732    HA   TRP  99           HA       TRP  99  -6.105  18.274  -1.295
  733    HB2  TRP  99           HB3      TRP  99  -6.184  19.178   1.567
  734    HB3  TRP  99           HB2      TRP  99  -5.668  17.544   1.167
  735    HD1  TRP  99           HD1      TRP  99  -3.308  17.251  -0.009
  736    HE1  TRP  99           HE1      TRP  99  -1.306  18.835  -0.314
  737    HE3  TRP  99           HE3      TRP  99  -5.583  21.674   1.169
  738    HZ2  TRP  99           HZ2      TRP  99  -0.758  21.587  -0.089
  739    HZ3  TRP  99           HZ3      TRP  99  -4.242  23.741   1.102
  740    HH2  TRP  99           HH2      TRP  99  -1.880  23.695   0.486
  741    H    ARG 100           H        ARG 100  -7.173  16.549  -1.839
  742    HA   ARG 100           HA       ARG 100  -9.492  15.719  -0.232
  743    HB2  ARG 100           HB3      ARG 100  -8.785  15.103  -3.113
  744    HB3  ARG 100           HB2      ARG 100 -10.139  14.382  -2.257
  745    HG2  ARG 100           HG3      ARG 100  -9.793  17.319  -2.820
  746    HG3  ARG 100           HG2      ARG 100 -10.823  16.209  -3.724
  747    HD2  ARG 100           HD3      ARG 100 -12.105  15.769  -1.662
  748    HD3  ARG 100           HD2      ARG 100 -11.106  16.948  -0.817
  749    HE   ARG 100           HE       ARG 100 -12.559  17.836  -3.190
  750   HH11  ARG 100          HH11      ARG 100 -12.271  17.789   0.296
  751   HH12  ARG 100          HH12      ARG 100 -13.323  19.146   0.531
  752   HH21  ARG 100          HH21      ARG 100 -13.945  19.626  -2.886
  753   HH22  ARG 100          HH22      ARG 100 -14.278  20.192  -1.281
  754    H    PHE 101           H        PHE 101  -9.824  13.293  -0.326
  755    HA   PHE 101           HA       PHE 101  -7.227  11.975   0.159
  756    HB2  PHE 101           HB3      PHE 101  -9.899  11.117   1.298
  757    HB3  PHE 101           HB2      PHE 101  -8.294  10.598   1.802
  758    HD1  PHE 101           HD1      PHE 101  -6.726  12.571   2.610
  759    HD2  PHE 101           HD2      PHE 101 -10.980  12.685   2.577
  760    HE1  PHE 101           HE1      PHE 101  -6.691  14.346   4.311
  761    HE2  PHE 101           HE2      PHE 101 -10.948  14.458   4.280
  762    HZ   PHE 101           HZ       PHE 101  -8.802  15.290   5.146
  763    H    ILE 102           H        ILE 102  -6.764  10.860  -1.648
  764    HA   ILE 102           HA       ILE 102  -9.039   9.737  -3.151
  765    HB   ILE 102           HB       ILE 102  -7.576   9.925  -5.162
  766   HG12  ILE 102          HG13      ILE 102  -5.800  11.586  -3.367
  767   HG13  ILE 102          HG12      ILE 102  -5.418   9.954  -3.892
  768   HG21  ILE 102          HG21      ILE 102  -8.143  12.476  -3.660
  769   HG22  ILE 102          HG22      ILE 102  -9.250  11.612  -4.728
  770   HG23  ILE 102          HG23      ILE 102  -7.802  12.374  -5.387
  771   HD11  ILE 102          HD11      ILE 102  -5.769  12.353  -5.673
  772   HD12  ILE 102          HD12      ILE 102  -5.395  10.715  -6.211
  773   HD13  ILE 102          HD13      ILE 102  -4.239  11.601  -5.216
  774    H    ARG 103           H        ARG 103  -8.901   7.701  -4.016
  775    HA   ARG 103           HA       ARG 103  -7.189   5.954  -2.472
  776    HB2  ARG 103           HB3      ARG 103  -8.546   4.128  -3.358
  777    HB3  ARG 103           HB2      ARG 103  -9.573   5.410  -2.733
  778    HG2  ARG 103           HG3      ARG 103 -10.027   6.183  -4.986
  779    HG3  ARG 103           HG2      ARG 103  -8.928   4.970  -5.641
  780    HD2  ARG 103           HD3      ARG 103 -10.390   3.219  -4.573
  781    HD3  ARG 103           HD2      ARG 103 -11.539   4.508  -4.209
  782    HE   ARG 103           HE       ARG 103 -11.003   4.684  -6.915
  783   HH11  ARG 103          HH11      ARG 103 -12.410   2.363  -4.709
  784   HH12  ARG 103          HH12      ARG 103 -13.407   1.620  -5.919
  785   HH21  ARG 103          HH21      ARG 103 -12.334   3.719  -8.509
  786   HH22  ARG 103          HH22      ARG 103 -13.372   2.401  -8.073
  787    H    ILE 104           H        ILE 104  -5.335   5.172  -3.121
  788    HA   ILE 104           HA       ILE 104  -4.917   4.754  -6.008
  789    HB   ILE 104           HB       ILE 104  -2.481   4.979  -5.607
  790   HG12  ILE 104          HG13      ILE 104  -3.253   6.065  -2.895
  791   HG13  ILE 104          HG12      ILE 104  -2.590   4.456  -3.155
  792   HG21  ILE 104          HG21      ILE 104  -4.123   7.382  -4.833
  793   HG22  ILE 104          HG22      ILE 104  -3.719   6.871  -6.472
  794   HG23  ILE 104          HG23      ILE 104  -2.448   7.425  -5.381
  795   HD11  ILE 104          HD11      ILE 104  -0.541   5.426  -4.019
  796   HD12  ILE 104          HD12      ILE 104  -0.899   6.034  -2.402
  797   HD13  ILE 104          HD13      ILE 104  -1.210   7.043  -3.815
  798    H    ASP 105           H        ASP 105  -4.333   2.754  -6.632
  799    HA   ASP 105           HA       ASP 105  -4.467   0.634  -4.670
  800    HB2  ASP 105           HB3      ASP 105  -4.042   0.557  -7.673
  801    HB3  ASP 105           HB2      ASP 105  -4.201  -0.873  -6.654
  802    H    THR 106           H        THR 106  -2.750  -0.005  -3.564
  803    HA   THR 106           HA       THR 106  -0.099   0.457  -4.761
  804    HB   THR 106           HB       THR 106  -0.487   2.192  -3.124
  805    HG1  THR 106           HG1      THR 106   1.377   0.178  -2.547
  806   HG21  THR 106          HG21      THR 106  -0.905   1.683  -0.764
  807   HG22  THR 106          HG22      THR 106  -1.031  -0.031  -1.158
  808   HG23  THR 106          HG23      THR 106  -2.214   1.111  -1.795
  809    H    ALA 107           H        ALA 107  -1.886  -1.957  -4.453
  810    HA   ALA 107           HA       ALA 107   0.169  -3.842  -4.078
  811    HB1  ALA 107           HB1      ALA 107  -0.146  -3.342  -1.695
  812    HB2  ALA 107           HB2      ALA 107  -0.635  -4.993  -2.077
  813    HB3  ALA 107           HB3      ALA 107  -1.858  -3.744  -1.839
  814    H    CYS 108           H        CYS 108  -0.555  -5.993  -4.585
  815    HA   CYS 108           HA       CYS 108  -3.412  -6.242  -5.206
  816    HB2  CYS 108           HB3      CYS 108  -2.138  -5.972  -7.341
  817    HB3  CYS 108           HB2      CYS 108  -1.194  -7.406  -6.920
  818    H    VAL 109           H        VAL 109  -4.248  -7.728  -3.940
  819    HA   VAL 109           HA       VAL 109  -2.437  -9.763  -2.833
  820    HB   VAL 109           HB       VAL 109  -3.969  -9.933  -0.936
  821   HG11  VAL 109          HG11      VAL 109  -3.617  -7.688   0.025
  822   HG12  VAL 109          HG12      VAL 109  -3.167  -7.099  -1.577
  823   HG13  VAL 109          HG13      VAL 109  -2.178  -8.321  -0.776
  824   HG21  VAL 109          HG21      VAL 109  -5.557  -7.746  -2.287
  825   HG22  VAL 109          HG22      VAL 109  -5.855  -8.396  -0.674
  826   HG23  VAL 109          HG23      VAL 109  -6.068  -9.425  -2.093
  827    H    CYS 110           H        CYS 110  -3.051 -11.906  -2.774
  828    HA   CYS 110           HA       CYS 110  -5.158 -12.653  -4.646
  829    HB2  CYS 110           HB3      CYS 110  -2.924 -13.730  -4.839
  830    HB3  CYS 110           HB2      CYS 110  -3.128 -14.399  -3.227
  831    H    VAL 111           H        VAL 111  -7.136 -13.008  -3.882
  832    HA   VAL 111           HA       VAL 111  -7.418 -13.653  -1.032
  833    HB   VAL 111           HB       VAL 111  -9.735 -12.993  -1.224
  834   HG11  VAL 111          HG11      VAL 111  -7.919 -11.016  -2.593
  835   HG12  VAL 111          HG12      VAL 111  -8.140 -11.206  -0.852
  836   HG13  VAL 111          HG13      VAL 111  -9.473 -10.633  -1.854
  837   HG21  VAL 111          HG21      VAL 111  -9.205 -12.582  -4.160
  838   HG22  VAL 111          HG22      VAL 111 -10.698 -12.187  -3.309
  839   HG23  VAL 111          HG23      VAL 111 -10.183 -13.868  -3.453
  840    H    LEU 112           H        LEU 112  -8.877 -15.347  -0.375
  841    HA   LEU 112           HA       LEU 112  -8.882 -17.518  -2.359
  842    HB2  LEU 112           HB3      LEU 112  -8.728 -17.723   0.651
  843    HB3  LEU 112           HB2      LEU 112  -8.680 -19.068  -0.475
  844    HG   LEU 112           HG       LEU 112  -6.579 -16.921  -0.137
  845   HD11  LEU 112          HD11      LEU 112  -5.156 -18.807   0.514
  846   HD12  LEU 112          HD12      LEU 112  -6.543 -19.889   0.387
  847   HD13  LEU 112          HD13      LEU 112  -6.531 -18.609   1.601
  848   HD21  LEU 112          HD21      LEU 112  -5.295 -18.204  -1.806
  849   HD22  LEU 112          HD22      LEU 112  -6.742 -17.457  -2.478
  850   HD23  LEU 112          HD23      LEU 112  -6.726 -19.184  -2.119
  851    H    SER 113           H        SER 113 -10.676 -18.640  -2.748
  852    HA   SER 113           HA       SER 113 -13.004 -18.210  -0.995
  853    HB2  SER 113           HB3      SER 113 -13.351 -17.220  -3.239
  854    HB3  SER 113           HB2      SER 113 -13.008 -18.786  -3.973
  855    HG   SER 113           HG       SER 113 -15.319 -18.059  -3.472
  856    H    ARG 114           H        ARG 114 -14.115 -20.044  -0.360
  857    HA   ARG 114           HA       ARG 114 -12.553 -22.459  -0.429
  858    HB2  ARG 114           HB3      ARG 114 -13.788 -21.580   1.595
  859    HB3  ARG 114           HB2      ARG 114 -15.280 -22.081   0.809
  860    HG2  ARG 114           HG3      ARG 114 -14.589 -24.387   0.847
  861    HG3  ARG 114           HG2      ARG 114 -12.997 -23.936   1.463
  862    HD2  ARG 114           HD3      ARG 114 -14.013 -23.094   3.505
  863    HD3  ARG 114           HD2      ARG 114 -15.616 -23.501   2.892
  864    HE   ARG 114           HE       ARG 114 -13.934 -25.786   2.906
  865   HH11  ARG 114          HH11      ARG 114 -15.720 -23.680   5.049
  866   HH12  ARG 114          HH12      ARG 114 -16.017 -24.918   6.228
  867   HH21  ARG 114          HH21      ARG 114 -14.315 -27.423   4.462
  868   HH22  ARG 114          HH22      ARG 114 -15.227 -27.048   5.891
  869    H    LYS 115           H        LYS 115 -14.318 -21.243  -2.724
  870    HA   LYS 115           HA       LYS 115 -15.343 -22.029  -4.591
  871    HB2  LYS 115           HB3      LYS 115 -14.804 -24.821  -3.560
  872    HB3  LYS 115           HB2      LYS 115 -15.131 -24.358  -5.220
  873    HG2  LYS 115           HG3      LYS 115 -12.975 -23.051  -5.154
  874    HG3  LYS 115           HG2      LYS 115 -12.657 -23.832  -3.600
  875    HD2  LYS 115           HD3      LYS 115 -12.997 -25.155  -6.281
  876    HD3  LYS 115           HD2      LYS 115 -11.547 -25.112  -5.281
  877    HE2  LYS 115           HE3      LYS 115 -14.133 -26.454  -4.517
  878    HE3  LYS 115           HE2      LYS 115 -12.741 -27.281  -5.206
  879    HZ1  LYS 115           HZ1      LYS 115 -11.470 -26.861  -3.305
  880    HZ2  LYS 115           HZ2      LYS 115 -12.976 -27.351  -2.712
  881    HZ3  LYS 115           HZ3      LYS 115 -12.558 -25.712  -2.705
  882    H    ALA 116           H        ALA 116 -16.884 -21.295  -2.463
  883    HA   ALA 116           HA       ALA 116 -19.178 -23.103  -2.711
  884    HB1  ALA 116           HB1      ALA 116 -18.236 -21.869  -0.125
  885    HB2  ALA 116           HB2      ALA 116 -18.118 -23.574  -0.560
  886    HB3  ALA 116           HB3      ALA 116 -19.699 -22.826  -0.344
  887    H    THR 117           H        THR 117 -21.202 -22.089  -2.482
  888    HA   THR 117           HA       THR 117 -21.168 -19.154  -2.446
  889    HB   THR 117           HB       THR 117 -23.160 -19.364  -4.089
  890    HG1  THR 117           HG1      THR 117 -23.552 -21.337  -4.727
  891   HG21  THR 117          HG21      THR 117 -21.657 -19.308  -6.032
  892   HG22  THR 117          HG22      THR 117 -20.345 -19.925  -5.028
  893   HG23  THR 117          HG23      THR 117 -21.033 -18.335  -4.701
  894    H    ARG 118           H        ARG 118 -23.359 -18.245  -1.969
  895    HA   ARG 118           HA       ARG 118 -24.385 -19.467   0.366
  896    HB2  ARG 118           HB3      ARG 118 -26.180 -17.626   0.165
  897    HB3  ARG 118           HB2      ARG 118 -24.520 -17.147   0.435
  898    HG2  ARG 118           HG3      ARG 118 -25.254 -15.641  -1.151
  899    HG3  ARG 118           HG2      ARG 118 -24.407 -16.844  -2.119
  900    HD2  ARG 118           HD3      ARG 118 -26.490 -16.228  -3.189
  901    HD3  ARG 118           HD2      ARG 118 -26.564 -17.904  -2.651
  902    HE   ARG 118           HE       ARG 118 -27.775 -15.721  -1.082
  903   HH11  ARG 118          HH11      ARG 118 -27.953 -18.867  -2.603
  904   HH12  ARG 118          HH12      ARG 118 -29.591 -19.156  -2.100
  905   HH21  ARG 118          HH21      ARG 118 -29.927 -16.110  -0.406
  906   HH22  ARG 118          HH22      ARG 118 -30.708 -17.594  -0.852
  907    H1   SER   1           H1       SER   1 -26.588 -11.705  12.461
  908    H2   SER   1           H2       SER   1 -27.506 -13.112  12.636
  909    H3   SER   1           H3       SER   1 -27.844 -12.035  11.381
  910    HA   SER   1           HA       SER   1 -25.774 -12.495  10.330
  911    HB2  SER   1           HB3      SER   1 -25.318 -14.458  12.590
  912    HB3  SER   1           HB2      SER   1 -24.228 -14.134  11.243
  913    HG   SER   1           HG       SER   1 -24.147 -12.982  13.532
  914    H    SER   2           H        SER   2 -27.477 -13.126   8.922
  915    HA   SER   2           HA       SER   2 -27.987 -16.025   8.962
  916    HB2  SER   2           HB3      SER   2 -30.173 -15.421   7.782
  917    HB3  SER   2           HB2      SER   2 -30.070 -15.016   9.496
  918    HG   SER   2           HG       SER   2 -30.875 -13.243   8.415
  919    H    THR   3           H        THR   3 -28.488 -13.350   6.667
  920    HA   THR   3           HA       THR   3 -27.731 -15.019   4.456
  921    HB   THR   3           HB       THR   3 -27.982 -12.787   3.185
  922    HG1  THR   3           HG1      THR   3 -27.799 -11.452   5.068
  923   HG21  THR   3          HG21      THR   3 -30.330 -13.937   4.703
  924   HG22  THR   3          HG22      THR   3 -29.687 -14.538   3.176
  925   HG23  THR   3          HG23      THR   3 -30.432 -12.942   3.250
  926    H    HIS   4           H        HIS   4 -25.671 -15.478   4.077
  927    HA   HIS   4           HA       HIS   4 -23.764 -13.307   3.851
  928    HB2  HIS   4           HB3      HIS   4 -22.049 -14.428   5.217
  929    HB3  HIS   4           HB2      HIS   4 -23.458 -14.012   6.175
  930    HD1  HIS   4           HD1      HIS   4 -25.097 -16.100   6.747
  931    HD2  HIS   4           HD2      HIS   4 -21.298 -17.048   5.343
  932    HE1  HIS   4           HE1      HIS   4 -24.729 -18.508   7.364
  933    HE2  HIS   4           HE2      HIS   4 -22.395 -19.039   6.580
  934    HA   PRO   5           HA       PRO   5 -22.882 -16.107   0.449
  935    HB2  PRO   5           HB3      PRO   5 -21.710 -14.328  -1.156
  936    HB3  PRO   5           HB2      PRO   5 -23.453 -14.265  -0.856
  937    HG2  PRO   5           HG3      PRO   5 -21.260 -12.600   0.315
  938    HG3  PRO   5           HG2      PRO   5 -22.879 -12.107  -0.211
  939    HD2  PRO   5           HD3      PRO   5 -22.136 -12.620   2.417
  940    HD3  PRO   5           HD2      PRO   5 -23.804 -12.633   1.807
  941    H    VAL   6           H        VAL   6 -21.330 -16.747   2.445
  942    HA   VAL   6           HA       VAL   6 -19.256 -17.299   3.224
  943    HB   VAL   6           HB       VAL   6 -18.334 -16.974   0.361
  944   HG11  VAL   6          HG11      VAL   6 -16.530 -17.325   1.943
  945   HG12  VAL   6          HG12      VAL   6 -16.750 -18.762   0.946
  946   HG13  VAL   6          HG13      VAL   6 -17.354 -18.738   2.603
  947   HG21  VAL   6          HG21      VAL   6 -20.350 -18.332   0.379
  948   HG22  VAL   6          HG22      VAL   6 -19.660 -19.363   1.634
  949   HG23  VAL   6          HG23      VAL   6 -18.935 -19.326   0.028
  950    H    PHE   7           H        PHE   7 -19.637 -14.998   4.074
  951    HA   PHE   7           HA       PHE   7 -19.015 -12.873   4.537
  952    HB2  PHE   7           HB3      PHE   7 -16.360 -13.902   3.515
  953    HB3  PHE   7           HB2      PHE   7 -16.569 -12.322   4.250
  954    HD1  PHE   7           HD1      PHE   7 -16.574 -15.941   4.851
  955    HD2  PHE   7           HD2      PHE   7 -16.819 -12.076   6.610
  956    HE1  PHE   7           HE1      PHE   7 -16.191 -16.933   7.064
  957    HE2  PHE   7           HE2      PHE   7 -16.438 -13.060   8.832
  958    HZ   PHE   7           HZ       PHE   7 -16.123 -15.491   9.062
  959    H    HIS   8           H        HIS   8 -16.596 -12.655   2.131
  960    HA   HIS   8           HA       HIS   8 -18.427 -11.793   0.028
  961    HB2  HIS   8           HB3      HIS   8 -17.775  -9.765   1.379
  962    HB3  HIS   8           HB2      HIS   8 -16.099 -10.088   0.966
  963    HD1  HIS   8           HD1      HIS   8 -19.342  -8.946  -0.564
  964    HD2  HIS   8           HD2      HIS   8 -15.308  -9.198  -1.532
  965    HE1  HIS   8           HE1      HIS   8 -19.068  -7.626  -2.687
  966    HE2  HIS   8           HE2      HIS   8 -16.592  -7.661  -3.161
  967    H    MET   9           H        MET   9 -16.310 -13.837   0.948
  968    HA   MET   9           HA       MET   9 -14.330 -14.787   0.379
  969    HB2  MET   9           HB3      MET   9 -14.363 -15.820  -1.834
  970    HB3  MET   9           HB2      MET   9 -15.920 -15.948  -1.040
  971    HG2  MET   9           HG3      MET   9 -16.738 -14.079  -2.425
  972    HG3  MET   9           HG2      MET   9 -15.186 -14.049  -3.258
  973    HE1  MET   9           HE1      MET   9 -17.217 -17.187  -1.977
  974    HE2  MET   9           HE2      MET   9 -18.165 -17.574  -3.413
  975    HE3  MET   9           HE3      MET   9 -18.454 -16.066  -2.544
  976    H    GLY  10           H        GLY  10 -13.890 -12.159   0.654
  977    HA2  GLY  10           HA3      GLY  10 -11.713 -11.753  -1.286
  978    HA3  GLY  10           HA2      GLY  10 -12.855 -10.444  -1.025
  979    H    GLU  11           H        GLU  11 -12.936 -11.645   1.857
  980    HA   GLU  11           HA       GLU  11 -10.662 -10.081   2.842
  981    HB2  GLU  11           HB3      GLU  11 -11.824 -10.223   5.051
  982    HB3  GLU  11           HB2      GLU  11 -12.752  -9.400   3.802
  983    HG2  GLU  11           HG3      GLU  11 -13.177 -12.296   4.475
  984    HG3  GLU  11           HG2      GLU  11 -14.017 -10.991   5.313
  985    H    PHE  12           H        PHE  12 -10.991 -13.045   1.862
  986    HA   PHE  12           HA       PHE  12  -9.828 -14.452   4.110
  987    HB2  PHE  12           HB3      PHE  12 -10.394 -15.289   1.258
  988    HB3  PHE  12           HB2      PHE  12  -9.600 -16.333   2.432
  989    HD1  PHE  12           HD1      PHE  12 -12.737 -14.417   1.855
  990    HD2  PHE  12           HD2      PHE  12 -10.842 -17.653   3.869
  991    HE1  PHE  12           HE1      PHE  12 -14.922 -15.187   2.667
  992    HE2  PHE  12           HE2      PHE  12 -13.029 -18.432   4.683
  993    HZ   PHE  12           HZ       PHE  12 -15.072 -17.198   4.080
  994    H    SER  13           H        SER  13  -8.132 -12.804   4.210
  995    HA   SER  13           HA       SER  13  -6.153 -12.658   2.161
  996    HB2  SER  13           HB3      SER  13  -4.898 -11.400   4.012
  997    HB3  SER  13           HB2      SER  13  -6.443 -10.722   3.516
  998    HG   SER  13           HG       SER  13  -6.552 -12.581   5.567
  999    H    VAL  14           H        VAL  14  -4.356 -13.840   1.913
 1000    HA   VAL  14           HA       VAL  14  -3.918 -16.258   3.242
 1001    HB   VAL  14           HB       VAL  14  -1.679 -16.261   2.172
 1002   HG11  VAL  14          HG11      VAL  14  -3.943 -15.370   0.391
 1003   HG12  VAL  14          HG12      VAL  14  -3.599 -17.022   0.905
 1004   HG13  VAL  14          HG13      VAL  14  -2.470 -16.173  -0.153
 1005   HG21  VAL  14          HG21      VAL  14  -2.426 -13.496   1.219
 1006   HG22  VAL  14          HG22      VAL  14  -1.006 -14.418   0.731
 1007   HG23  VAL  14          HG23      VAL  14  -1.173 -13.873   2.401
 1008    H    CYS  15           H        CYS  15  -2.950 -13.049   4.000
 1009    HA   CYS  15           HA       CYS  15  -1.684 -14.018   6.465
 1010    HB2  CYS  15           HB3      CYS  15  -0.884 -11.561   4.875
 1011    HB3  CYS  15           HB2      CYS  15  -0.158 -12.102   6.390
 1012    H    ASP  16           H        ASP  16  -2.863 -13.421   8.165
 1013    HA   ASP  16           HA       ASP  16  -5.156 -11.851   8.032
 1014    HB2  ASP  16           HB3      ASP  16  -3.426 -12.499  10.436
 1015    HB3  ASP  16           HB2      ASP  16  -5.024 -11.765  10.538
 1016    H    SER  17           H        SER  17  -5.402  -9.755   7.733
 1017    HA   SER  17           HA       SER  17  -3.322  -7.929   8.727
 1018    HB2  SER  17           HB3      SER  17  -4.833  -7.696   6.109
 1019    HB3  SER  17           HB2      SER  17  -3.610  -6.571   6.707
 1020    HG   SER  17           HG       SER  17  -3.167  -9.326   6.145
 1021    H    VAL  18           H        VAL  18  -4.031  -5.868   9.396
 1022    HA   VAL  18           HA       VAL  18  -6.945  -5.667   9.807
 1023    HB   VAL  18           HB       VAL  18  -5.853  -6.215  11.910
 1024   HG11  VAL  18          HG11      VAL  18  -4.207  -3.734  11.461
 1025   HG12  VAL  18          HG12      VAL  18  -3.624  -5.399  11.458
 1026   HG13  VAL  18          HG13      VAL  18  -4.241  -4.683  12.947
 1027   HG21  VAL  18          HG21      VAL  18  -7.783  -4.762  12.015
 1028   HG22  VAL  18          HG22      VAL  18  -6.757  -3.344  11.798
 1029   HG23  VAL  18          HG23      VAL  18  -6.620  -4.315  13.263
 1030    H    SER  19           H        SER  19  -7.888  -3.812   9.173
 1031    HA   SER  19           HA       SER  19  -6.206  -1.723   8.042
 1032    HB2  SER  19           HB3      SER  19  -9.224  -2.024   7.996
 1033    HB3  SER  19           HB2      SER  19  -8.279  -0.867   7.056
 1034    HG   SER  19           HG       SER  19  -7.321  -2.606   5.960
 1035    H    VAL  20           H        VAL  20  -5.779   0.131   9.058
 1036    HA   VAL  20           HA       VAL  20  -7.391   0.824  11.428
 1037    HB   VAL  20           HB       VAL  20  -4.397   1.131  11.181
 1038   HG11  VAL  20          HG11      VAL  20  -5.380   2.819  12.603
 1039   HG12  VAL  20          HG12      VAL  20  -4.485   1.653  13.577
 1040   HG13  VAL  20          HG13      VAL  20  -6.245   1.580  13.514
 1041   HG21  VAL  20          HG21      VAL  20  -4.232  -0.664  12.836
 1042   HG22  VAL  20          HG22      VAL  20  -4.992  -1.220  11.345
 1043   HG23  VAL  20          HG23      VAL  20  -5.979  -0.884  12.766
 1044    H    TRP  21           H        TRP  21  -7.956   2.928  11.619
 1045    HA   TRP  21           HA       TRP  21  -6.845   4.828   9.675
 1046    HB2  TRP  21           HB3      TRP  21  -9.347   4.979  11.375
 1047    HB3  TRP  21           HB2      TRP  21  -8.774   6.282  10.340
 1048    HD1  TRP  21           HD1      TRP  21 -10.519   2.898  10.218
 1049    HE1  TRP  21           HE1      TRP  21 -11.470   2.525   7.855
 1050    HE3  TRP  21           HE3      TRP  21  -8.359   6.883   7.834
 1051    HZ2  TRP  21           HZ2      TRP  21 -11.318   3.755   5.319
 1052    HZ3  TRP  21           HZ3      TRP  21  -8.815   7.210   5.436
 1053    HH2  TRP  21           HH2      TRP  21 -10.263   5.678   4.206
 1054    H    VAL  22           H        VAL  22  -4.983   5.483  10.592
 1055    HA   VAL  22           HA       VAL  22  -4.819   6.020  13.432
 1056    HB   VAL  22           HB       VAL  22  -2.733   6.414  11.282
 1057   HG11  VAL  22          HG11      VAL  22  -2.496   6.293  14.283
 1058   HG12  VAL  22          HG12      VAL  22  -2.223   7.703  13.256
 1059   HG13  VAL  22          HG13      VAL  22  -1.136   6.317  13.160
 1060   HG21  VAL  22          HG21      VAL  22  -1.814   4.269  12.019
 1061   HG22  VAL  22          HG22      VAL  22  -3.450   4.089  11.384
 1062   HG23  VAL  22          HG23      VAL  22  -3.172   4.070  13.125
 1063    H    GLY  23           H        GLY  23  -5.673   7.891  14.130
 1064    HA2  GLY  23           HA3      GLY  23  -5.431  10.278  12.434
 1065    HA3  GLY  23           HA2      GLY  23  -6.518  10.096  13.810
 1066    H    ASP  24           H        ASP  24  -3.305   8.994  14.203
 1067    HA   ASP  24           HA       ASP  24  -2.020  11.347  15.052
 1068    HB2  ASP  24           HB3      ASP  24  -3.713  11.249  16.873
 1069    HB3  ASP  24           HB2      ASP  24  -3.134   9.641  17.301
 1070    H    LYS  25           H        LYS  25  -0.419  10.281  13.800
 1071    HA   LYS  25           HA       LYS  25   0.517   7.679  14.696
 1072    HB2  LYS  25           HB3      LYS  25   0.227   8.328  12.254
 1073    HB3  LYS  25           HB2      LYS  25   1.647   9.342  12.448
 1074    HG2  LYS  25           HG3      LYS  25   2.970   7.379  13.050
 1075    HG3  LYS  25           HG2      LYS  25   1.543   6.360  12.847
 1076    HD2  LYS  25           HD3      LYS  25   1.415   7.104  10.485
 1077    HD3  LYS  25           HD2      LYS  25   2.920   7.992  10.718
 1078    HE2  LYS  25           HE3      LYS  25   2.517   5.009  10.931
 1079    HE3  LYS  25           HE2      LYS  25   3.418   5.867   9.681
 1080    HZ1  LYS  25           HZ1      LYS  25   4.130   5.584  12.546
 1081    HZ2  LYS  25           HZ2      LYS  25   4.919   6.651  11.505
 1082    HZ3  LYS  25           HZ3      LYS  25   4.976   4.988  11.212
 1083    H    THR  26           H        THR  26   1.267  10.939  15.168
 1084    HA   THR  26           HA       THR  26   2.813  12.101  16.280
 1085    HB   THR  26           HB       THR  26   4.105  11.094  18.073
 1086    HG1  THR  26           HG1      THR  26   3.239   8.631  16.932
 1087   HG21  THR  26          HG21      THR  26   1.285  10.055  17.875
 1088   HG22  THR  26          HG22      THR  26   1.793  11.619  18.518
 1089   HG23  THR  26          HG23      THR  26   2.234  10.134  19.359
 1090    H    THR  27           H        THR  27   4.471   9.156  15.114
 1091    HA   THR  27           HA       THR  27   6.476  10.936  13.924
 1092    HB   THR  27           HB       THR  27   8.145   9.018  14.492
 1093    HG1  THR  27           HG1      THR  27   6.497   8.739  16.775
 1094   HG21  THR  27          HG21      THR  27   8.734  10.137  16.597
 1095   HG22  THR  27          HG22      THR  27   7.170  10.951  16.596
 1096   HG23  THR  27          HG23      THR  27   8.347  11.298  15.327
 1097    H    ALA  28           H        ALA  28   7.303  10.299  11.977
 1098    HA   ALA  28           HA       ALA  28   6.738   7.632  10.988
 1099    HB1  ALA  28           HB1      ALA  28   4.712   8.929  10.435
 1100    HB2  ALA  28           HB2      ALA  28   5.573   8.339   9.014
 1101    HB3  ALA  28           HB3      ALA  28   5.714  10.031   9.492
 1102    H    THR  29           H        THR  29   7.858   7.169   8.990
 1103    HA   THR  29           HA       THR  29  10.354   8.686   8.892
 1104    HB   THR  29           HB       THR  29   9.765   5.914   7.850
 1105    HG1  THR  29           HG1      THR  29  10.325   6.876  10.355
 1106   HG21  THR  29          HG21      THR  29  12.381   7.378   8.231
 1107   HG22  THR  29          HG22      THR  29  11.622   6.996   6.684
 1108   HG23  THR  29          HG23      THR  29  12.207   5.697   7.724
 1109    H    ASP  30           H        ASP  30  10.693  10.011   7.306
 1110    HA   ASP  30           HA       ASP  30   9.053  10.181   4.972
 1111    HB2  ASP  30           HB3      ASP  30  10.061  12.181   5.973
 1112    HB3  ASP  30           HB2      ASP  30  11.676  11.533   5.691
 1113    H    ILE  31           H        ILE  31  10.007  10.194   2.751
 1114    HA   ILE  31           HA       ILE  31  11.000   7.686   2.068
 1115    HB   ILE  31           HB       ILE  31   9.730   9.077   0.515
 1116   HG12  ILE  31          HG13      ILE  31  12.501   8.507  -0.565
 1117   HG13  ILE  31          HG12      ILE  31  11.213   7.317  -0.402
 1118   HG21  ILE  31          HG21      ILE  31  10.754  10.986  -0.624
 1119   HG22  ILE  31          HG22      ILE  31  12.177  10.835   0.406
 1120   HG23  ILE  31          HG23      ILE  31  10.617  11.257   1.113
 1121   HD11  ILE  31          HD11      ILE  31   9.855   8.581  -1.993
 1122   HD12  ILE  31          HD12      ILE  31  11.400   8.089  -2.689
 1123   HD13  ILE  31          HD13      ILE  31  11.158   9.757  -2.162
 1124    H    LYS  32           H        LYS  32  12.707  10.545   3.027
 1125    HA   LYS  32           HA       LYS  32  15.241   9.726   1.908
 1126    HB2  LYS  32           HB3      LYS  32  14.669  11.830   3.994
 1127    HB3  LYS  32           HB2      LYS  32  16.137  11.671   3.038
 1128    HG2  LYS  32           HG3      LYS  32  14.924  12.210   1.026
 1129    HG3  LYS  32           HG2      LYS  32  13.407  12.260   1.923
 1130    HD2  LYS  32           HD3      LYS  32  14.668  14.025   3.369
 1131    HD3  LYS  32           HD2      LYS  32  15.691  14.179   1.939
 1132    HE2  LYS  32           HE3      LYS  32  13.978  15.809   1.732
 1133    HE3  LYS  32           HE2      LYS  32  13.591  14.509   0.605
 1134    HZ1  LYS  32           HZ1      LYS  32  11.604  15.098   1.722
 1135    HZ2  LYS  32           HZ2      LYS  32  12.345  15.034   3.239
 1136    HZ3  LYS  32           HZ3      LYS  32  12.086  13.605   2.370
 1137    H    GLY  33           H        GLY  33  13.441   8.632   4.442
 1138    HA2  GLY  33           HA3      GLY  33  14.078   6.970   5.964
 1139    HA3  GLY  33           HA2      GLY  33  15.767   7.376   5.670
 1140    H    LYS  34           H        LYS  34  13.666   9.997   6.268
 1141    HA   LYS  34           HA       LYS  34  15.031  10.485   8.799
 1142    HB2  LYS  34           HB3      LYS  34  13.240  12.272   7.147
 1143    HB3  LYS  34           HB2      LYS  34  14.116  12.764   8.587
 1144    HG2  LYS  34           HG3      LYS  34  15.346  11.839   6.002
 1145    HG3  LYS  34           HG2      LYS  34  15.235  13.503   6.563
 1146    HD2  LYS  34           HD3      LYS  34  16.589  12.893   8.531
 1147    HD3  LYS  34           HD2      LYS  34  16.764  11.265   7.877
 1148    HE2  LYS  34           HE3      LYS  34  17.908  12.147   5.929
 1149    HE3  LYS  34           HE2      LYS  34  17.657  13.792   6.502
 1150    HZ1  LYS  34           HZ1      LYS  34  19.882  13.066   7.002
 1151    HZ2  LYS  34           HZ2      LYS  34  19.303  11.708   7.823
 1152    HZ3  LYS  34           HZ3      LYS  34  19.022  13.253   8.449
 1153    H    GLU  35           H        GLU  35  14.068  10.357  10.719
 1154    HA   GLU  35           HA       GLU  35  11.267   9.588  10.855
 1155    HB2  GLU  35           HB3      GLU  35  13.105   8.513  12.244
 1156    HB3  GLU  35           HB2      GLU  35  13.196  10.021  13.139
 1157    HG2  GLU  35           HG3      GLU  35  11.829   8.723  14.459
 1158    HG3  GLU  35           HG2      GLU  35  10.677   9.679  13.538
 1159    H    VAL  36           H        VAL  36   9.758  11.128  10.950
 1160    HA   VAL  36           HA       VAL  36  10.508  13.719  12.130
 1161    HB   VAL  36           HB       VAL  36   9.016  14.812  10.481
 1162   HG11  VAL  36          HG11      VAL  36  10.516  14.579   8.549
 1163   HG12  VAL  36          HG12      VAL  36  11.238  13.154   9.298
 1164   HG13  VAL  36          HG13      VAL  36  11.406  14.733  10.064
 1165   HG21  VAL  36          HG21      VAL  36   7.578  12.899   9.974
 1166   HG22  VAL  36          HG22      VAL  36   8.932  12.090   9.183
 1167   HG23  VAL  36          HG23      VAL  36   8.281  13.584   8.508
 1168    H    THR  37           H        THR  37   8.780  14.994  12.979
 1169    HA   THR  37           HA       THR  37   6.862  13.391  14.421
 1170    HB   THR  37           HB       THR  37   7.223  16.386  14.496
 1171    HG1  THR  37           HG1      THR  37   8.754  14.315  15.553
 1172   HG21  THR  37          HG21      THR  37   5.150  15.575  15.510
 1173   HG22  THR  37          HG22      THR  37   6.257  16.184  16.740
 1174   HG23  THR  37          HG23      THR  37   6.070  14.447  16.504
 1175    H    VAL  38           H        VAL  38   4.913  12.985  13.669
 1176    HA   VAL  38           HA       VAL  38   3.886  14.459  11.390
 1177    HB   VAL  38           HB       VAL  38   2.789  12.022  12.812
 1178   HG11  VAL  38          HG11      VAL  38   1.020  13.262  11.692
 1179   HG12  VAL  38          HG12      VAL  38   1.361  11.757  10.838
 1180   HG13  VAL  38          HG13      VAL  38   1.963  13.288  10.201
 1181   HG21  VAL  38          HG21      VAL  38   4.933  11.613  11.714
 1182   HG22  VAL  38          HG22      VAL  38   4.288  12.262  10.207
 1183   HG23  VAL  38          HG23      VAL  38   3.619  10.778  10.886
 1184    H    LEU  39           H        LEU  39   2.318  15.937  11.484
 1185    HA   LEU  39           HA       LEU  39   1.156  16.583  14.067
 1186    HB2  LEU  39           HB3      LEU  39   0.820  17.938  11.382
 1187    HB3  LEU  39           HB2      LEU  39   0.267  18.562  12.925
 1188    HG   LEU  39           HG       LEU  39   3.152  18.144  12.143
 1189   HD11  LEU  39          HD11      LEU  39   1.531  20.667  12.429
 1190   HD12  LEU  39          HD12      LEU  39   2.115  19.973  10.917
 1191   HD13  LEU  39          HD13      LEU  39   3.264  20.584  12.107
 1192   HD21  LEU  39          HD21      LEU  39   2.825  17.853  14.528
 1193   HD22  LEU  39          HD22      LEU  39   1.930  19.369  14.610
 1194   HD23  LEU  39          HD23      LEU  39   3.646  19.379  14.204
 1195    H    ALA  40           H        ALA  40  -0.606  15.527  14.664
 1196    HA   ALA  40           HA       ALA  40  -2.304  14.088  12.922
 1197    HB1  ALA  40           HB1      ALA  40  -2.859  15.062  15.724
 1198    HB2  ALA  40           HB2      ALA  40  -2.064  13.544  15.304
 1199    HB3  ALA  40           HB3      ALA  40  -3.751  13.808  14.863
 1200    H    GLU  41           H        GLU  41  -2.313  17.300  14.223
 1201    HA   GLU  41           HA       GLU  41  -4.645  17.951  12.562
 1202    HB2  GLU  41           HB3      GLU  41  -3.592  19.393  15.003
 1203    HB3  GLU  41           HB2      GLU  41  -5.003  19.860  14.064
 1204    HG2  GLU  41           HG3      GLU  41  -6.183  17.897  14.720
 1205    HG3  GLU  41           HG2      GLU  41  -4.738  17.221  15.472
 1206    H    VAL  42           H        VAL  42  -4.101  18.992  10.765
 1207    HA   VAL  42           HA       VAL  42  -1.396  20.057  10.591
 1208    HB   VAL  42           HB       VAL  42  -1.669  20.020   8.173
 1209   HG11  VAL  42          HG11      VAL  42  -1.871  17.621   7.848
 1210   HG12  VAL  42          HG12      VAL  42  -2.623  17.458   9.435
 1211   HG13  VAL  42          HG13      VAL  42  -0.945  17.985   9.306
 1212   HG21  VAL  42          HG21      VAL  42  -4.045  20.605   8.050
 1213   HG22  VAL  42          HG22      VAL  42  -4.467  19.011   8.674
 1214   HG23  VAL  42          HG23      VAL  42  -3.677  19.163   7.105
 1215    H    ASN  43           H        ASN  43  -0.891  22.099  10.128
 1216    HA   ASN  43           HA       ASN  43  -3.057  24.071  10.255
 1217    HB2  ASN  43           HB3      ASN  43  -0.073  24.344  10.723
 1218    HB3  ASN  43           HB2      ASN  43  -1.208  25.688  10.771
 1219   HD21  ASN  43          HD21      ASN  43  -0.120  22.795  12.385
 1220   HD22  ASN  43          HD22      ASN  43  -0.912  23.097  13.889
 1221    H    ILE  44           H        ILE  44  -3.762  24.343   8.197
 1222    HA   ILE  44           HA       ILE  44  -1.730  24.847   6.124
 1223    HB   ILE  44           HB       ILE  44  -4.656  24.183   5.714
 1224   HG12  ILE  44          HG13      ILE  44  -2.223  22.396   5.438
 1225   HG13  ILE  44          HG12      ILE  44  -3.414  22.300   6.733
 1226   HG21  ILE  44          HG21      ILE  44  -3.640  25.463   3.890
 1227   HG22  ILE  44          HG22      ILE  44  -4.008  23.814   3.387
 1228   HG23  ILE  44          HG23      ILE  44  -2.348  24.270   3.770
 1229   HD11  ILE  44          HD11      ILE  44  -3.806  20.580   5.077
 1230   HD12  ILE  44          HD12      ILE  44  -3.923  21.798   3.806
 1231   HD13  ILE  44          HD13      ILE  44  -5.138  21.735   5.083
 1232    H    ASN  45           H        ASN  45  -1.355  26.982   6.700
 1233    HA   ASN  45           HA       ASN  45  -1.584  29.226   6.622
 1234    HB2  ASN  45           HB3      ASN  45  -2.223  28.774   4.262
 1235    HB3  ASN  45           HB2      ASN  45  -3.907  28.662   4.758
 1236   HD21  ASN  45          HD21      ASN  45  -1.568  31.007   5.996
 1237   HD22  ASN  45          HD22      ASN  45  -2.351  32.393   5.326
 1238    H    ASN  46           H        ASN  46  -2.335  28.567   8.885
 1239    HA   ASN  46           HA       ASN  46  -3.492  29.207  10.724
 1240    HB2  ASN  46           HB3      ASN  46  -4.911  31.145   8.882
 1241    HB3  ASN  46           HB2      ASN  46  -4.849  31.226  10.638
 1242   HD21  ASN  46          HD21      ASN  46  -2.927  31.846  11.650
 1243   HD22  ASN  46          HD22      ASN  46  -1.667  32.658  10.786
 1244    H    SER  47           H        SER  47  -4.588  27.191   8.740
 1245    HA   SER  47           HA       SER  47  -7.267  27.042   9.932
 1246    HB2  SER  47           HB3      SER  47  -7.393  27.695   7.520
 1247    HB3  SER  47           HB2      SER  47  -6.546  26.204   7.106
 1248    HG   SER  47           HG       SER  47  -8.692  25.774   6.891
 1249    H    VAL  48           H        VAL  48  -7.427  25.294  11.163
 1250    HA   VAL  48           HA       VAL  48  -5.424  23.181  10.834
 1251    HB   VAL  48           HB       VAL  48  -7.210  23.719  13.209
 1252   HG11  VAL  48          HG11      VAL  48  -6.425  21.422  13.091
 1253   HG12  VAL  48          HG12      VAL  48  -5.646  22.281  14.419
 1254   HG13  VAL  48          HG13      VAL  48  -4.762  21.984  12.921
 1255   HG21  VAL  48          HG21      VAL  48  -4.343  24.521  12.745
 1256   HG22  VAL  48          HG22      VAL  48  -5.221  24.692  14.263
 1257   HG23  VAL  48          HG23      VAL  48  -5.732  25.603  12.843
 1258    H    PHE  49           H        PHE  49  -5.956  21.211  10.210
 1259    HA   PHE  49           HA       PHE  49  -8.676  20.212  10.676
 1260    HB2  PHE  49           HB3      PHE  49  -7.146  20.002   8.068
 1261    HB3  PHE  49           HB2      PHE  49  -8.572  19.039   8.443
 1262    HD1  PHE  49           HD1      PHE  49  -7.367  22.063   7.047
 1263    HD2  PHE  49           HD2      PHE  49 -10.725  20.331   9.002
 1264    HE1  PHE  49           HE1      PHE  49  -8.807  23.848   6.153
 1265    HE2  PHE  49           HE2      PHE  49 -12.167  22.114   8.117
 1266    HZ   PHE  49           HZ       PHE  49 -11.208  23.874   6.688
 1267    H    ARG  50           H        ARG  50  -8.684  18.137  11.483
 1268    HA   ARG  50           HA       ARG  50  -6.085  16.963  11.971
 1269    HB2  ARG  50           HB3      ARG  50  -7.087  15.531  13.514
 1270    HB3  ARG  50           HB2      ARG  50  -8.009  17.014  13.669
 1271    HG2  ARG  50           HG3      ARG  50  -9.823  16.073  12.397
 1272    HG3  ARG  50           HG2      ARG  50  -8.877  14.616  12.072
 1273    HD2  ARG  50           HD3      ARG  50  -8.759  14.224  14.523
 1274    HD3  ARG  50           HD2      ARG  50  -9.851  15.587  14.754
 1275    HE   ARG  50           HE       ARG  50 -11.120  13.902  12.981
 1276   HH11  ARG  50          HH11      ARG  50  -9.884  13.678  16.249
 1277   HH12  ARG  50          HH12      ARG  50 -11.041  12.483  16.744
 1278   HH21  ARG  50          HH21      ARG  50 -12.654  12.344  13.625
 1279   HH22  ARG  50          HH22      ARG  50 -12.627  11.727  15.248
 1280    H    GLN  51           H        GLN  51  -5.420  14.912  11.309
 1281    HA   GLN  51           HA       GLN  51  -6.716  14.089   8.795
 1282    HB2  GLN  51           HB3      GLN  51  -3.762  14.259   9.431
 1283    HB3  GLN  51           HB2      GLN  51  -4.437  13.617   7.940
 1284    HG2  GLN  51           HG3      GLN  51  -4.726  16.445   8.935
 1285    HG3  GLN  51           HG2      GLN  51  -3.650  15.901   7.649
 1286   HE21  GLN  51          HE21      GLN  51  -5.876  17.833   7.614
 1287   HE22  GLN  51          HE22      GLN  51  -6.962  17.274   6.384
 1288    H    TYR  52           H        TYR  52  -6.440  11.911   8.150
 1289    HA   TYR  52           HA       TYR  52  -5.774  10.059  10.344
 1290    HB2  TYR  52           HB3      TYR  52  -7.833   9.462   8.216
 1291    HB3  TYR  52           HB2      TYR  52  -7.595   8.653   9.759
 1292    HD1  TYR  52           HD1      TYR  52  -8.412   9.709  11.852
 1293    HD2  TYR  52           HD2      TYR  52  -9.132  11.456   8.037
 1294    HE1  TYR  52           HE1      TYR  52 -10.161  11.135  12.833
 1295    HE2  TYR  52           HE2      TYR  52 -10.874  12.883   9.009
 1296    HH   TYR  52           HH       TYR  52 -12.340  12.971  10.902
 1297    H    PHE  53           H        PHE  53  -4.771   8.109   9.712
 1298    HA   PHE  53           HA       PHE  53  -3.893   7.993   6.902
 1299    HB2  PHE  53           HB3      PHE  53  -2.336   7.090   9.341
 1300    HB3  PHE  53           HB2      PHE  53  -1.784   6.997   7.670
 1301    HD1  PHE  53           HD1      PHE  53  -1.501   9.167   6.392
 1302    HD2  PHE  53           HD2      PHE  53  -1.975   9.006  10.616
 1303    HE1  PHE  53           HE1      PHE  53  -0.555  11.429   6.577
 1304    HE2  PHE  53           HE2      PHE  53  -1.028  11.268  10.813
 1305    HZ   PHE  53           HZ       PHE  53  -0.320  12.481   8.791
 1306    H    PHE  54           H        PHE  54  -4.558   6.240   5.856
 1307    HA   PHE  54           HA       PHE  54  -5.841   4.105   7.330
 1308    HB2  PHE  54           HB3      PHE  54  -6.925   4.962   5.302
 1309    HB3  PHE  54           HB2      PHE  54  -5.508   4.541   4.344
 1310    HD1  PHE  54           HD1      PHE  54  -5.285   2.392   3.416
 1311    HD2  PHE  54           HD2      PHE  54  -8.220   3.101   6.417
 1312    HE1  PHE  54           HE1      PHE  54  -6.242   0.165   3.002
 1313    HE2  PHE  54           HE2      PHE  54  -9.180   0.874   6.006
 1314    HZ   PHE  54           HZ       PHE  54  -8.190  -0.598   4.299
 1315    H    GLU  55           H        GLU  55  -4.413   2.784   8.276
 1316    HA   GLU  55           HA       GLU  55  -2.239   1.679   6.641
 1317    HB2  GLU  55           HB3      GLU  55  -2.768   1.474   9.618
 1318    HB3  GLU  55           HB2      GLU  55  -1.474   0.625   8.789
 1319    HG2  GLU  55           HG3      GLU  55  -0.763   3.022   8.036
 1320    HG3  GLU  55           HG2      GLU  55  -1.746   3.530   9.415
 1321    H    THR  56           H        THR  56  -1.881  -0.602   6.715
 1322    HA   THR  56           HA       THR  56  -4.059  -2.255   7.711
 1323    HB   THR  56           HB       THR  56  -2.901  -2.647   4.938
 1324    HG1  THR  56           HG1      THR  56  -4.678  -0.932   5.586
 1325   HG21  THR  56          HG21      THR  56  -4.629  -4.392   4.738
 1326   HG22  THR  56          HG22      THR  56  -5.083  -4.124   6.423
 1327   HG23  THR  56          HG23      THR  56  -3.482  -4.749   6.029
 1328    H    LYS  57           H        LYS  57  -3.020  -3.277   9.245
 1329    HA   LYS  57           HA       LYS  57  -0.126  -3.659   8.938
 1330    HB2  LYS  57           HB3      LYS  57  -1.721  -3.688  11.507
 1331    HB3  LYS  57           HB2      LYS  57   0.016  -3.467  11.321
 1332    HG2  LYS  57           HG3      LYS  57  -0.390  -1.311  10.214
 1333    HG3  LYS  57           HG2      LYS  57  -2.122  -1.524  10.451
 1334    HD2  LYS  57           HD3      LYS  57  -1.506  -0.156  12.220
 1335    HD3  LYS  57           HD2      LYS  57  -1.516  -1.762  12.945
 1336    HE2  LYS  57           HE3      LYS  57   0.453  -0.537  13.638
 1337    HE3  LYS  57           HE2      LYS  57   0.905  -1.907  12.626
 1338    HZ1  LYS  57           HZ1      LYS  57   1.258  -0.460  10.785
 1339    HZ2  LYS  57           HZ2      LYS  57   2.091   0.193  12.100
 1340    HZ3  LYS  57           HZ3      LYS  57   0.618   0.876  11.611
 1341    H    CYS  58           H        CYS  58   0.838  -5.610   9.618
 1342    HA   CYS  58           HA       CYS  58  -0.852  -7.847   8.944
 1343    HB2  CYS  58           HB3      CYS  58   1.649  -7.358   8.247
 1344    HB3  CYS  58           HB2      CYS  58   2.000  -8.199   9.752
 1345    H    ARG  59           H        ARG  59  -1.968  -8.891  10.381
 1346    HA   ARG  59           HA       ARG  59  -1.464  -8.708  13.201
 1347    HB2  ARG  59           HB3      ARG  59  -3.422 -10.328  11.568
 1348    HB3  ARG  59           HB2      ARG  59  -3.373 -10.358  13.321
 1349    HG2  ARG  59           HG3      ARG  59  -3.989  -8.051  13.441
 1350    HG3  ARG  59           HG2      ARG  59  -3.843  -7.873  11.693
 1351    HD2  ARG  59           HD3      ARG  59  -6.192  -8.127  12.550
 1352    HD3  ARG  59           HD2      ARG  59  -5.716  -9.279  11.305
 1353    HE   ARG  59           HE       ARG  59  -5.510 -10.068  14.122
 1354   HH11  ARG  59          HH11      ARG  59  -7.155 -10.369  11.035
 1355   HH12  ARG  59          HH12      ARG  59  -7.890 -11.887  11.438
 1356   HH21  ARG  59          HH21      ARG  59  -6.493 -12.054  14.647
 1357   HH22  ARG  59          HH22      ARG  59  -7.511 -12.849  13.486
 1358    H    ALA  60           H        ALA  60  -0.906 -11.032  10.646
 1359    HA   ALA  60           HA       ALA  60   0.640 -12.671  12.523
 1360    HB1  ALA  60           HB1      ALA  60  -1.284 -13.792  10.487
 1361    HB2  ALA  60           HB2      ALA  60  -1.549 -13.748  12.230
 1362    HB3  ALA  60           HB3      ALA  60  -0.241 -14.724  11.560
 1363    H    SER  61           H        SER  61   2.661 -12.579  11.825
 1364    HA   SER  61           HA       SER  61   3.397 -12.015   9.138
 1365    HB2  SER  61           HB3      SER  61   4.800 -11.454  11.129
 1366    HB3  SER  61           HB2      SER  61   5.114 -13.174  11.349
 1367    HG   SER  61           HG       SER  61   5.926 -13.081   9.105
 1368    H    ASN  62           H        ASN  62   2.762 -14.887  10.932
 1369    HA   ASN  62           HA       ASN  62   2.833 -16.422   8.471
 1370    HB2  ASN  62           HB3      ASN  62   4.531 -17.068  10.868
 1371    HB3  ASN  62           HB2      ASN  62   3.883 -18.372   9.880
 1372   HD21  ASN  62          HD21      ASN  62   4.528 -18.509   7.687
 1373   HD22  ASN  62          HD22      ASN  62   6.004 -17.790   7.147
 1374    HA   PRO  63           HA       PRO  63  -1.077 -16.891  10.844
 1375    HB2  PRO  63           HB3      PRO  63  -1.824 -18.022   8.192
 1376    HB3  PRO  63           HB2      PRO  63  -2.679 -16.847   9.201
 1377    HG2  PRO  63           HG3      PRO  63  -1.351 -16.093   7.001
 1378    HG3  PRO  63           HG2      PRO  63  -1.407 -15.071   8.445
 1379    HD2  PRO  63           HD3      PRO  63   0.822 -16.739   7.387
 1380    HD3  PRO  63           HD2      PRO  63   0.881 -15.202   8.279
 1381    H    VAL  64           H        VAL  64   0.434 -19.269   8.685
 1382    HA   VAL  64           HA       VAL  64  -0.449 -21.371  10.540
 1383    HB   VAL  64           HB       VAL  64  -0.307 -22.978   8.674
 1384   HG11  VAL  64          HG11      VAL  64  -2.136 -20.640   8.145
 1385   HG12  VAL  64          HG12      VAL  64  -2.467 -22.008   9.208
 1386   HG13  VAL  64          HG13      VAL  64  -2.323 -22.256   7.468
 1387   HG21  VAL  64          HG21      VAL  64   0.153 -20.535   6.973
 1388   HG22  VAL  64          HG22      VAL  64  -0.169 -22.159   6.366
 1389   HG23  VAL  64          HG23      VAL  64   1.307 -21.834   7.276
 1390    H    GLU  65           H        GLU  65   1.073 -23.155  10.819
 1391    HA   GLU  65           HA       GLU  65   3.697 -22.037  11.204
 1392    HB2  GLU  65           HB3      GLU  65   2.515 -23.410  12.929
 1393    HB3  GLU  65           HB2      GLU  65   2.721 -24.811  11.888
 1394    HG2  GLU  65           HG3      GLU  65   5.161 -24.517  12.026
 1395    HG3  GLU  65           HG2      GLU  65   4.913 -23.166  13.132
 1396    H    SER  66           H        SER  66   3.996 -21.876   8.840
 1397    HA   SER  66           HA       SER  66   5.971 -23.587   7.935
 1398    HB2  SER  66           HB3      SER  66   3.898 -25.151   7.737
 1399    HB3  SER  66           HB2      SER  66   3.458 -24.149   6.354
 1400    HG   SER  66           HG       SER  66   5.285 -24.783   5.295
 1401    H    GLY  67           H        GLY  67   3.223 -21.601   7.008
 1402    HA2  GLY  67           HA3      GLY  67   4.888 -19.639   5.793
 1403    HA3  GLY  67           HA2      GLY  67   4.027 -20.589   4.581
 1404    H    CYS  68           H        CYS  68   2.205 -19.654   3.929
 1405    HA   CYS  68           HA       CYS  68   0.520 -18.375   5.971
 1406    HB2  CYS  68           HB3      CYS  68  -0.272 -16.793   4.212
 1407    HB3  CYS  68           HB2      CYS  68   1.445 -16.610   4.580
 1408    H    ARG  69           H        ARG  69  -1.807 -18.058   4.676
 1409    HA   ARG  69           HA       ARG  69  -2.719 -20.771   4.612
 1410    HB2  ARG  69           HB3      ARG  69  -4.223 -18.213   3.994
 1411    HB3  ARG  69           HB2      ARG  69  -4.955 -19.792   4.237
 1412    HG2  ARG  69           HG3      ARG  69  -4.062 -19.782   6.560
 1413    HG3  ARG  69           HG2      ARG  69  -3.490 -18.136   6.281
 1414    HD2  ARG  69           HD3      ARG  69  -5.622 -18.077   7.430
 1415    HD3  ARG  69           HD2      ARG  69  -5.797 -17.430   5.795
 1416    HE   ARG  69           HE       ARG  69  -6.396 -20.193   5.822
 1417   HH11  ARG  69          HH11      ARG  69  -7.719 -17.101   6.779
 1418   HH12  ARG  69          HH12      ARG  69  -9.367 -17.635   6.702
 1419   HH21  ARG  69          HH21      ARG  69  -8.551 -20.908   5.709
 1420   HH22  ARG  69          HH22      ARG  69  -9.843 -19.814   6.103
 1421    H    GLY  70           H        GLY  70  -3.042 -22.070   2.908
 1422    HA2  GLY  70           HA3      GLY  70  -3.994 -22.503   0.778
 1423    HA3  GLY  70           HA2      GLY  70  -3.637 -20.850   0.310
 1424    H    ILE  71           H        ILE  71  -0.922 -20.768   1.038
 1425    HA   ILE  71           HA       ILE  71   0.218 -21.652  -1.357
 1426    HB   ILE  71           HB       ILE  71   1.584 -20.887   1.221
 1427   HG12  ILE  71          HG13      ILE  71   0.151 -19.122   0.285
 1428   HG13  ILE  71          HG12      ILE  71   1.853 -18.693   0.180
 1429   HG21  ILE  71          HG21      ILE  71   2.725 -21.108  -1.560
 1430   HG22  ILE  71          HG22      ILE  71   3.088 -22.164  -0.195
 1431   HG23  ILE  71          HG23      ILE  71   3.568 -20.468  -0.151
 1432   HD11  ILE  71          HD11      ILE  71   0.690 -18.053  -1.832
 1433   HD12  ILE  71          HD12      ILE  71   0.130 -19.707  -2.068
 1434   HD13  ILE  71          HD13      ILE  71   1.850 -19.333  -2.188
 1435    H    ASP  72           H        ASP  72   1.115 -23.491  -2.006
 1436    HA   ASP  72           HA       ASP  72   1.283 -25.800  -0.341
 1437    HB2  ASP  72           HB3      ASP  72   0.937 -26.006  -2.765
 1438    HB3  ASP  72           HB2      ASP  72   2.508 -25.264  -3.065
 1439    H    SER  73           H        SER  73   2.637 -25.644   1.346
 1440    HA   SER  73           HA       SER  73   5.079 -24.158   1.178
 1441    HB2  SER  73           HB3      SER  73   3.538 -24.383   3.228
 1442    HB3  SER  73           HB2      SER  73   4.305 -25.955   3.470
 1443    HG   SER  73           HG       SER  73   6.050 -23.866   3.021
 1444    H    LYS  74           H        LYS  74   4.255 -27.225   0.241
 1445    HA   LYS  74           HA       LYS  74   6.582 -28.683   0.909
 1446    HB2  LYS  74           HB3      LYS  74   4.513 -29.743   0.085
 1447    HB3  LYS  74           HB2      LYS  74   4.733 -28.971  -1.472
 1448    HG2  LYS  74           HG3      LYS  74   6.907 -30.222  -1.664
 1449    HG3  LYS  74           HG2      LYS  74   6.414 -31.128  -0.233
 1450    HD2  LYS  74           HD3      LYS  74   4.859 -30.948  -2.807
 1451    HD3  LYS  74           HD2      LYS  74   5.855 -32.313  -2.312
 1452    HE2  LYS  74           HE3      LYS  74   4.422 -32.642  -0.358
 1453    HE3  LYS  74           HE2      LYS  74   3.435 -31.271  -0.853
 1454    HZ1  LYS  74           HZ1      LYS  74   3.808 -33.761  -2.421
 1455    HZ2  LYS  74           HZ2      LYS  74   2.832 -32.451  -2.857
 1456    HZ3  LYS  74           HZ3      LYS  74   2.442 -33.381  -1.501
 1457    H    HIS  75           H        HIS  75   5.689 -26.600  -1.784
 1458    HA   HIS  75           HA       HIS  75   8.371 -26.865  -2.924
 1459    HB2  HIS  75           HB3      HIS  75   5.861 -25.537  -3.966
 1460    HB3  HIS  75           HB2      HIS  75   7.411 -25.474  -4.795
 1461    HD1  HIS  75           HD1      HIS  75   4.671 -27.878  -3.841
 1462    HD2  HIS  75           HD2      HIS  75   8.064 -27.731  -6.253
 1463    HE1  HIS  75           HE1      HIS  75   4.593 -29.954  -5.262
 1464    HE2  HIS  75           HE2      HIS  75   6.653 -29.852  -6.705
 1465    H    TRP  76           H        TRP  76   6.261 -24.518  -1.383
 1466    HA   TRP  76           HA       TRP  76   8.377 -22.496  -1.701
 1467    HB2  TRP  76           HB3      TRP  76   5.380 -22.070  -1.576
 1468    HB3  TRP  76           HB2      TRP  76   6.590 -20.791  -1.707
 1469    HD1  TRP  76           HD1      TRP  76   4.560 -23.171  -3.767
 1470    HE1  TRP  76           HE1      TRP  76   5.143 -22.893  -6.259
 1471    HE3  TRP  76           HE3      TRP  76   8.730 -20.236  -3.314
 1472    HZ2  TRP  76           HZ2      TRP  76   7.098 -21.601  -7.823
 1473    HZ3  TRP  76           HZ3      TRP  76   9.893 -19.524  -5.361
 1474    HH2  TRP  76           HH2      TRP  76   9.094 -20.195  -7.568
 1475    H    ASN  77           H        ASN  77   9.163 -21.578   0.066
 1476    HA   ASN  77           HA       ASN  77   7.789 -21.935   2.632
 1477    HB2  ASN  77           HB3      ASN  77  10.230 -22.355   2.589
 1478    HB3  ASN  77           HB2      ASN  77  10.500 -20.716   2.008
 1479   HD21  ASN  77          HD21      ASN  77  11.719 -20.064   3.747
 1480   HD22  ASN  77          HD22      ASN  77  11.062 -19.850   5.333
 1481    H    SER  78           H        SER  78   6.862 -20.186   3.704
 1482    HA   SER  78           HA       SER  78   6.725 -17.744   2.067
 1483    HB2  SER  78           HB3      SER  78   4.364 -18.908   3.534
 1484    HB3  SER  78           HB2      SER  78   4.368 -17.668   2.282
 1485    HG   SER  78           HG       SER  78   4.857 -19.195   0.768
 1486    H    TYR  79           H        TYR  79   6.522 -15.817   3.095
 1487    HA   TYR  79           HA       TYR  79   5.778 -15.734   5.878
 1488    HB2  TYR  79           HB3      TYR  79   7.680 -14.325   6.576
 1489    HB3  TYR  79           HB2      TYR  79   8.205 -15.934   6.093
 1490    HD1  TYR  79           HD1      TYR  79   8.360 -12.364   5.344
 1491    HD2  TYR  79           HD2      TYR  79   9.494 -16.250   4.031
 1492    HE1  TYR  79           HE1      TYR  79  10.033 -11.364   3.843
 1493    HE2  TYR  79           HE2      TYR  79  11.166 -15.259   2.526
 1494    HH   TYR  79           HH       TYR  79  11.538 -13.090   1.369
 1495    H    CYS  80           H        CYS  80   5.008 -13.686   6.508
 1496    HA   CYS  80           HA       CYS  80   3.984 -12.239   4.194
 1497    HB2  CYS  80           HB3      CYS  80   3.137 -12.061   7.095
 1498    HB3  CYS  80           HB2      CYS  80   2.259 -11.436   5.694
 1499    H    THR  81           H        THR  81   4.502 -10.220   3.708
 1500    HA   THR  81           HA       THR  81   6.066  -8.643   5.644
 1501    HB   THR  81           HB       THR  81   6.547  -8.815   2.653
 1502    HG1  THR  81           HG1      THR  81   7.231 -10.648   4.019
 1503   HG21  THR  81          HG21      THR  81   7.066  -6.599   3.572
 1504   HG22  THR  81          HG22      THR  81   8.532  -7.456   3.095
 1505   HG23  THR  81          HG23      THR  81   8.091  -7.346   4.798
 1506    H    THR  82           H        THR  82   5.427  -6.524   5.844
 1507    HA   THR  82           HA       THR  82   2.925  -5.839   4.622
 1508    HB   THR  82           HB       THR  82   3.206  -3.693   5.940
 1509    HG1  THR  82           HG1      THR  82   5.194  -3.389   6.581
 1510   HG21  THR  82          HG21      THR  82   2.713  -4.768   8.078
 1511   HG22  THR  82          HG22      THR  82   3.316  -6.300   7.450
 1512   HG23  THR  82          HG23      THR  82   1.871  -5.568   6.753
 1513    H    THR  83           H        THR  83   2.525  -4.498   3.005
 1514    HA   THR  83           HA       THR  83   4.767  -3.275   1.599
 1515    HB   THR  83           HB       THR  83   1.866  -3.211   0.763
 1516    HG1  THR  83           HG1      THR  83   3.755  -5.303   0.630
 1517   HG21  THR  83          HG21      THR  83   2.793  -3.002  -1.475
 1518   HG22  THR  83          HG22      THR  83   4.429  -3.165  -0.838
 1519   HG23  THR  83          HG23      THR  83   3.462  -1.746  -0.432
 1520    H    HIS  84           H        HIS  84   5.218  -1.167   1.812
 1521    HA   HIS  84           HA       HIS  84   3.198   0.524   3.101
 1522    HB2  HIS  84           HB3      HIS  84   5.308   1.808   3.980
 1523    HB3  HIS  84           HB2      HIS  84   4.729   0.378   4.819
 1524    HD1  HIS  84           HD1      HIS  84   6.328  -1.473   5.146
 1525    HD2  HIS  84           HD2      HIS  84   7.667   1.279   2.321
 1526    HE1  HIS  84           HE1      HIS  84   8.695  -2.148   4.598
 1527    HE2  HIS  84           HE2      HIS  84   9.520  -0.400   2.980
 1528    H    THR  85           H        THR  85   2.811   2.476   2.309
 1529    HA   THR  85           HA       THR  85   4.284   3.221  -0.137
 1530    HB   THR  85           HB       THR  85   1.864   2.627  -0.470
 1531    HG1  THR  85           HG1      THR  85   1.869   4.065  -2.026
 1532   HG21  THR  85          HG21      THR  85   0.951   3.422   1.638
 1533   HG22  THR  85          HG22      THR  85   0.156   4.240   0.292
 1534   HG23  THR  85          HG23      THR  85   1.393   5.081   1.226
 1535    H    PHE  86           H        PHE  86   4.254   5.650  -0.527
 1536    HA   PHE  86           HA       PHE  86   4.901   6.943   2.028
 1537    HB2  PHE  86           HB3      PHE  86   5.851   7.586  -0.780
 1538    HB3  PHE  86           HB2      PHE  86   6.253   8.533   0.654
 1539    HD1  PHE  86           HD1      PHE  86   7.661   7.553   2.427
 1540    HD2  PHE  86           HD2      PHE  86   6.961   5.541  -1.257
 1541    HE1  PHE  86           HE1      PHE  86   9.586   6.087   2.869
 1542    HE2  PHE  86           HE2      PHE  86   8.885   4.069  -0.822
 1543    HZ   PHE  86           HZ       PHE  86  10.200   4.340   1.241
 1544    H    VAL  87           H        VAL  87   3.498   8.342   2.769
 1545    HA   VAL  87           HA       VAL  87   1.614   9.567   0.872
 1546    HB   VAL  87           HB       VAL  87   0.066   9.816   2.787
 1547   HG11  VAL  87          HG11      VAL  87   1.022   6.992   2.365
 1548   HG12  VAL  87          HG12      VAL  87  -0.072   7.874   1.302
 1549   HG13  VAL  87          HG13      VAL  87  -0.570   7.480   2.948
 1550   HG21  VAL  87          HG21      VAL  87   0.493   8.637   4.874
 1551   HG22  VAL  87          HG22      VAL  87   1.716   9.877   4.594
 1552   HG23  VAL  87          HG23      VAL  87   2.096   8.179   4.301
 1553    H    LYS  88           H        LYS  88   0.938  11.715   1.258
 1554    HA   LYS  88           HA       LYS  88   3.139  13.402   2.101
 1555    HB2  LYS  88           HB3      LYS  88   0.489  14.126   0.821
 1556    HB3  LYS  88           HB2      LYS  88   1.868  15.199   1.027
 1557    HG2  LYS  88           HG3      LYS  88   3.144  14.046  -0.561
 1558    HG3  LYS  88           HG2      LYS  88   2.071  12.651  -0.536
 1559    HD2  LYS  88           HD3      LYS  88   0.301  14.003  -1.557
 1560    HD3  LYS  88           HD2      LYS  88   1.387  15.395  -1.585
 1561    HE2  LYS  88           HE3      LYS  88   1.229  14.195  -3.753
 1562    HE3  LYS  88           HE2      LYS  88   2.866  14.289  -3.106
 1563    HZ1  LYS  88           HZ1      LYS  88   2.598  12.019  -2.273
 1564    HZ2  LYS  88           HZ2      LYS  88   2.435  12.091  -3.955
 1565    HZ3  LYS  88           HZ3      LYS  88   1.064  11.934  -2.976
 1566    H    ALA  89           H        ALA  89   3.250  13.906   4.177
 1567    HA   ALA  89           HA       ALA  89   0.754  14.677   5.550
 1568    HB1  ALA  89           HB1      ALA  89   3.010  13.090   6.770
 1569    HB2  ALA  89           HB2      ALA  89   1.441  12.444   6.297
 1570    HB3  ALA  89           HB3      ALA  89   1.549  13.631   7.596
 1571    H    LEU  90           H        LEU  90   0.852  16.492   6.777
 1572    HA   LEU  90           HA       LEU  90   3.167  18.160   6.560
 1573    HB2  LEU  90           HB3      LEU  90   0.843  19.060   6.587
 1574    HB3  LEU  90           HB2      LEU  90   0.693  18.538   8.258
 1575    HG   LEU  90           HG       LEU  90   2.625  20.061   8.812
 1576   HD11  LEU  90          HD11      LEU  90   3.079  21.880   7.215
 1577   HD12  LEU  90          HD12      LEU  90   2.107  21.036   6.009
 1578   HD13  LEU  90          HD13      LEU  90   3.592  20.303   6.616
 1579   HD21  LEU  90          HD21      LEU  90   0.136  21.319   7.667
 1580   HD22  LEU  90          HD22      LEU  90   1.253  22.087   8.795
 1581   HD23  LEU  90          HD23      LEU  90   0.323  20.675   9.299
 1582    H    THR  91           H        THR  91   4.891  17.942   7.783
 1583    HA   THR  91           HA       THR  91   4.575  16.825  10.492
 1584    HB   THR  91           HB       THR  91   6.777  15.753  10.204
 1585    HG1  THR  91           HG1      THR  91   6.593  17.046   7.700
 1586   HG21  THR  91          HG21      THR  91   4.796  14.431   9.677
 1587   HG22  THR  91          HG22      THR  91   6.110  14.018   8.579
 1588   HG23  THR  91          HG23      THR  91   4.795  15.055   8.030
 1589    H    THR  92           H        THR  92   6.448  17.371  11.932
 1590    HA   THR  92           HA       THR  92   7.624  19.962  11.198
 1591    HB   THR  92           HB       THR  92   5.943  20.407  12.869
 1592    HG1  THR  92           HG1      THR  92   7.814  21.619  13.127
 1593   HG21  THR  92          HG21      THR  92   5.981  19.410  15.093
 1594   HG22  THR  92          HG22      THR  92   7.345  18.394  14.628
 1595   HG23  THR  92          HG23      THR  92   5.775  18.168  13.857
 1596    H    ASP  93           H        ASP  93   9.690  19.679  10.837
 1597    HA   ASP  93           HA       ASP  93  11.137  17.443  11.920
 1598    HB2  ASP  93           HB3      ASP  93  11.524  18.285   9.608
 1599    HB3  ASP  93           HB2      ASP  93  12.162  19.780  10.288
 1600    H    GLU  94           H        GLU  94  11.258  20.968  12.281
 1601    HA   GLU  94           HA       GLU  94  12.628  20.542  14.851
 1602    HB2  GLU  94           HB3      GLU  94  13.186  22.603  12.740
 1603    HB3  GLU  94           HB2      GLU  94  13.585  22.914  14.422
 1604    HG2  GLU  94           HG3      GLU  94  14.584  20.575  12.823
 1605    HG3  GLU  94           HG2      GLU  94  15.475  22.070  13.082
 1606    H    LYS  95           H        LYS  95  11.225  23.408  13.262
 1607    HA   LYS  95           HA       LYS  95   9.426  23.672  15.582
 1608    HB2  LYS  95           HB3      LYS  95  10.864  25.882  14.096
 1609    HB3  LYS  95           HB2      LYS  95   9.670  26.130  15.360
 1610    HG2  LYS  95           HG3      LYS  95  11.130  24.978  16.953
 1611    HG3  LYS  95           HG2      LYS  95  12.328  24.757  15.680
 1612    HD2  LYS  95           HD3      LYS  95  12.478  27.197  15.431
 1613    HD3  LYS  95           HD2      LYS  95  11.334  27.391  16.760
 1614    HE2  LYS  95           HE3      LYS  95  12.895  26.211  18.245
 1615    HE3  LYS  95           HE2      LYS  95  14.036  26.066  16.911
 1616    HZ1  LYS  95           HZ1      LYS  95  14.606  27.912  18.344
 1617    HZ2  LYS  95           HZ2      LYS  95  13.084  28.607  18.111
 1618    HZ3  LYS  95           HZ3      LYS  95  14.161  28.483  16.816
 1619    H    GLN  96           H        GLN  96   9.932  24.647  12.208
 1620    HA   GLN  96           HA       GLN  96   7.189  25.413  11.853
 1621    HB2  GLN  96           HB3      GLN  96   9.466  25.060   9.895
 1622    HB3  GLN  96           HB2      GLN  96   7.877  25.666   9.454
 1623    HG2  GLN  96           HG3      GLN  96   9.720  26.952  11.457
 1624    HG3  GLN  96           HG2      GLN  96   9.538  27.451   9.776
 1625   HE21  GLN  96          HE21      GLN  96   8.092  27.415  12.932
 1626   HE22  GLN  96          HE22      GLN  96   6.803  28.509  12.579
 1627    H    ALA  97           H        ALA  97   6.155  24.481   9.700
 1628    HA   ALA  97           HA       ALA  97   6.220  21.549   9.953
 1629    HB1  ALA  97           HB1      ALA  97   4.215  22.497  11.002
 1630    HB2  ALA  97           HB2      ALA  97   3.818  21.507   9.599
 1631    HB3  ALA  97           HB3      ALA  97   3.788  23.266   9.473
 1632    H    ALA  98           H        ALA  98   6.374  20.408   8.128
 1633    HA   ALA  98           HA       ALA  98   5.839  21.676   5.551
 1634    HB1  ALA  98           HB1      ALA  98   7.991  20.925   4.645
 1635    HB2  ALA  98           HB2      ALA  98   8.459  20.342   6.242
 1636    HB3  ALA  98           HB3      ALA  98   8.217  22.068   5.968
 1637    H    TRP  99           H        TRP  99   5.325  20.214   3.916
 1638    HA   TRP  99           HA       TRP  99   4.260  17.715   4.818
 1639    HB2  TRP  99           HB3      TRP  99   4.341  19.130   2.172
 1640    HB3  TRP  99           HB2      TRP  99   3.828  17.451   2.263
 1641    HD1  TRP  99           HD1      TRP  99   1.469  16.944   3.366
 1642    HE1  TRP  99           HE1      TRP  99  -0.536  18.443   3.955
 1643    HE3  TRP  99           HE3      TRP  99   3.737  21.512   3.017
 1644    HZ2  TRP  99           HZ2      TRP  99  -1.088  21.190   4.238
 1645    HZ3  TRP  99           HZ3      TRP  99   2.395  23.529   3.467
 1646    HH2  TRP  99           HH2      TRP  99   0.033  23.369   4.064
 1647    H    ARG 100           H        ARG 100   5.328  15.921   5.035
 1648    HA   ARG 100           HA       ARG 100   7.650  15.401   3.302
 1649    HB2  ARG 100           HB3      ARG 100   6.943  14.268   6.021
 1650    HB3  ARG 100           HB2      ARG 100   8.296  13.715   5.046
 1651    HG2  ARG 100           HG3      ARG 100   7.950  16.500   6.140
 1652    HG3  ARG 100           HG2      ARG 100   8.980  15.243   6.824
 1653    HD2  ARG 100           HD3      ARG 100  10.263  15.190   4.717
 1654    HD3  ARG 100           HD2      ARG 100   9.258  16.502   4.100
 1655    HE   ARG 100           HE       ARG 100  10.709  16.946   6.594
 1656   HH11  ARG 100          HH11      ARG 100  10.423  17.534   3.156
 1657   HH12  ARG 100          HH12      ARG 100  11.492  18.901   3.173
 1658   HH21  ARG 100          HH21      ARG 100  12.093  18.758   6.626
 1659   HH22  ARG 100          HH22      ARG 100  12.429  19.610   5.153
 1660    H    PHE 101           H        PHE 101   7.985  13.001   2.950
 1661    HA   PHE 101           HA       PHE 101   5.387  11.793   2.230
 1662    HB2  PHE 101           HB3      PHE 101   8.060  11.162   0.954
 1663    HB3  PHE 101           HB2      PHE 101   6.457  10.739   0.365
 1664    HD1  PHE 101           HD1      PHE 101   4.884  12.820  -0.074
 1665    HD2  PHE 101           HD2      PHE 101   9.137  12.936  -0.017
 1666    HE1  PHE 101           HE1      PHE 101   4.843  14.874  -1.427
 1667    HE2  PHE 101           HE2      PHE 101   9.101  14.988  -1.371
 1668    HZ   PHE 101           HZ       PHE 101   6.953  15.960  -2.075
 1669    H    ILE 102           H        ILE 102   4.924  10.363   3.802
 1670    HA   ILE 102           HA       ILE 102   7.200   8.986   5.073
 1671    HB   ILE 102           HB       ILE 102   5.738   8.798   7.083
 1672   HG12  ILE 102          HG13      ILE 102   3.963  10.761   5.623
 1673   HG13  ILE 102          HG12      ILE 102   3.580   9.061   5.844
 1674   HG21  ILE 102          HG21      ILE 102   6.305  11.583   6.077
 1675   HG22  ILE 102          HG22      ILE 102   7.412  10.536   6.969
 1676   HG23  ILE 102          HG23      ILE 102   5.964  11.164   7.755
 1677   HD11  ILE 102          HD11      ILE 102   3.931  11.094   8.032
 1678   HD12  ILE 102          HD12      ILE 102   3.557   9.386   8.262
 1679   HD13  ILE 102          HD13      ILE 102   2.403  10.439   7.447
 1680    H    ARG 103           H        ARG 103   7.063   6.828   5.550
 1681    HA   ARG 103           HA       ARG 103   5.352   5.391   3.712
 1682    HB2  ARG 103           HB3      ARG 103   6.709   3.436   4.251
 1683    HB3  ARG 103           HB2      ARG 103   7.736   4.811   3.869
 1684    HG2  ARG 103           HG3      ARG 103   8.190   5.158   6.225
 1685    HG3  ARG 103           HG2      ARG 103   7.093   3.845   6.647
 1686    HD2  ARG 103           HD3      ARG 103   8.555   2.324   5.272
 1687    HD3  ARG 103           HD2      ARG 103   9.703   3.658   5.155
 1688    HE   ARG 103           HE       ARG 103   9.164   3.324   7.849
 1689   HH11  ARG 103          HH11      ARG 103  10.576   1.464   5.242
 1690   HH12  ARG 103          HH12      ARG 103  11.576   0.512   6.292
 1691   HH21  ARG 103          HH21      ARG 103  10.488   2.089   9.232
 1692   HH22  ARG 103          HH22      ARG 103  11.535   0.876   8.564
 1693    H    ILE 104           H        ILE 104   3.501   4.498   4.206
 1694    HA   ILE 104           HA       ILE 104   3.081   3.558   6.968
 1695    HB   ILE 104           HB       ILE 104   0.644   3.851   6.616
 1696   HG12  ILE 104          HG13      ILE 104   1.416   5.418   4.150
 1697   HG13  ILE 104          HG12      ILE 104   0.756   3.788   4.108
 1698   HG21  ILE 104          HG21      ILE 104   2.285   6.356   6.294
 1699   HG22  ILE 104          HG22      ILE 104   1.882   5.553   7.812
 1700   HG23  ILE 104          HG23      ILE 104   0.609   6.297   6.841
 1701   HD11  ILE 104          HD11      ILE 104  -1.297   4.582   5.136
 1702   HD12  ILE 104          HD12      ILE 104  -0.941   5.475   3.657
 1703   HD13  ILE 104          HD13      ILE 104  -0.628   6.210   5.228
 1704    H    ASP 105           H        ASP 105   2.493   1.476   7.217
 1705    HA   ASP 105           HA       ASP 105   2.631  -0.243   4.898
 1706    HB2  ASP 105           HB3      ASP 105   2.230  -0.868   7.838
 1707    HB3  ASP 105           HB2      ASP 105   2.363  -2.092   6.576
 1708    H    THR 106           H        THR 106   0.920  -0.674   3.693
 1709    HA   THR 106           HA       THR 106  -1.731  -0.434   4.952
 1710    HB   THR 106           HB       THR 106  -1.344   1.569   3.656
 1711    HG1  THR 106           HG1      THR 106  -3.211  -0.311   2.760
 1712   HG21  THR 106          HG21      THR 106  -0.920   1.500   1.245
 1713   HG22  THR 106          HG22      THR 106  -0.794  -0.258   1.319
 1714   HG23  THR 106          HG23      THR 106   0.388   0.750   2.156
 1715    H    ALA 107           H        ALA 107   0.050  -2.756   4.215
 1716    HA   ALA 107           HA       ALA 107  -2.000  -4.541   3.493
 1717    HB1  ALA 107           HB1      ALA 107  -1.687  -3.611   1.244
 1718    HB2  ALA 107           HB2      ALA 107  -1.193  -5.302   1.314
 1719    HB3  ALA 107           HB3      ALA 107   0.025  -4.028   1.313
 1720    H    CYS 108           H        CYS 108  -1.273  -6.749   3.595
 1721    HA   CYS 108           HA       CYS 108   1.584  -7.106   4.161
 1722    HB2  CYS 108           HB3      CYS 108   0.310  -7.233   6.309
 1723    HB3  CYS 108           HB2      CYS 108  -0.635  -8.563   5.632
 1724    H    VAL 109           H        VAL 109   2.420  -8.331   2.642
 1725    HA   VAL 109           HA       VAL 109   0.609 -10.128   1.178
 1726    HB   VAL 109           HB       VAL 109   2.140  -9.945  -0.716
 1727   HG11  VAL 109          HG11      VAL 109   1.789  -7.563  -1.247
 1728   HG12  VAL 109          HG12      VAL 109   1.341  -7.276   0.436
 1729   HG13  VAL 109          HG13      VAL 109   0.349  -8.329  -0.574
 1730   HG21  VAL 109          HG21      VAL 109   3.730  -8.044   1.011
 1731   HG22  VAL 109          HG22      VAL 109   4.028  -8.389  -0.693
 1732   HG23  VAL 109          HG23      VAL 109   4.239  -9.658   0.515
 1733    H    CYS 110           H        CYS 110   1.220 -12.226   0.734
 1734    HA   CYS 110           HA       CYS 110   3.333 -13.302   2.431
 1735    HB2  CYS 110           HB3      CYS 110   1.100 -14.397   2.421
 1736    HB3  CYS 110           HB2      CYS 110   1.306 -14.761   0.715
 1737    H    VAL 111           H        VAL 111   5.308 -13.508   1.614
 1738    HA   VAL 111           HA       VAL 111   5.591 -13.619  -1.305
 1739    HB   VAL 111           HB       VAL 111   7.908 -13.004  -0.996
 1740   HG11  VAL 111          HG11      VAL 111   6.090 -11.313   0.714
 1741   HG12  VAL 111          HG12      VAL 111   6.312 -11.180  -1.031
 1742   HG13  VAL 111          HG13      VAL 111   7.644 -10.802   0.060
 1743   HG21  VAL 111          HG21      VAL 111   7.377 -13.142   1.966
 1744   HG22  VAL 111          HG22      VAL 111   8.871 -12.600   1.203
 1745   HG23  VAL 111          HG23      VAL 111   8.355 -14.278   1.036
 1746    H    LEU 112           H        LEU 112   7.050 -15.163  -2.262
 1747    HA   LEU 112           HA       LEU 112   7.061 -17.663  -0.709
 1748    HB2  LEU 112           HB3      LEU 112   6.903 -17.310  -3.706
 1749    HB3  LEU 112           HB2      LEU 112   6.856 -18.840  -2.846
 1750    HG   LEU 112           HG       LEU 112   4.754 -16.667  -2.783
 1751   HD11  LEU 112          HD11      LEU 112   3.332 -18.405  -3.771
 1752   HD12  LEU 112          HD12      LEU 112   4.721 -19.489  -3.845
 1753   HD13  LEU 112          HD13      LEU 112   4.707 -18.007  -4.802
 1754   HD21  LEU 112          HD21      LEU 112   3.472 -18.236  -1.377
 1755   HD22  LEU 112          HD22      LEU 112   4.921 -17.627  -0.581
 1756   HD23  LEU 112          HD23      LEU 112   4.905 -19.257  -1.251
 1757    H    SER 113           H        SER 113   8.857 -18.833  -0.533
 1758    HA   SER 113           HA       SER 113  11.183 -18.086  -2.178
 1759    HB2  SER 113           HB3      SER 113  11.529 -17.529   0.212
 1760    HB3  SER 113           HB2      SER 113  11.184 -19.204   0.642
 1761    HG   SER 113           HG       SER 113  13.495 -18.412   0.299
 1762    H    ARG 114           H        ARG 114  12.296 -19.773  -3.136
 1763    HA   ARG 114           HA       ARG 114  10.732 -22.161  -3.509
 1764    HB2  ARG 114           HB3      ARG 114  11.970 -20.924  -5.338
 1765    HB3  ARG 114           HB2      ARG 114  13.461 -21.562  -4.659
 1766    HG2  ARG 114           HG3      ARG 114  12.769 -23.820  -5.124
 1767    HG3  ARG 114           HG2      ARG 114  11.178 -23.263  -5.648
 1768    HD2  ARG 114           HD3      ARG 114  12.204 -22.053  -7.499
 1769    HD3  ARG 114           HD2      ARG 114  13.802 -22.574  -6.969
 1770    HE   ARG 114           HE       ARG 114  12.108 -24.807  -7.405
 1771   HH11  ARG 114          HH11      ARG 114  13.917 -22.357  -9.118
 1772   HH12  ARG 114          HH12      ARG 114  14.204 -23.354 -10.507
 1773   HH21  ARG 114          HH21      ARG 114  12.486 -26.133  -9.235
 1774   HH22  ARG 114          HH22      ARG 114  13.395 -25.501 -10.571
 1775    H    LYS 115           H        LYS 115  12.506 -21.379  -1.031
 1776    HA   LYS 115           HA       LYS 115  13.527 -22.500   0.661
 1777    HB2  LYS 115           HB3      LYS 115  12.983 -25.055  -0.869
 1778    HB3  LYS 115           HB2      LYS 115  13.309 -24.909   0.847
 1779    HG2  LYS 115           HG3      LYS 115  11.152 -23.611   1.023
 1780    HG3  LYS 115           HG2      LYS 115  10.835 -24.093  -0.649
 1781    HD2  LYS 115           HD3      LYS 115  11.173 -25.883   1.746
 1782    HD3  LYS 115           HD2      LYS 115   9.725 -25.660   0.767
 1783    HE2  LYS 115           HE3      LYS 115  12.314 -26.839  -0.220
 1784    HE3  LYS 115           HE2      LYS 115  10.921 -27.780   0.299
 1785    HZ1  LYS 115           HZ1      LYS 115   9.661 -27.016  -1.504
 1786    HZ2  LYS 115           HZ2      LYS 115  11.171 -27.392  -2.167
 1787    HZ3  LYS 115           HZ3      LYS 115  10.753 -25.779  -1.879
 1788    H    ALA 116           H        ALA 116  15.068 -21.389  -1.294
 1789    HA   ALA 116           HA       ALA 116  17.361 -23.207  -1.392
 1790    HB1  ALA 116           HB1      ALA 116  16.414 -21.529  -3.713
 1791    HB2  ALA 116           HB2      ALA 116  16.293 -23.285  -3.591
 1792    HB3  ALA 116           HB3      ALA 116  17.877 -22.513  -3.673
 1793    H    THR 117           H        THR 117  19.384 -22.164  -1.437
 1794    HA   THR 117           HA       THR 117  19.343 -19.274  -0.923
 1795    HB   THR 117           HB       THR 117  21.337 -19.792   0.652
 1796    HG1  THR 117           HG1      THR 117  21.725 -21.849   0.920
 1797   HG21  THR 117          HG21      THR 117  19.833 -20.094   2.571
 1798   HG22  THR 117          HG22      THR 117  18.520 -20.517   1.472
 1799   HG23  THR 117          HG23      THR 117  19.208 -18.894   1.441
 1800    H    ARG 118           H        ARG 118  21.532 -18.291  -1.227
 1801    HA   ARG 118           HA       ARG 118  22.568 -19.065  -3.747
 1802    HB2  ARG 118           HB3      ARG 118  24.358 -17.291  -3.213
 1803    HB3  ARG 118           HB2      ARG 118  22.699 -16.768  -3.387
 1804    HG2  ARG 118           HG3      ARG 118  23.436 -15.582  -1.550
 1805    HG3  ARG 118           HG2      ARG 118  22.589 -16.942  -0.824
 1806    HD2  ARG 118           HD3      ARG 118  24.668 -16.537   0.346
 1807    HD3  ARG 118           HD2      ARG 118  24.739 -18.084  -0.492
 1808    HE   ARG 118           HE       ARG 118  25.960 -15.652  -1.629
 1809   HH11  ARG 118          HH11      ARG 118  26.124 -19.027  -0.718
 1810   HH12  ARG 118          HH12      ARG 118  27.761 -19.225  -1.261
 1811   HH21  ARG 118          HH21      ARG 118  28.106 -15.920  -2.372
 1812   HH22  ARG 118          HH22      ARG 118  28.885 -17.459  -2.209
  Start of MODEL    8
    1    H1   SER   1           H1       SER   1  20.930   2.828   3.165
    2    H2   SER   1           H2       SER   1  22.413   2.393   3.841
    3    H3   SER   1           H3       SER   1  20.976   1.873   4.560
    4    HA   SER   1           HA       SER   1  20.455   0.532   2.654
    5    HB2  SER   1           HB3      SER   1  22.341   0.255   0.949
    6    HB3  SER   1           HB2      SER   1  21.423   1.759   0.872
    7    HG   SER   1           HG       SER   1  24.071   1.345   1.434
    8    H    SER   2           H        SER   2  20.519  -1.014   4.219
    9    HA   SER   2           HA       SER   2  22.980  -2.560   4.383
   10    HB2  SER   2           HB3      SER   2  21.492  -1.648   6.864
   11    HB3  SER   2           HB2      SER   2  22.873  -2.745   6.835
   12    HG   SER   2           HG       SER   2  23.943  -0.873   5.695
   13    H    THR   3           H        THR   3  19.679  -2.322   5.698
   14    HA   THR   3           HA       THR   3  19.290  -5.174   5.439
   15    HB   THR   3           HB       THR   3  16.891  -4.480   6.158
   16    HG1  THR   3           HG1      THR   3  17.306  -2.381   7.475
   17   HG21  THR   3          HG21      THR   3  17.586  -4.360   8.509
   18   HG22  THR   3          HG22      THR   3  19.245  -4.053   8.000
   19   HG23  THR   3          HG23      THR   3  18.484  -5.600   7.632
   20    H    HIS   4           H        HIS   4  19.496  -5.451   3.201
   21    HA   HIS   4           HA       HIS   4  17.250  -4.410   1.605
   22    HB2  HIS   4           HB3      HIS   4  19.519  -3.250   1.241
   23    HB3  HIS   4           HB2      HIS   4  20.042  -4.763   0.516
   24    HD1  HIS   4           HD1      HIS   4  18.078  -1.705  -0.151
   25    HD2  HIS   4           HD2      HIS   4  18.791  -5.370  -1.977
   26    HE1  HIS   4           HE1      HIS   4  17.338  -1.425  -2.535
   27    HE2  HIS   4           HE2      HIS   4  18.040  -3.561  -3.667
   28    HA   PRO   5           HA       PRO   5  17.714  -9.001   1.129
   29    HB2  PRO   5           HB3      PRO   5  15.383  -9.793   2.192
   30    HB3  PRO   5           HB2      PRO   5  16.774  -9.396   3.208
   31    HG2  PRO   5           HG3      PRO   5  14.310  -7.818   2.670
   32    HG3  PRO   5           HG2      PRO   5  15.292  -7.899   4.140
   33    HD2  PRO   5           HD3      PRO   5  15.373  -5.880   2.179
   34    HD3  PRO   5           HD2      PRO   5  16.551  -6.133   3.478
   35    H    VAL   6           H        VAL   6  17.479  -7.998  -1.091
   36    HA   VAL   6           HA       VAL   6  16.552  -7.940  -3.157
   37    HB   VAL   6           HB       VAL   6  14.463  -9.839  -2.093
   38   HG11  VAL   6          HG11      VAL   6  15.456  -9.334  -4.896
   39   HG12  VAL   6          HG12      VAL   6  13.897  -8.832  -4.243
   40   HG13  VAL   6          HG13      VAL   6  14.265 -10.547  -4.427
   41   HG21  VAL   6          HG21      VAL   6  16.687 -10.725  -1.655
   42   HG22  VAL   6          HG22      VAL   6  17.137 -10.464  -3.341
   43   HG23  VAL   6          HG23      VAL   6  15.891 -11.642  -2.933
   44    H    PHE   7           H        PHE   7  16.055  -5.718  -2.542
   45    HA   PHE   7           HA       PHE   7  13.180  -5.263  -2.166
   46    HB2  PHE   7           HB3      PHE   7  14.681  -4.258  -0.453
   47    HB3  PHE   7           HB2      PHE   7  15.455  -3.317  -1.720
   48    HD1  PHE   7           HD1      PHE   7  12.043  -3.981  -0.351
   49    HD2  PHE   7           HD2      PHE   7  14.742  -1.162  -2.056
   50    HE1  PHE   7           HE1      PHE   7  10.376  -2.205  -0.041
   51    HE2  PHE   7           HE2      PHE   7  13.076   0.621  -1.750
   52    HZ   PHE   7           HZ       PHE   7  10.891   0.104  -0.740
   53    H    HIS   8           H        HIS   8  15.709  -5.089  -4.405
   54    HA   HIS   8           HA       HIS   8  14.523  -3.037  -6.065
   55    HB2  HIS   8           HB3      HIS   8  17.035  -3.639  -5.903
   56    HB3  HIS   8           HB2      HIS   8  16.641  -4.999  -6.943
   57    HD1  HIS   8           HD1      HIS   8  17.224  -1.355  -6.967
   58    HD2  HIS   8           HD2      HIS   8  15.845  -4.269  -9.593
   59    HE1  HIS   8           HE1      HIS   8  17.289  -0.296  -9.249
   60    HE2  HIS   8           HE2      HIS   8  16.473  -2.085 -10.828
   61    H    MET   9           H        MET   9  12.495  -4.346  -5.786
   62    HA   MET   9           HA       MET   9  11.627  -5.598  -8.108
   63    HB2  MET   9           HB3      MET   9  13.124  -7.472  -7.432
   64    HB3  MET   9           HB2      MET   9  12.290  -7.568  -5.889
   65    HG2  MET   9           HG3      MET   9  10.176  -7.992  -7.263
   66    HG3  MET   9           HG2      MET   9  11.267  -8.277  -8.614
   67    HE1  MET   9           HE1      MET   9  13.417 -11.278  -7.157
   68    HE2  MET   9           HE2      MET   9  13.752  -9.557  -6.960
   69    HE3  MET   9           HE3      MET   9  13.218 -10.180  -8.522
   70    H    GLY  10           H        GLY  10  11.502  -5.225  -4.671
   71    HA2  GLY  10           HA3      GLY  10   9.447  -4.131  -3.806
   72    HA3  GLY  10           HA2      GLY  10   8.559  -5.338  -4.728
   73    H    GLU  11           H        GLU  11   7.884  -5.321  -2.189
   74    HA   GLU  11           HA       GLU  11   9.566  -7.131  -0.676
   75    HB2  GLU  11           HB3      GLU  11   7.696  -6.986   1.025
   76    HB3  GLU  11           HB2      GLU  11   8.521  -5.478   0.654
   77    HG2  GLU  11           HG3      GLU  11   5.975  -6.197  -0.744
   78    HG3  GLU  11           HG2      GLU  11   5.950  -5.500   0.874
   79    H    PHE  12           H        PHE  12   8.496  -8.039  -3.177
   80    HA   PHE  12           HA       PHE  12   7.733  -9.932  -4.133
   81    HB2  PHE  12           HB3      PHE  12   7.853 -10.910  -1.286
   82    HB3  PHE  12           HB2      PHE  12   7.396 -11.953  -2.629
   83    HD1  PHE  12           HD1      PHE  12  10.118 -10.222  -0.953
   84    HD2  PHE  12           HD2      PHE  12   9.030 -12.573  -4.328
   85    HE1  PHE  12           HE1      PHE  12  12.491 -10.705  -1.380
   86    HE2  PHE  12           HE2      PHE  12  11.400 -13.059  -4.762
   87    HZ   PHE  12           HZ       PHE  12  13.135 -12.127  -3.286
   88    H    SER  13           H        SER  13   5.866 -11.470  -4.250
   89    HA   SER  13           HA       SER  13   3.543 -11.104  -2.696
   90    HB2  SER  13           HB3      SER  13   3.434  -8.968  -3.965
   91    HB3  SER  13           HB2      SER  13   3.460  -9.877  -5.470
   92    HG   SER  13           HG       SER  13   1.332  -9.181  -4.497
   93    H    VAL  14           H        VAL  14   1.897 -12.575  -3.306
   94    HA   VAL  14           HA       VAL  14   2.847 -14.862  -4.780
   95    HB   VAL  14           HB       VAL  14   0.677 -15.889  -4.182
   96   HG11  VAL  14          HG11      VAL  14   2.107 -14.518  -1.910
   97   HG12  VAL  14          HG12      VAL  14   2.510 -16.082  -2.621
   98   HG13  VAL  14          HG13      VAL  14   1.001 -15.880  -1.735
   99   HG21  VAL  14          HG21      VAL  14  -0.914 -14.719  -2.779
  100   HG22  VAL  14          HG22      VAL  14  -0.687 -13.843  -4.292
  101   HG23  VAL  14          HG23      VAL  14   0.085 -13.266  -2.816
  102    H    CYS  15           H        CYS  15   1.406 -12.024  -5.630
  103    HA   CYS  15           HA       CYS  15   0.421 -13.154  -8.160
  104    HB2  CYS  15           HB3      CYS  15  -1.463 -12.428  -6.680
  105    HB3  CYS  15           HB2      CYS  15  -0.783 -10.800  -6.672
  106    H    ASP  16           H        ASP  16   0.698 -11.701  -9.996
  107    HA   ASP  16           HA       ASP  16   3.214 -10.333  -9.809
  108    HB2  ASP  16           HB3      ASP  16   2.242 -11.650 -11.838
  109    HB3  ASP  16           HB2      ASP  16   1.393 -10.149 -12.200
  110    H    SER  17           H        SER  17   3.448  -8.347  -9.111
  111    HA   SER  17           HA       SER  17   1.162  -6.506  -9.281
  112    HB2  SER  17           HB3      SER  17   3.433  -6.512  -7.276
  113    HB3  SER  17           HB2      SER  17   2.005  -5.469  -7.245
  114    HG   SER  17           HG       SER  17   1.699  -8.268  -7.275
  115    H    VAL  18           H        VAL  18   1.427  -4.574 -10.262
  116    HA   VAL  18           HA       VAL  18   4.143  -3.929 -11.192
  117    HB   VAL  18           HB       VAL  18   2.688  -4.309 -13.055
  118   HG11  VAL  18          HG11      VAL  18   0.535  -3.991 -12.010
  119   HG12  VAL  18          HG12      VAL  18   0.661  -2.991 -13.456
  120   HG13  VAL  18          HG13      VAL  18   0.835  -2.259 -11.859
  121   HG21  VAL  18          HG21      VAL  18   4.293  -2.527 -13.335
  122   HG22  VAL  18          HG22      VAL  18   3.157  -1.363 -12.655
  123   HG23  VAL  18          HG23      VAL  18   2.806  -2.136 -14.199
  124    H    SER  19           H        SER  19   5.089  -2.377 -10.080
  125    HA   SER  19           HA       SER  19   3.471  -0.373  -8.700
  126    HB2  SER  19           HB3      SER  19   6.437  -0.974  -8.499
  127    HB3  SER  19           HB2      SER  19   5.546   0.162  -7.486
  128    HG   SER  19           HG       SER  19   4.358  -1.559  -6.651
  129    H    VAL  20           H        VAL  20   3.133   1.519  -9.627
  130    HA   VAL  20           HA       VAL  20   5.148   2.550 -11.514
  131    HB   VAL  20           HB       VAL  20   2.175   3.083 -11.555
  132   HG11  VAL  20          HG11      VAL  20   3.452   4.929 -12.448
  133   HG12  VAL  20          HG12      VAL  20   2.614   4.085 -13.750
  134   HG13  VAL  20          HG13      VAL  20   4.342   3.834 -13.506
  135   HG21  VAL  20          HG21      VAL  20   3.815   1.311 -13.357
  136   HG22  VAL  20          HG22      VAL  20   2.104   1.691 -13.561
  137   HG23  VAL  20          HG23      VAL  20   2.644   0.771 -12.155
  138    H    TRP  21           H        TRP  21   5.881   4.588 -11.176
  139    HA   TRP  21           HA       TRP  21   4.750   6.084  -8.928
  140    HB2  TRP  21           HB3      TRP  21   7.317   6.476 -10.498
  141    HB3  TRP  21           HB2      TRP  21   6.775   7.541  -9.205
  142    HD1  TRP  21           HD1      TRP  21   8.402   4.164  -9.818
  143    HE1  TRP  21           HE1      TRP  21   9.218   3.198  -7.581
  144    HE3  TRP  21           HE3      TRP  21   6.216   7.523  -6.632
  145    HZ2  TRP  21           HZ2      TRP  21   8.973   3.777  -4.829
  146    HZ3  TRP  21           HZ3      TRP  21   6.559   7.242  -4.208
  147    HH2  TRP  21           HH2      TRP  21   7.907   5.408  -3.330
  148    H    VAL  22           H        VAL  22   2.953   7.032  -9.710
  149    HA   VAL  22           HA       VAL  22   2.951   8.214 -12.365
  150    HB   VAL  22           HB       VAL  22   0.735   8.097 -10.312
  151   HG11  VAL  22          HG11      VAL  22   0.416   9.869 -11.956
  152   HG12  VAL  22          HG12      VAL  22  -0.749   8.567 -12.195
  153   HG13  VAL  22          HG13      VAL  22   0.646   8.708 -13.264
  154   HG21  VAL  22          HG21      VAL  22  -0.144   6.233 -11.624
  155   HG22  VAL  22          HG22      VAL  22   1.454   5.864 -10.974
  156   HG23  VAL  22          HG23      VAL  22   1.270   6.299 -12.672
  157    H    GLY  23           H        GLY  23   3.703  10.214 -12.608
  158    HA2  GLY  23           HA3      GLY  23   3.763  12.003 -10.312
  159    HA3  GLY  23           HA2      GLY  23   4.549  12.273 -11.865
  160    H    ASP  24           H        ASP  24   1.688  11.398 -12.909
  161    HA   ASP  24           HA       ASP  24   0.318  13.929 -12.398
  162    HB2  ASP  24           HB3      ASP  24   1.256  12.987 -15.096
  163    HB3  ASP  24           HB2      ASP  24  -0.169  14.013 -14.950
  164    H    LYS  25           H        LYS  25  -0.895  12.210 -11.179
  165    HA   LYS  25           HA       LYS  25  -2.630  10.492 -12.675
  166    HB2  LYS  25           HB3      LYS  25  -1.976  10.140 -10.270
  167    HB3  LYS  25           HB2      LYS  25  -2.975  11.523  -9.851
  168    HG2  LYS  25           HG3      LYS  25  -4.950  10.382 -10.654
  169    HG3  LYS  25           HG2      LYS  25  -3.972   9.003 -11.159
  170    HD2  LYS  25           HD3      LYS  25  -3.268   8.712  -8.795
  171    HD3  LYS  25           HD2      LYS  25  -4.380  10.008  -8.346
  172    HE2  LYS  25           HE3      LYS  25  -5.435   7.858  -7.957
  173    HE3  LYS  25           HE2      LYS  25  -6.247   8.695  -9.282
  174    HZ1  LYS  25           HZ1      LYS  25  -4.972   7.340 -10.846
  175    HZ2  LYS  25           HZ2      LYS  25  -5.907   6.383  -9.817
  176    HZ3  LYS  25           HZ3      LYS  25  -4.236   6.519  -9.556
  177    H    THR  26           H        THR  26  -4.567  11.001 -13.595
  178    HA   THR  26           HA       THR  26  -5.119  13.830 -13.776
  179    HB   THR  26           HB       THR  26  -5.065  12.579 -15.847
  180    HG1  THR  26           HG1      THR  26  -6.627  14.355 -15.518
  181   HG21  THR  26          HG21      THR  26  -5.791  10.394 -15.052
  182   HG22  THR  26          HG22      THR  26  -6.786  10.922 -16.405
  183   HG23  THR  26          HG23      THR  26  -7.411  11.021 -14.760
  184    H    THR  27           H        THR  27  -6.855  10.959 -12.630
  185    HA   THR  27           HA       THR  27  -8.699  12.740 -11.238
  186    HB   THR  27           HB       THR  27 -10.535  10.999 -11.886
  187    HG1  THR  27           HG1      THR  27  -9.575  10.779 -14.393
  188   HG21  THR  27          HG21      THR  27  -9.563  13.089 -13.836
  189   HG22  THR  27          HG22      THR  27 -10.635  13.365 -12.463
  190   HG23  THR  27          HG23      THR  27 -11.176  12.373 -13.818
  191    H    ALA  28           H        ALA  28  -9.569  11.915  -9.361
  192    HA   ALA  28           HA       ALA  28  -9.141   9.125  -8.695
  193    HB1  ALA  28           HB1      ALA  28  -7.018  10.223  -8.044
  194    HB2  ALA  28           HB2      ALA  28  -7.892   9.522  -6.683
  195    HB3  ALA  28           HB3      ALA  28  -7.933  11.265  -6.953
  196    H    THR  29           H        THR  29 -10.159   8.568  -6.627
  197    HA   THR  29           HA       THR  29 -12.552  10.203  -6.220
  198    HB   THR  29           HB       THR  29 -12.068   7.423  -5.162
  199    HG1  THR  29           HG1      THR  29 -12.224   8.106  -7.709
  200   HG21  THR  29          HG21      THR  29 -14.508   7.311  -5.132
  201   HG22  THR  29          HG22      THR  29 -14.600   8.947  -5.784
  202   HG23  THR  29          HG23      THR  29 -13.932   8.674  -4.174
  203    H    ASP  30           H        ASP  30 -12.563  11.520  -4.554
  204    HA   ASP  30           HA       ASP  30 -10.784  11.345  -2.331
  205    HB2  ASP  30           HB3      ASP  30 -11.716  13.507  -3.014
  206    HB3  ASP  30           HB2      ASP  30 -13.355  12.920  -2.728
  207    H    ILE  31           H        ILE  31 -11.468  11.021  -0.111
  208    HA   ILE  31           HA       ILE  31 -12.651   8.526   0.280
  209    HB   ILE  31           HB       ILE  31 -11.007   9.525   1.803
  210   HG12  ILE  31          HG13      ILE  31 -13.615   8.939   3.228
  211   HG13  ILE  31          HG12      ILE  31 -12.498   7.718   2.626
  212   HG21  ILE  31          HG21      ILE  31 -13.240  11.375   2.620
  213   HG22  ILE  31          HG22      ILE  31 -11.772  11.823   1.753
  214   HG23  ILE  31          HG23      ILE  31 -11.672  11.244   3.416
  215   HD11  ILE  31          HD11      ILE  31 -10.777   8.560   4.149
  216   HD12  ILE  31          HD12      ILE  31 -12.226   8.037   5.007
  217   HD13  ILE  31          HD13      ILE  31 -11.918   9.756   4.761
  218    H    LYS  32           H        LYS  32 -14.135  11.597  -0.072
  219    HA   LYS  32           HA       LYS  32 -16.597  10.895   1.278
  220    HB2  LYS  32           HB3      LYS  32 -15.958  13.186  -0.585
  221    HB3  LYS  32           HB2      LYS  32 -17.391  13.052   0.429
  222    HG2  LYS  32           HG3      LYS  32 -16.173  13.398   2.391
  223    HG3  LYS  32           HG2      LYS  32 -14.637  13.024   1.610
  224    HD2  LYS  32           HD3      LYS  32 -15.111  15.078   0.153
  225    HD3  LYS  32           HD2      LYS  32 -16.319  15.497   1.372
  226    HE2  LYS  32           HE3      LYS  32 -14.148  16.588   1.784
  227    HE3  LYS  32           HE2      LYS  32 -14.623  15.507   3.094
  228    HZ1  LYS  32           HZ1      LYS  32 -12.901  14.473   0.941
  229    HZ2  LYS  32           HZ2      LYS  32 -12.999  14.004   2.566
  230    HZ3  LYS  32           HZ3      LYS  32 -12.218  15.444   2.150
  231    H    GLY  33           H        GLY  33 -15.247   9.846  -1.503
  232    HA2  GLY  33           HA3      GLY  33 -16.226   8.412  -3.058
  233    HA3  GLY  33           HA2      GLY  33 -17.815   8.920  -2.491
  234    H    LYS  34           H        LYS  34 -15.451  11.298  -3.347
  235    HA   LYS  34           HA       LYS  34 -17.099  11.998  -5.674
  236    HB2  LYS  34           HB3      LYS  34 -15.253  13.740  -4.039
  237    HB3  LYS  34           HB2      LYS  34 -16.242  14.284  -5.385
  238    HG2  LYS  34           HG3      LYS  34 -17.264  13.179  -2.779
  239    HG3  LYS  34           HG2      LYS  34 -17.238  14.875  -3.249
  240    HD2  LYS  34           HD3      LYS  34 -18.725  14.355  -5.135
  241    HD3  LYS  34           HD2      LYS  34 -18.787  12.673  -4.606
  242    HE2  LYS  34           HE3      LYS  34 -19.673  15.045  -2.980
  243    HE3  LYS  34           HE2      LYS  34 -20.748  13.977  -3.872
  244    HZ1  LYS  34           HZ1      LYS  34 -20.667  13.380  -1.542
  245    HZ2  LYS  34           HZ2      LYS  34 -18.993  13.181  -1.613
  246    HZ3  LYS  34           HZ3      LYS  34 -20.001  12.141  -2.478
  247    H    GLU  35           H        GLU  35 -16.246  11.897  -7.645
  248    HA   GLU  35           HA       GLU  35 -13.426  11.256  -7.943
  249    HB2  GLU  35           HB3      GLU  35 -15.051   9.939  -9.210
  250    HB3  GLU  35           HB2      GLU  35 -15.664  11.400  -9.968
  251    HG2  GLU  35           HG3      GLU  35 -13.515  11.742 -11.064
  252    HG3  GLU  35           HG2      GLU  35 -12.887  10.288 -10.295
  253    H    VAL  36           H        VAL  36 -11.992  12.816  -8.191
  254    HA   VAL  36           HA       VAL  36 -12.841  15.310  -9.494
  255    HB   VAL  36           HB       VAL  36 -11.339  16.515  -7.835
  256   HG11  VAL  36          HG11      VAL  36 -13.759  16.681  -7.732
  257   HG12  VAL  36          HG12      VAL  36 -13.082  16.603  -6.104
  258   HG13  VAL  36          HG13      VAL  36 -13.840  15.176  -6.814
  259   HG21  VAL  36          HG21      VAL  36 -10.163  14.552  -6.978
  260   HG22  VAL  36          HG22      VAL  36 -11.675  13.931  -6.313
  261   HG23  VAL  36          HG23      VAL  36 -10.979  15.424  -5.679
  262    H    THR  37           H        THR  37 -11.057  16.652 -10.234
  263    HA   THR  37           HA       THR  37  -9.091  15.050 -11.610
  264    HB   THR  37           HB       THR  37  -9.502  18.044 -11.677
  265    HG1  THR  37           HG1      THR  37 -11.330  16.590 -12.325
  266   HG21  THR  37          HG21      THR  37  -7.334  17.326 -12.556
  267   HG22  THR  37          HG22      THR  37  -8.380  17.908 -13.852
  268   HG23  THR  37          HG23      THR  37  -8.140  16.175 -13.622
  269    H    VAL  38           H        VAL  38  -7.087  14.724 -10.931
  270    HA   VAL  38           HA       VAL  38  -6.241  15.994  -8.462
  271    HB   VAL  38           HB       VAL  38  -4.961  13.748 -10.028
  272   HG11  VAL  38          HG11      VAL  38  -4.433  14.716  -7.222
  273   HG12  VAL  38          HG12      VAL  38  -3.354  14.895  -8.606
  274   HG13  VAL  38          HG13      VAL  38  -3.717  13.290  -7.971
  275   HG21  VAL  38          HG21      VAL  38  -5.918  12.287  -8.306
  276   HG22  VAL  38          HG22      VAL  38  -7.165  13.129  -9.228
  277   HG23  VAL  38          HG23      VAL  38  -6.749  13.675  -7.604
  278    H    LEU  39           H        LEU  39  -4.626  17.418  -8.263
  279    HA   LEU  39           HA       LEU  39  -3.116  18.149 -10.676
  280    HB2  LEU  39           HB3      LEU  39  -3.430  19.663  -8.074
  281    HB3  LEU  39           HB2      LEU  39  -2.624  20.246  -9.520
  282    HG   LEU  39           HG       LEU  39  -5.574  19.648  -9.296
  283   HD11  LEU  39          HD11      LEU  39  -4.075  22.260  -9.333
  284   HD12  LEU  39          HD12      LEU  39  -4.989  21.584  -7.982
  285   HD13  LEU  39          HD13      LEU  39  -5.827  22.091  -9.448
  286   HD21  LEU  39          HD21      LEU  39  -3.952  20.867 -11.521
  287   HD22  LEU  39          HD22      LEU  39  -5.713  20.782 -11.470
  288   HD23  LEU  39          HD23      LEU  39  -4.760  19.299 -11.549
  289    H    ALA  40           H        ALA  40  -1.036  17.623 -10.783
  290    HA   ALA  40           HA       ALA  40   0.243  16.122  -8.741
  291    HB1  ALA  40           HB1      ALA  40   0.736  15.830 -11.125
  292    HB2  ALA  40           HB2      ALA  40   2.192  16.183 -10.193
  293    HB3  ALA  40           HB3      ALA  40   1.440  17.447 -11.168
  294    H    GLU  41           H        GLU  41  -0.018  19.434  -9.463
  295    HA   GLU  41           HA       GLU  41   2.239  20.158  -7.740
  296    HB2  GLU  41           HB3      GLU  41   0.649  21.783  -9.739
  297    HB3  GLU  41           HB2      GLU  41   1.996  22.392  -8.789
  298    HG2  GLU  41           HG3      GLU  41   2.384  20.013 -10.538
  299    HG3  GLU  41           HG2      GLU  41   2.352  21.627 -11.247
  300    H    VAL  42           H        VAL  42   1.686  20.615  -5.705
  301    HA   VAL  42           HA       VAL  42  -1.061  21.417  -5.157
  302    HB   VAL  42           HB       VAL  42  -0.524  21.065  -2.763
  303   HG11  VAL  42          HG11      VAL  42  -0.400  18.634  -2.879
  304   HG12  VAL  42          HG12      VAL  42   0.132  18.736  -4.558
  305   HG13  VAL  42          HG13      VAL  42  -1.485  19.278  -4.111
  306   HG21  VAL  42          HG21      VAL  42   2.133  20.042  -3.762
  307   HG22  VAL  42          HG22      VAL  42   1.538  19.964  -2.104
  308   HG23  VAL  42          HG23      VAL  42   1.886  21.527  -2.844
  309    H    ASN  43           H        ASN  43  -1.305  23.466  -5.597
  310    HA   ASN  43           HA       ASN  43   0.627  25.484  -4.928
  311    HB2  ASN  43           HB3      ASN  43  -2.264  25.825  -5.787
  312    HB3  ASN  43           HB2      ASN  43  -1.018  27.068  -5.797
  313   HD21  ASN  43          HD21      ASN  43  -2.351  24.339  -7.431
  314   HD22  ASN  43          HD22      ASN  43  -1.373  24.440  -8.851
  315    H    ILE  44           H        ILE  44   0.939  25.633  -2.761
  316    HA   ILE  44           HA       ILE  44  -1.257  25.615  -0.907
  317    HB   ILE  44           HB       ILE  44   1.631  26.396  -0.440
  318   HG12  ILE  44          HG13      ILE  44   0.217  23.766   0.066
  319   HG13  ILE  44          HG12      ILE  44   1.356  24.065  -1.245
  320   HG21  ILE  44          HG21      ILE  44  -0.555  25.677   1.508
  321   HG22  ILE  44          HG22      ILE  44   0.137  27.281   1.266
  322   HG23  ILE  44          HG23      ILE  44   1.130  25.982   1.924
  323   HD11  ILE  44          HD11      ILE  44   3.122  24.473   0.400
  324   HD12  ILE  44          HD12      ILE  44   2.413  22.868   0.579
  325   HD13  ILE  44          HD13      ILE  44   1.975  24.155   1.702
  326    H    ASN  45           H        ASN  45   1.251  28.119  -1.258
  327    HA   ASN  45           HA       ASN  45  -0.866  30.113  -1.685
  328    HB2  ASN  45           HB3      ASN  45   1.539  30.641   0.081
  329    HB3  ASN  45           HB2      ASN  45   0.181  31.717  -0.214
  330   HD21  ASN  45          HD21      ASN  45  -1.845  31.225   0.752
  331   HD22  ASN  45          HD22      ASN  45  -1.926  30.206   2.151
  332    H    ASN  46           H        ASN  46   2.654  29.975  -1.368
  333    HA   ASN  46           HA       ASN  46   2.884  30.990  -4.121
  334    HB2  ASN  46           HB3      ASN  46   4.903  32.218  -3.434
  335    HB3  ASN  46           HB2      ASN  46   3.496  32.759  -2.525
  336   HD21  ASN  46          HD21      ASN  46   6.565  31.175  -2.388
  337   HD22  ASN  46          HD22      ASN  46   6.666  31.073  -0.664
  338    H    SER  47           H        SER  47   3.714  28.637  -1.816
  339    HA   SER  47           HA       SER  47   5.966  27.648  -3.379
  340    HB2  SER  47           HB3      SER  47   4.844  26.637  -0.751
  341    HB3  SER  47           HB2      SER  47   6.373  26.159  -1.491
  342    HG   SER  47           HG       SER  47   6.875  28.515  -1.356
  343    H    VAL  48           H        VAL  48   5.757  26.014  -4.756
  344    HA   VAL  48           HA       VAL  48   3.272  24.431  -4.692
  345    HB   VAL  48           HB       VAL  48   4.989  25.058  -7.101
  346   HG11  VAL  48          HG11      VAL  48   3.121  24.145  -8.386
  347   HG12  VAL  48          HG12      VAL  48   2.288  23.742  -6.883
  348   HG13  VAL  48          HG13      VAL  48   3.809  22.946  -7.291
  349   HG21  VAL  48          HG21      VAL  48   3.201  26.548  -7.814
  350   HG22  VAL  48          HG22      VAL  48   3.873  27.066  -6.268
  351   HG23  VAL  48          HG23      VAL  48   2.324  26.227  -6.317
  352    H    PHE  49           H        PHE  49   3.542  22.328  -4.272
  353    HA   PHE  49           HA       PHE  49   6.199  21.145  -4.761
  354    HB2  PHE  49           HB3      PHE  49   4.294  20.584  -2.472
  355    HB3  PHE  49           HB2      PHE  49   5.751  19.652  -2.802
  356    HD1  PHE  49           HD1      PHE  49   4.388  22.613  -1.284
  357    HD2  PHE  49           HD2      PHE  49   7.979  20.780  -2.649
  358    HE1  PHE  49           HE1      PHE  49   5.707  24.187   0.078
  359    HE2  PHE  49           HE2      PHE  49   9.301  22.350  -1.293
  360    HZ   PHE  49           HZ       PHE  49   8.164  24.054   0.072
  361    H    ARG  50           H        ARG  50   6.176  18.790  -5.099
  362    HA   ARG  50           HA       ARG  50   3.626  17.719  -6.056
  363    HB2  ARG  50           HB3      ARG  50   4.574  16.991  -8.164
  364    HB3  ARG  50           HB2      ARG  50   4.788  18.728  -8.015
  365    HG2  ARG  50           HG3      ARG  50   7.119  18.353  -7.327
  366    HG3  ARG  50           HG2      ARG  50   6.885  16.618  -7.551
  367    HD2  ARG  50           HD3      ARG  50   7.966  17.550  -9.497
  368    HD3  ARG  50           HD2      ARG  50   6.335  17.024  -9.916
  369    HE   ARG  50           HE       ARG  50   5.797  19.533  -9.500
  370   HH11  ARG  50          HH11      ARG  50   8.730  18.265 -10.958
  371   HH12  ARG  50          HH12      ARG  50   9.002  19.675 -11.932
  372   HH21  ARG  50          HH21      ARG  50   6.158  21.381 -10.772
  373   HH22  ARG  50          HH22      ARG  50   7.541  21.446 -11.826
  374    H    GLN  51           H        GLN  51   3.794  15.353  -6.508
  375    HA   GLN  51           HA       GLN  51   6.105  13.988  -5.413
  376    HB2  GLN  51           HB3      GLN  51   5.031  12.790  -3.714
  377    HB3  GLN  51           HB2      GLN  51   4.343  14.397  -3.529
  378    HG2  GLN  51           HG3      GLN  51   2.310  13.743  -4.560
  379    HG3  GLN  51           HG2      GLN  51   2.999  12.213  -5.102
  380   HE21  GLN  51          HE21      GLN  51   3.348  10.560  -3.583
  381   HE22  GLN  51          HE22      GLN  51   2.533  10.548  -2.053
  382    H    TYR  52           H        TYR  52   5.972  11.632  -5.880
  383    HA   TYR  52           HA       TYR  52   4.315  11.150  -8.261
  384    HB2  TYR  52           HB3      TYR  52   6.715   9.535  -7.353
  385    HB3  TYR  52           HB2      TYR  52   5.914   9.469  -8.919
  386    HD1  TYR  52           HD1      TYR  52   5.803  11.920 -10.097
  387    HD2  TYR  52           HD2      TYR  52   8.730  10.629  -7.293
  388    HE1  TYR  52           HE1      TYR  52   7.358  13.622 -10.945
  389    HE2  TYR  52           HE2      TYR  52  10.292  12.325  -8.136
  390    HH   TYR  52           HH       TYR  52  10.649  13.633 -10.230
  391    H    PHE  53           H        PHE  53   2.676   9.764  -8.114
  392    HA   PHE  53           HA       PHE  53   2.085   8.615  -5.545
  393    HB2  PHE  53           HB3      PHE  53   0.561   8.400  -8.156
  394    HB3  PHE  53           HB2      PHE  53  -0.048   7.945  -6.566
  395    HD1  PHE  53           HD1      PHE  53  -0.056   9.837  -4.778
  396    HD2  PHE  53           HD2      PHE  53   0.134  10.513  -8.973
  397    HE1  PHE  53           HE1      PHE  53  -0.894  12.126  -4.441
  398    HE2  PHE  53           HE2      PHE  53  -0.701  12.803  -8.646
  399    HZ   PHE  53           HZ       PHE  53  -1.216  13.612  -6.380
  400    H    PHE  54           H        PHE  54   2.533   6.644  -4.900
  401    HA   PHE  54           HA       PHE  54   3.788   4.766  -6.711
  402    HB2  PHE  54           HB3      PHE  54   4.713   5.167  -4.454
  403    HB3  PHE  54           HB2      PHE  54   3.210   4.610  -3.733
  404    HD1  PHE  54           HD1      PHE  54   3.075   2.424  -3.024
  405    HD2  PHE  54           HD2      PHE  54   5.888   3.445  -6.049
  406    HE1  PHE  54           HE1      PHE  54   3.982   0.141  -2.944
  407    HE2  PHE  54           HE2      PHE  54   6.798   1.161  -5.977
  408    HZ   PHE  54           HZ       PHE  54   5.845  -0.495  -4.422
  409    H    GLU  55           H        GLU  55   2.200   3.973  -8.047
  410    HA   GLU  55           HA       GLU  55  -0.149   2.753  -6.768
  411    HB2  GLU  55           HB3      GLU  55   0.259   3.370  -9.705
  412    HB3  GLU  55           HB2      GLU  55  -1.214   2.773  -8.960
  413    HG2  GLU  55           HG3      GLU  55  -1.127   4.950  -7.568
  414    HG3  GLU  55           HG2      GLU  55   0.002   5.504  -8.811
  415    H    THR  56           H        THR  56   0.373   0.725  -6.225
  416    HA   THR  56           HA       THR  56   1.637  -0.978  -8.248
  417    HB   THR  56           HB       THR  56   1.032  -1.617  -5.356
  418    HG1  THR  56           HG1      THR  56   2.724  -0.375  -5.068
  419   HG21  THR  56          HG21      THR  56   1.152  -3.606  -6.774
  420   HG22  THR  56          HG22      THR  56   2.550  -3.517  -5.702
  421   HG23  THR  56          HG23      THR  56   2.712  -3.074  -7.403
  422    H    LYS  57           H        LYS  57   0.341  -2.066  -9.539
  423    HA   LYS  57           HA       LYS  57  -2.411  -2.607  -8.625
  424    HB2  LYS  57           HB3      LYS  57  -1.431  -1.923 -11.406
  425    HB3  LYS  57           HB2      LYS  57  -3.099  -2.279 -10.972
  426    HG2  LYS  57           HG3      LYS  57  -3.204  -0.326  -9.572
  427    HG3  LYS  57           HG2      LYS  57  -1.494   0.002  -9.839
  428    HD2  LYS  57           HD3      LYS  57  -2.000   0.271 -12.262
  429    HD3  LYS  57           HD2      LYS  57  -3.714   0.115 -11.872
  430    HE2  LYS  57           HE3      LYS  57  -3.559   2.050 -10.400
  431    HE3  LYS  57           HE2      LYS  57  -1.846   2.200 -10.770
  432    HZ1  LYS  57           HZ1      LYS  57  -4.096   2.548 -12.672
  433    HZ2  LYS  57           HZ2      LYS  57  -2.461   2.576 -13.102
  434    HZ3  LYS  57           HZ3      LYS  57  -3.081   3.760 -12.067
  435    H    CYS  58           H        CYS  58  -3.485  -4.389  -9.790
  436    HA   CYS  58           HA       CYS  58  -1.743  -6.702  -9.838
  437    HB2  CYS  58           HB3      CYS  58  -4.744  -6.496 -10.192
  438    HB3  CYS  58           HB2      CYS  58  -3.842  -7.998 -10.037
  439    H    ARG  59           H        ARG  59  -0.677  -7.133 -11.660
  440    HA   ARG  59           HA       ARG  59  -2.204  -7.026 -14.170
  441    HB2  ARG  59           HB3      ARG  59  -0.060  -6.902 -15.360
  442    HB3  ARG  59           HB2      ARG  59  -0.262  -5.553 -14.255
  443    HG2  ARG  59           HG3      ARG  59   1.276  -6.474 -12.711
  444    HG3  ARG  59           HG2      ARG  59   1.323  -8.010 -13.576
  445    HD2  ARG  59           HD3      ARG  59   2.395  -6.955 -15.462
  446    HD3  ARG  59           HD2      ARG  59   2.240  -5.372 -14.705
  447    HE   ARG  59           HE       ARG  59   3.720  -7.352 -13.181
  448   HH11  ARG  59          HH11      ARG  59   3.889  -4.747 -15.530
  449   HH12  ARG  59          HH12      ARG  59   5.553  -4.391 -15.199
  450   HH21  ARG  59          HH21      ARG  59   5.910  -6.868 -12.752
  451   HH22  ARG  59          HH22      ARG  59   6.696  -5.578 -13.608
  452    H    ALA  60           H        ALA  60  -2.552  -8.895 -15.215
  453    HA   ALA  60           HA       ALA  60  -2.779 -11.142 -15.501
  454    HB1  ALA  60           HB1      ALA  60   0.056 -11.266 -14.470
  455    HB2  ALA  60           HB2      ALA  60  -0.410 -11.016 -16.152
  456    HB3  ALA  60           HB3      ALA  60  -0.790 -12.539 -15.348
  457    H    SER  61           H        SER  61  -4.368 -11.084 -13.834
  458    HA   SER  61           HA       SER  61  -3.766 -11.422 -11.094
  459    HB2  SER  61           HB3      SER  61  -5.883 -10.448 -11.851
  460    HB3  SER  61           HB2      SER  61  -6.337 -11.983 -12.592
  461    HG   SER  61           HG       SER  61  -5.796 -12.663 -10.193
  462    H    ASN  62           H        ASN  62  -3.665 -13.615 -13.654
  463    HA   ASN  62           HA       ASN  62  -3.567 -15.830 -11.723
  464    HB2  ASN  62           HB3      ASN  62  -4.689 -15.924 -14.536
  465    HB3  ASN  62           HB2      ASN  62  -4.372 -17.344 -13.550
  466   HD21  ASN  62          HD21      ASN  62  -5.251 -16.006 -11.082
  467   HD22  ASN  62          HD22      ASN  62  -6.976 -15.959 -11.173
  468    HA   PRO  63           HA       PRO  63   0.563 -15.389 -13.905
  469    HB2  PRO  63           HB3      PRO  63   1.871 -16.358 -11.639
  470    HB3  PRO  63           HB2      PRO  63   1.705 -14.650 -12.068
  471    HG2  PRO  63           HG3      PRO  63   0.121 -16.293 -10.143
  472    HG3  PRO  63           HG2      PRO  63   0.624 -14.597 -10.026
  473    HD2  PRO  63           HD3      PRO  63  -1.907 -15.274 -10.660
  474    HD3  PRO  63           HD2      PRO  63  -1.114 -13.853 -11.387
  475    H    VAL  64           H        VAL  64  -0.892 -17.823 -11.842
  476    HA   VAL  64           HA       VAL  64   0.124 -19.906 -13.659
  477    HB   VAL  64           HB       VAL  64  -0.364 -21.518 -11.802
  478   HG11  VAL  64          HG11      VAL  64   1.615 -20.908 -10.432
  479   HG12  VAL  64          HG12      VAL  64   1.654 -19.350 -11.257
  480   HG13  VAL  64          HG13      VAL  64   1.907 -20.837 -12.168
  481   HG21  VAL  64          HG21      VAL  64  -0.636 -20.685  -9.536
  482   HG22  VAL  64          HG22      VAL  64  -1.955 -20.124 -10.563
  483   HG23  VAL  64          HG23      VAL  64  -0.647 -19.026 -10.132
  484    H    GLU  65           H        GLU  65  -1.474 -21.689 -14.041
  485    HA   GLU  65           HA       GLU  65  -3.983 -20.451 -14.737
  486    HB2  GLU  65           HB3      GLU  65  -2.699 -22.019 -16.239
  487    HB3  GLU  65           HB2      GLU  65  -3.172 -23.328 -15.164
  488    HG2  GLU  65           HG3      GLU  65  -5.527 -22.835 -15.624
  489    HG3  GLU  65           HG2      GLU  65  -5.033 -21.553 -16.728
  490    H    SER  66           H        SER  66  -4.192 -20.230 -12.259
  491    HA   SER  66           HA       SER  66  -6.328 -21.940 -11.416
  492    HB2  SER  66           HB3      SER  66  -3.802 -21.973  -9.726
  493    HB3  SER  66           HB2      SER  66  -5.318 -22.794  -9.361
  494    HG   SER  66           HG       SER  66  -4.582 -23.587 -11.767
  495    H    GLY  67           H        GLY  67  -3.864 -19.605 -10.445
  496    HA2  GLY  67           HA3      GLY  67  -5.461 -17.445  -9.934
  497    HA3  GLY  67           HA2      GLY  67  -5.444 -18.359  -8.424
  498    H    CYS  68           H        CYS  68  -4.031 -17.476  -7.051
  499    HA   CYS  68           HA       CYS  68  -1.626 -16.175  -7.975
  500    HB2  CYS  68           HB3      CYS  68  -2.531 -16.898  -5.171
  501    HB3  CYS  68           HB2      CYS  68  -1.162 -15.851  -5.568
  502    H    ARG  69           H        ARG  69   0.525 -16.836  -7.074
  503    HA   ARG  69           HA       ARG  69   0.924 -19.626  -7.696
  504    HB2  ARG  69           HB3      ARG  69   2.945 -17.561  -6.784
  505    HB3  ARG  69           HB2      ARG  69   3.315 -19.144  -7.458
  506    HG2  ARG  69           HG3      ARG  69   2.029 -18.328  -9.530
  507    HG3  ARG  69           HG2      ARG  69   2.220 -16.721  -8.829
  508    HD2  ARG  69           HD3      ARG  69   4.022 -17.144 -10.388
  509    HD3  ARG  69           HD2      ARG  69   4.659 -17.073  -8.741
  510    HE   ARG  69           HE       ARG  69   4.138 -19.730  -9.200
  511   HH11  ARG  69          HH11      ARG  69   6.139 -17.273 -10.680
  512   HH12  ARG  69          HH12      ARG  69   7.315 -18.408 -11.264
  513   HH21  ARG  69          HH21      ARG  69   5.672 -21.223  -9.961
  514   HH22  ARG  69          HH22      ARG  69   7.044 -20.660 -10.861
  515    H    GLY  70           H        GLY  70   1.343 -21.261  -6.327
  516    HA2  GLY  70           HA3      GLY  70   2.238 -22.144  -4.282
  517    HA3  GLY  70           HA2      GLY  70   1.832 -20.623  -3.496
  518    H    ILE  71           H        ILE  71  -0.807 -20.436  -4.614
  519    HA   ILE  71           HA       ILE  71  -2.258 -21.797  -2.619
  520    HB   ILE  71           HB       ILE  71  -3.386 -20.664  -5.185
  521   HG12  ILE  71          HG13      ILE  71  -1.977 -18.977  -4.100
  522   HG13  ILE  71          HG12      ILE  71  -3.675 -18.548  -3.965
  523   HG21  ILE  71          HG21      ILE  71  -5.399 -20.287  -3.813
  524   HG22  ILE  71          HG22      ILE  71  -4.607 -21.098  -2.461
  525   HG23  ILE  71          HG23      ILE  71  -4.973 -21.994  -3.936
  526   HD11  ILE  71          HD11      ILE  71  -2.485 -18.089  -1.903
  527   HD12  ILE  71          HD12      ILE  71  -1.984 -19.776  -1.799
  528   HD13  ILE  71          HD13      ILE  71  -3.689 -19.353  -1.659
  529    H    ASP  72           H        ASP  72  -2.903 -23.847  -2.529
  530    HA   ASP  72           HA       ASP  72  -2.340 -25.717  -4.548
  531    HB2  ASP  72           HB3      ASP  72  -3.571 -27.350  -3.204
  532    HB3  ASP  72           HB2      ASP  72  -2.512 -26.375  -2.196
  533    H    SER  73           H        SER  73  -5.124 -23.779  -3.968
  534    HA   SER  73           HA       SER  73  -6.869 -23.225  -5.286
  535    HB2  SER  73           HB3      SER  73  -5.476 -24.884  -7.398
  536    HB3  SER  73           HB2      SER  73  -6.733 -23.674  -7.676
  537    HG   SER  73           HG       SER  73  -4.140 -23.218  -6.595
  538    H    LYS  74           H        LYS  74  -6.510 -26.076  -3.963
  539    HA   LYS  74           HA       LYS  74  -8.925 -27.233  -5.178
  540    HB2  LYS  74           HB3      LYS  74  -6.930 -28.705  -4.987
  541    HB3  LYS  74           HB2      LYS  74  -6.960 -28.481  -3.246
  542    HG2  LYS  74           HG3      LYS  74  -9.112 -29.577  -3.107
  543    HG3  LYS  74           HG2      LYS  74  -9.166 -29.739  -4.863
  544    HD2  LYS  74           HD3      LYS  74  -8.470 -31.827  -3.830
  545    HD3  LYS  74           HD2      LYS  74  -7.156 -31.138  -4.781
  546    HE2  LYS  74           HE3      LYS  74  -6.131 -30.259  -2.767
  547    HE3  LYS  74           HE2      LYS  74  -7.463 -30.877  -1.799
  548    HZ1  LYS  74           HZ1      LYS  74  -6.840 -33.125  -2.509
  549    HZ2  LYS  74           HZ2      LYS  74  -5.600 -32.355  -1.657
  550    HZ3  LYS  74           HZ3      LYS  74  -5.511 -32.490  -3.340
  551    H    HIS  75           H        HIS  75  -7.476 -26.098  -2.192
  552    HA   HIS  75           HA       HIS  75  -9.993 -26.409  -0.742
  553    HB2  HIS  75           HB3      HIS  75  -7.391 -25.165   0.189
  554    HB3  HIS  75           HB2      HIS  75  -8.761 -25.593   1.203
  555    HD1  HIS  75           HD1      HIS  75  -5.602 -26.856  -0.032
  556    HD2  HIS  75           HD2      HIS  75  -9.179 -28.516   1.298
  557    HE1  HIS  75           HE1      HIS  75  -5.076 -29.255   0.527
  558    HE2  HIS  75           HE2      HIS  75  -7.272 -30.261   1.242
  559    H    TRP  76           H        TRP  76  -8.242 -24.068  -2.529
  560    HA   TRP  76           HA       TRP  76 -10.041 -21.945  -1.614
  561    HB2  TRP  76           HB3      TRP  76  -7.032 -21.736  -1.882
  562    HB3  TRP  76           HB2      TRP  76  -8.109 -20.358  -1.651
  563    HD1  TRP  76           HD1      TRP  76  -6.161 -22.897   0.233
  564    HE1  TRP  76           HE1      TRP  76  -6.650 -22.697   2.751
  565    HE3  TRP  76           HE3      TRP  76 -10.250 -19.832   0.035
  566    HZ2  TRP  76           HZ2      TRP  76  -8.509 -21.413   4.427
  567    HZ3  TRP  76           HZ3      TRP  76 -11.323 -19.166   2.142
  568    HH2  TRP  76           HH2      TRP  76 -10.471 -19.942   4.294
  569    H    ASN  77           H        ASN  77 -10.779 -20.641  -3.156
  570    HA   ASN  77           HA       ASN  77  -9.659 -20.796  -5.858
  571    HB2  ASN  77           HB3      ASN  77 -12.083 -20.968  -5.785
  572    HB3  ASN  77           HB2      ASN  77 -12.198 -19.528  -4.787
  573   HD21  ASN  77          HD21      ASN  77 -12.164 -17.542  -5.730
  574   HD22  ASN  77          HD22      ASN  77 -12.139 -17.295  -7.446
  575    H    SER  78           H        SER  78  -8.678 -19.013  -6.806
  576    HA   SER  78           HA       SER  78  -8.007 -16.870  -4.915
  577    HB2  SER  78           HB3      SER  78  -6.262 -18.472  -4.669
  578    HB3  SER  78           HB2      SER  78  -6.131 -18.701  -6.410
  579    HG   SER  78           HG       SER  78  -5.414 -16.400  -4.912
  580    H    TYR  79           H        TYR  79  -7.892 -14.899  -5.744
  581    HA   TYR  79           HA       TYR  79  -6.841 -14.440  -8.366
  582    HB2  TYR  79           HB3      TYR  79  -8.697 -13.079  -9.221
  583    HB3  TYR  79           HB2      TYR  79  -9.208 -14.741  -8.959
  584    HD1  TYR  79           HD1      TYR  79  -9.450 -11.287  -7.629
  585    HD2  TYR  79           HD2      TYR  79 -10.990 -15.255  -7.492
  586    HE1  TYR  79           HE1      TYR  79 -11.394 -10.483  -6.351
  587    HE2  TYR  79           HE2      TYR  79 -12.932 -14.462  -6.210
  588    HH   TYR  79           HH       TYR  79 -13.656 -11.128  -5.835
  589    H    CYS  80           H        CYS  80  -6.767 -11.925  -8.719
  590    HA   CYS  80           HA       CYS  80  -5.657 -10.975  -6.166
  591    HB2  CYS  80           HB3      CYS  80  -4.903 -10.038  -8.938
  592    HB3  CYS  80           HB2      CYS  80  -4.005  -9.803  -7.435
  593    H    THR  81           H        THR  81  -6.084  -8.971  -5.384
  594    HA   THR  81           HA       THR  81  -7.830  -7.216  -6.972
  595    HB   THR  81           HB       THR  81  -8.192  -7.806  -4.019
  596    HG1  THR  81           HG1      THR  81  -9.463  -9.348  -4.679
  597   HG21  THR  81          HG21      THR  81  -8.814  -5.511  -4.610
  598   HG22  THR  81          HG22      THR  81 -10.242  -6.472  -4.232
  599   HG23  THR  81          HG23      THR  81  -9.838  -6.116  -5.910
  600    H    THR  82           H        THR  82  -7.291  -5.063  -6.854
  601    HA   THR  82           HA       THR  82  -4.759  -4.478  -5.564
  602    HB   THR  82           HB       THR  82  -6.427  -2.646  -7.292
  603    HG1  THR  82           HG1      THR  82  -5.253  -4.938  -7.966
  604   HG21  THR  82          HG21      THR  82  -4.243  -1.608  -7.764
  605   HG22  THR  82          HG22      THR  82  -3.482  -2.717  -6.623
  606   HG23  THR  82          HG23      THR  82  -4.656  -1.531  -6.051
  607    H    THR  83           H        THR  83  -4.543  -3.374  -3.713
  608    HA   THR  83           HA       THR  83  -6.944  -2.323  -2.441
  609    HB   THR  83           HB       THR  83  -5.340  -3.826  -1.189
  610    HG1  THR  83           HG1      THR  83  -6.785  -2.568  -0.013
  611   HG21  THR  83          HG21      THR  83  -3.332  -2.801  -0.242
  612   HG22  THR  83          HG22      THR  83  -3.625  -1.339  -1.181
  613   HG23  THR  83          HG23      THR  83  -3.240  -2.852  -2.002
  614    H    HIS  84           H        HIS  84  -6.527  -0.237  -1.092
  615    HA   HIS  84           HA       HIS  84  -5.157   1.722  -2.784
  616    HB2  HIS  84           HB3      HIS  84  -7.207   3.135  -2.874
  617    HB3  HIS  84           HB2      HIS  84  -7.388   1.611  -3.735
  618    HD1  HIS  84           HD1      HIS  84  -9.219   0.042  -2.965
  619    HD2  HIS  84           HD2      HIS  84  -8.702   3.286  -0.416
  620    HE1  HIS  84           HE1      HIS  84 -11.156  -0.035  -1.377
  621    HE2  HIS  84           HE2      HIS  84 -10.661   1.762   0.311
  622    H    THR  85           H        THR  85  -4.489   3.547  -1.751
  623    HA   THR  85           HA       THR  85  -5.211   3.806   1.104
  624    HB   THR  85           HB       THR  85  -2.763   3.307   0.591
  625    HG1  THR  85           HG1      THR  85  -2.306   4.418   2.355
  626   HG21  THR  85          HG21      THR  85  -2.597   4.697  -1.440
  627   HG22  THR  85          HG22      THR  85  -1.379   5.130  -0.244
  628   HG23  THR  85          HG23      THR  85  -2.806   6.144  -0.454
  629    H    PHE  86           H        PHE  86  -4.886   6.227   1.815
  630    HA   PHE  86           HA       PHE  86  -6.137   7.896  -0.266
  631    HB2  PHE  86           HB3      PHE  86  -6.687   7.865   2.714
  632    HB3  PHE  86           HB2      PHE  86  -7.294   9.102   1.612
  633    HD1  PHE  86           HD1      PHE  86  -8.967   8.536  -0.084
  634    HD2  PHE  86           HD2      PHE  86  -7.655   5.679   2.785
  635    HE1  PHE  86           HE1      PHE  86 -10.917   7.129  -0.602
  636    HE2  PHE  86           HE2      PHE  86  -9.600   4.265   2.273
  637    HZ   PHE  86           HZ       PHE  86 -11.234   4.985   0.578
  638    H    VAL  87           H        VAL  87  -4.888   9.469  -0.908
  639    HA   VAL  87           HA       VAL  87  -2.837  10.512   0.941
  640    HB   VAL  87           HB       VAL  87  -1.561  11.160  -1.098
  641   HG11  VAL  87          HG11      VAL  87  -2.236   8.250  -0.746
  642   HG12  VAL  87          HG12      VAL  87  -0.905   9.148  -0.015
  643   HG13  VAL  87          HG13      VAL  87  -0.909   8.836  -1.749
  644   HG21  VAL  87          HG21      VAL  87  -2.159  10.206  -3.254
  645   HG22  VAL  87          HG22      VAL  87  -3.431  11.280  -2.669
  646   HG23  VAL  87          HG23      VAL  87  -3.631   9.530  -2.559
  647    H    LYS  88           H        LYS  88  -2.463  12.743   1.024
  648    HA   LYS  88           HA       LYS  88  -4.688  14.441   0.412
  649    HB2  LYS  88           HB3      LYS  88  -1.896  15.197   1.312
  650    HB3  LYS  88           HB2      LYS  88  -3.281  16.270   1.282
  651    HG2  LYS  88           HG3      LYS  88  -4.372  14.747   2.950
  652    HG3  LYS  88           HG2      LYS  88  -2.827  13.906   3.080
  653    HD2  LYS  88           HD3      LYS  88  -1.763  16.080   3.653
  654    HD3  LYS  88           HD2      LYS  88  -3.367  16.810   3.665
  655    HE2  LYS  88           HE3      LYS  88  -2.717  16.289   5.921
  656    HE3  LYS  88           HE2      LYS  88  -4.033  15.222   5.438
  657    HZ1  LYS  88           HZ1      LYS  88  -1.176  14.438   5.289
  658    HZ2  LYS  88           HZ2      LYS  88  -2.537  13.435   5.141
  659    HZ3  LYS  88           HZ3      LYS  88  -2.155  14.126   6.638
  660    H    ALA  89           H        ALA  89  -5.088  15.040  -1.602
  661    HA   ALA  89           HA       ALA  89  -2.824  16.008  -3.216
  662    HB1  ALA  89           HB1      ALA  89  -5.173  14.441  -4.277
  663    HB2  ALA  89           HB2      ALA  89  -3.540  13.812  -4.055
  664    HB3  ALA  89           HB3      ALA  89  -3.838  15.099  -5.223
  665    H    LEU  90           H        LEU  90  -3.149  17.912  -4.258
  666    HA   LEU  90           HA       LEU  90  -5.535  19.406  -3.677
  667    HB2  LEU  90           HB3      LEU  90  -3.264  20.459  -3.841
  668    HB3  LEU  90           HB2      LEU  90  -3.263  20.089  -5.559
  669    HG   LEU  90           HG       LEU  90  -5.366  21.511  -5.732
  670   HD11  LEU  90          HD11      LEU  90  -5.660  23.191  -3.963
  671   HD12  LEU  90          HD12      LEU  90  -4.467  22.341  -2.980
  672   HD13  LEU  90          HD13      LEU  90  -5.988  21.553  -3.398
  673   HD21  LEU  90          HD21      LEU  90  -4.099  23.597  -5.790
  674   HD22  LEU  90          HD22      LEU  90  -3.180  22.270  -6.502
  675   HD23  LEU  90          HD23      LEU  90  -2.798  22.835  -4.876
  676    H    THR  91           H        THR  91  -7.313  19.454  -4.911
  677    HA   THR  91           HA       THR  91  -7.107  18.311  -7.619
  678    HB   THR  91           HB       THR  91  -9.345  17.326  -7.294
  679    HG1  THR  91           HG1      THR  91  -9.021  18.463  -4.711
  680   HG21  THR  91          HG21      THR  91  -7.300  16.526  -5.217
  681   HG22  THR  91          HG22      THR  91  -7.421  15.912  -6.866
  682   HG23  THR  91          HG23      THR  91  -8.688  15.549  -5.696
  683    H    THR  92           H        THR  92  -8.630  19.099  -9.165
  684    HA   THR  92           HA       THR  92  -9.838  21.660  -8.376
  685    HB   THR  92           HB       THR  92  -8.081  22.074  -9.974
  686    HG1  THR  92           HG1      THR  92  -9.679  23.459 -10.420
  687   HG21  THR  92          HG21      THR  92  -8.102  21.130 -12.236
  688   HG22  THR  92          HG22      THR  92  -9.482  20.122 -11.803
  689   HG23  THR  92          HG23      THR  92  -7.925  19.873 -11.012
  690    H    ASP  93           H        ASP  93 -11.909  21.448  -8.091
  691    HA   ASP  93           HA       ASP  93 -13.370  19.220  -9.129
  692    HB2  ASP  93           HB3      ASP  93 -13.836  20.149  -6.894
  693    HB3  ASP  93           HB2      ASP  93 -14.361  21.659  -7.635
  694    H    GLU  94           H        GLU  94 -13.623  22.735  -9.601
  695    HA   GLU  94           HA       GLU  94 -14.573  22.213 -12.323
  696    HB2  GLU  94           HB3      GLU  94 -15.918  23.926 -10.259
  697    HB3  GLU  94           HB2      GLU  94 -16.084  24.297 -11.966
  698    HG2  GLU  94           HG3      GLU  94 -16.772  21.635 -10.761
  699    HG3  GLU  94           HG2      GLU  94 -17.930  22.943 -10.975
  700    H    LYS  95           H        LYS  95 -14.094  25.163 -10.362
  701    HA   LYS  95           HA       LYS  95 -11.948  25.912 -12.235
  702    HB2  LYS  95           HB3      LYS  95 -14.147  27.685 -11.159
  703    HB3  LYS  95           HB2      LYS  95 -12.734  28.279 -12.016
  704    HG2  LYS  95           HG3      LYS  95 -13.394  27.000 -13.993
  705    HG3  LYS  95           HG2      LYS  95 -14.813  26.409 -13.129
  706    HD2  LYS  95           HD3      LYS  95 -15.616  28.706 -12.887
  707    HD3  LYS  95           HD2      LYS  95 -14.206  29.292 -13.771
  708    HE2  LYS  95           HE3      LYS  95 -14.908  28.012 -15.731
  709    HE3  LYS  95           HE2      LYS  95 -16.303  27.410 -14.841
  710    HZ1  LYS  95           HZ1      LYS  95 -17.134  29.661 -14.669
  711    HZ2  LYS  95           HZ2      LYS  95 -16.885  29.256 -16.289
  712    HZ3  LYS  95           HZ3      LYS  95 -15.785  30.259 -15.492
  713    H    GLN  96           H        GLN  96 -12.436  24.995  -9.224
  714    HA   GLN  96           HA       GLN  96 -10.360  26.789  -8.174
  715    HB2  GLN  96           HB3      GLN  96 -12.853  25.827  -6.777
  716    HB3  GLN  96           HB2      GLN  96 -11.465  26.449  -5.903
  717    HG2  GLN  96           HG3      GLN  96 -12.971  27.994  -8.001
  718    HG3  GLN  96           HG2      GLN  96 -13.279  28.104  -6.268
  719   HE21  GLN  96          HE21      GLN  96 -11.089  28.887  -8.851
  720   HE22  GLN  96          HE22      GLN  96 -10.100  29.981  -7.944
  721    H    ALA  97           H        ALA  97  -8.994  25.864  -6.581
  722    HA   ALA  97           HA       ALA  97  -8.782  22.945  -6.840
  723    HB1  ALA  97           HB1      ALA  97  -6.405  23.207  -6.390
  724    HB2  ALA  97           HB2      ALA  97  -6.620  24.945  -6.191
  725    HB3  ALA  97           HB3      ALA  97  -6.889  24.198  -7.766
  726    H    ALA  98           H        ALA  98  -8.968  21.717  -5.080
  727    HA   ALA  98           HA       ALA  98  -8.717  22.965  -2.438
  728    HB1  ALA  98           HB1      ALA  98 -10.761  21.850  -1.682
  729    HB2  ALA  98           HB2      ALA  98 -11.026  21.229  -3.312
  730    HB3  ALA  98           HB3      ALA  98 -11.095  22.964  -3.007
  731    H    TRP  99           H        TRP  99  -8.113  21.560  -0.780
  732    HA   TRP  99           HA       TRP  99  -6.553  19.310  -1.647
  733    HB2  TRP  99           HB3      TRP  99  -7.119  20.467   1.087
  734    HB3  TRP  99           HB2      TRP  99  -6.112  19.045   0.843
  735    HD1  TRP  99           HD1      TRP  99  -6.169  22.808  -0.041
  736    HE1  TRP  99           HE1      TRP  99  -3.739  23.577  -0.413
  737    HE3  TRP  99           HE3      TRP  99  -3.824  18.288   0.352
  738    HZ2  TRP  99           HZ2      TRP  99  -1.170  22.414  -0.522
  739    HZ3  TRP  99           HZ3      TRP  99  -1.374  18.201   0.105
  740    HH2  TRP  99           HH2      TRP  99  -0.076  20.224  -0.323
  741    H    ARG 100           H        ARG 100  -7.168  17.281  -1.813
  742    HA   ARG 100           HA       ARG 100  -9.473  16.373  -0.229
  743    HB2  ARG 100           HB3      ARG 100  -8.820  15.680  -3.102
  744    HB3  ARG 100           HB2      ARG 100 -10.073  14.895  -2.154
  745    HG2  ARG 100           HG3      ARG 100  -9.996  17.811  -2.902
  746    HG3  ARG 100           HG2      ARG 100 -10.995  16.567  -3.656
  747    HD2  ARG 100           HD3      ARG 100 -12.139  16.193  -1.527
  748    HD3  ARG 100           HD2      ARG 100 -11.131  17.422  -0.768
  749    HE   ARG 100           HE       ARG 100 -13.118  17.949  -2.881
  750   HH11  ARG 100          HH11      ARG 100 -11.213  19.004  -0.128
  751   HH12  ARG 100          HH12      ARG 100 -12.051  20.515   0.023
  752   HH21  ARG 100          HH21      ARG 100 -14.197  19.942  -2.693
  753   HH22  ARG 100          HH22      ARG 100 -13.737  21.058  -1.445
  754    H    PHE 101           H        PHE 101  -9.561  14.018   0.006
  755    HA   PHE 101           HA       PHE 101  -6.851  12.861   0.214
  756    HB2  PHE 101           HB3      PHE 101  -9.311  11.947   1.730
  757    HB3  PHE 101           HB2      PHE 101  -7.636  11.515   2.041
  758    HD1  PHE 101           HD1      PHE 101  -6.064  13.365   2.830
  759    HD2  PHE 101           HD2      PHE 101 -10.303  13.736   2.823
  760    HE1  PHE 101           HE1      PHE 101  -5.905  15.193   4.466
  761    HE2  PHE 101           HE2      PHE 101 -10.149  15.567   4.458
  762    HZ   PHE 101           HZ       PHE 101  -7.947  16.298   5.280
  763    H    ILE 102           H        ILE 102  -6.529  11.537  -1.494
  764    HA   ILE 102           HA       ILE 102  -8.952  10.374  -2.709
  765    HB   ILE 102           HB       ILE 102  -7.710  10.372  -4.851
  766   HG12  ILE 102          HG13      ILE 102  -5.685  12.104  -3.439
  767   HG13  ILE 102          HG12      ILE 102  -5.431  10.395  -3.763
  768   HG21  ILE 102          HG21      ILE 102  -9.253  12.170  -4.356
  769   HG22  ILE 102          HG22      ILE 102  -7.870  12.786  -5.260
  770   HG23  ILE 102          HG23      ILE 102  -7.980  13.061  -3.521
  771   HD11  ILE 102          HD11      ILE 102  -5.833  12.563  -5.809
  772   HD12  ILE 102          HD12      ILE 102  -5.642  10.846  -6.166
  773   HD13  ILE 102          HD13      ILE 102  -4.319  11.745  -5.419
  774    H    ARG 103           H        ARG 103  -8.976   8.322  -3.424
  775    HA   ARG 103           HA       ARG 103  -7.126   6.510  -2.166
  776    HB2  ARG 103           HB3      ARG 103  -8.546   4.731  -3.136
  777    HB3  ARG 103           HB2      ARG 103  -9.495   5.915  -2.247
  778    HG2  ARG 103           HG3      ARG 103 -10.273   6.914  -4.272
  779    HG3  ARG 103           HG2      ARG 103  -9.164   5.944  -5.236
  780    HD2  ARG 103           HD3      ARG 103 -10.361   3.912  -4.550
  781    HD3  ARG 103           HD2      ARG 103 -11.480   4.895  -3.605
  782    HE   ARG 103           HE       ARG 103 -11.696   5.975  -6.057
  783   HH11  ARG 103          HH11      ARG 103 -11.769   2.630  -5.030
  784   HH12  ARG 103          HH12      ARG 103 -12.937   2.161  -6.222
  785   HH21  ARG 103          HH21      ARG 103 -13.221   5.367  -7.622
  786   HH22  ARG 103          HH22      ARG 103 -13.761   3.720  -7.707
  787    H    ILE 104           H        ILE 104  -5.298   5.849  -3.025
  788    HA   ILE 104           HA       ILE 104  -5.170   5.558  -5.957
  789    HB   ILE 104           HB       ILE 104  -2.732   5.888  -5.840
  790   HG12  ILE 104          HG13      ILE 104  -3.197   6.700  -2.965
  791   HG13  ILE 104          HG12      ILE 104  -2.461   5.184  -3.467
  792   HG21  ILE 104          HG21      ILE 104  -2.748   8.308  -5.438
  793   HG22  ILE 104          HG22      ILE 104  -4.326   8.160  -4.670
  794   HG23  ILE 104          HG23      ILE 104  -4.142   7.782  -6.382
  795   HD11  ILE 104          HD11      ILE 104  -0.788   6.801  -2.787
  796   HD12  ILE 104          HD12      ILE 104  -1.373   7.934  -4.005
  797   HD13  ILE 104          HD13      ILE 104  -0.629   6.414  -4.500
  798    H    ASP 105           H        ASP 105  -4.328   3.675  -6.754
  799    HA   ASP 105           HA       ASP 105  -4.546   1.334  -5.196
  800    HB2  ASP 105           HB3      ASP 105  -3.112   1.740  -7.843
  801    HB3  ASP 105           HB2      ASP 105  -3.553   0.180  -7.149
  802    H    THR 106           H        THR 106  -3.082   0.327  -3.906
  803    HA   THR 106           HA       THR 106  -0.403   1.563  -3.871
  804    HB   THR 106           HB       THR 106  -1.699   0.321  -1.459
  805    HG1  THR 106           HG1      THR 106  -2.466   2.543  -2.770
  806   HG21  THR 106          HG21      THR 106  -0.124   1.745  -0.267
  807   HG22  THR 106          HG22      THR 106   0.433   2.441  -1.786
  808   HG23  THR 106          HG23      THR 106   0.739   0.741  -1.428
  809    H    ALA 107           H        ALA 107  -2.157  -1.486  -3.568
  810    HA   ALA 107           HA       ALA 107   0.248  -2.951  -4.175
  811    HB1  ALA 107           HB1      ALA 107   0.458  -2.652  -1.750
  812    HB2  ALA 107           HB2      ALA 107   0.227  -4.344  -2.187
  813    HB3  ALA 107           HB3      ALA 107  -1.117  -3.410  -1.528
  814    H    CYS 108           H        CYS 108  -0.164  -5.212  -4.568
  815    HA   CYS 108           HA       CYS 108  -2.968  -5.709  -5.278
  816    HB2  CYS 108           HB3      CYS 108  -1.379  -5.789  -7.166
  817    HB3  CYS 108           HB2      CYS 108  -0.446  -7.030  -6.324
  818    H    VAL 109           H        VAL 109  -4.051  -7.023  -3.976
  819    HA   VAL 109           HA       VAL 109  -2.508  -8.857  -2.272
  820    HB   VAL 109           HB       VAL 109  -4.335  -8.856  -0.712
  821   HG11  VAL 109          HG11      VAL 109  -3.787  -6.043  -1.647
  822   HG12  VAL 109          HG12      VAL 109  -2.805  -6.981  -0.522
  823   HG13  VAL 109          HG13      VAL 109  -4.437  -6.492  -0.070
  824   HG21  VAL 109          HG21      VAL 109  -6.197  -8.845  -2.288
  825   HG22  VAL 109          HG22      VAL 109  -5.854  -7.163  -2.695
  826   HG23  VAL 109          HG23      VAL 109  -6.394  -7.583  -1.070
  827    H    CYS 110           H        CYS 110  -3.489 -10.958  -1.834
  828    HA   CYS 110           HA       CYS 110  -4.926 -11.956  -4.195
  829    HB2  CYS 110           HB3      CYS 110  -2.658 -12.898  -3.870
  830    HB3  CYS 110           HB2      CYS 110  -3.147 -13.491  -2.289
  831    H    VAL 111           H        VAL 111  -6.922 -12.696  -3.901
  832    HA   VAL 111           HA       VAL 111  -7.923 -12.832  -1.163
  833    HB   VAL 111           HB       VAL 111 -10.105 -12.646  -2.023
  834   HG11  VAL 111          HG11      VAL 111 -10.076 -10.708  -3.446
  835   HG12  VAL 111          HG12      VAL 111  -8.424 -11.055  -3.945
  836   HG13  VAL 111          HG13      VAL 111  -8.760 -10.591  -2.279
  837   HG21  VAL 111          HG21      VAL 111  -9.952 -14.416  -3.699
  838   HG22  VAL 111          HG22      VAL 111  -9.042 -13.336  -4.753
  839   HG23  VAL 111          HG23      VAL 111 -10.719 -12.970  -4.350
  840    H    LEU 112           H        LEU 112  -9.136 -14.637  -0.402
  841    HA   LEU 112           HA       LEU 112  -8.771 -17.100  -1.967
  842    HB2  LEU 112           HB3      LEU 112  -8.601 -16.783   1.031
  843    HB3  LEU 112           HB2      LEU 112  -8.593 -18.320   0.190
  844    HG   LEU 112           HG       LEU 112  -6.476 -16.175  -0.049
  845   HD11  LEU 112          HD11      LEU 112  -6.450 -18.861   1.323
  846   HD12  LEU 112          HD12      LEU 112  -6.450 -17.284   2.116
  847   HD13  LEU 112          HD13      LEU 112  -5.066 -17.784   1.142
  848   HD21  LEU 112          HD21      LEU 112  -6.603 -18.950  -1.230
  849   HD22  LEU 112          HD22      LEU 112  -5.220 -17.863  -1.304
  850   HD23  LEU 112          HD23      LEU 112  -6.721 -17.435  -2.125
  851    H    SER 113           H        SER 113 -10.494 -18.373  -2.186
  852    HA   SER 113           HA       SER 113 -12.837 -17.907  -0.484
  853    HB2  SER 113           HB3      SER 113 -14.160 -18.312  -2.727
  854    HB3  SER 113           HB2      SER 113 -13.559 -16.700  -2.332
  855    HG   SER 113           HG       SER 113 -11.597 -17.480  -3.562
  856    H    ARG 114           H        ARG 114 -14.504 -19.755  -0.967
  857    HA   ARG 114           HA       ARG 114 -12.947 -22.162  -0.481
  858    HB2  ARG 114           HB3      ARG 114 -15.803 -21.399   0.027
  859    HB3  ARG 114           HB2      ARG 114 -15.291 -23.080   0.113
  860    HG2  ARG 114           HG3      ARG 114 -14.142 -20.818   1.739
  861    HG3  ARG 114           HG2      ARG 114 -15.300 -22.021   2.314
  862    HD2  ARG 114           HD3      ARG 114 -13.671 -23.796   1.826
  863    HD3  ARG 114           HD2      ARG 114 -12.513 -22.577   1.303
  864    HE   ARG 114           HE       ARG 114 -13.419 -22.075   3.950
  865   HH11  ARG 114          HH11      ARG 114 -11.271 -24.090   2.065
  866   HH12  ARG 114          HH12      ARG 114 -10.179 -24.379   3.380
  867   HH21  ARG 114          HH21      ARG 114 -11.983 -22.461   5.694
  868   HH22  ARG 114          HH22      ARG 114 -10.582 -23.454   5.443
  869    H    LYS 115           H        LYS 115 -13.784 -20.905  -3.227
  870    HA   LYS 115           HA       LYS 115 -14.111 -21.686  -5.337
  871    HB2  LYS 115           HB3      LYS 115 -13.888 -24.436  -4.067
  872    HB3  LYS 115           HB2      LYS 115 -13.883 -24.120  -5.794
  873    HG2  LYS 115           HG3      LYS 115 -11.802 -22.829  -5.521
  874    HG3  LYS 115           HG2      LYS 115 -11.816 -23.220  -3.798
  875    HD2  LYS 115           HD3      LYS 115 -10.326 -24.726  -4.949
  876    HD3  LYS 115           HD2      LYS 115 -11.733 -25.616  -4.374
  877    HE2  LYS 115           HE3      LYS 115 -12.705 -25.603  -6.567
  878    HE3  LYS 115           HE2      LYS 115 -11.416 -24.566  -7.177
  879    HZ1  LYS 115           HZ1      LYS 115 -11.068 -26.876  -7.788
  880    HZ2  LYS 115           HZ2      LYS 115 -11.068 -27.333  -6.162
  881    HZ3  LYS 115           HZ3      LYS 115  -9.836 -26.338  -6.761
  882    H    ALA 116           H        ALA 116 -16.209 -21.041  -3.588
  883    HA   ALA 116           HA       ALA 116 -18.493 -21.793  -4.993
  884    HB1  ALA 116           HB1      ALA 116 -18.181 -24.009  -3.995
  885    HB2  ALA 116           HB2      ALA 116 -19.635 -23.231  -3.371
  886    HB3  ALA 116           HB3      ALA 116 -18.173 -23.287  -2.387
  887    H    THR 117           H        THR 117 -17.460 -21.285  -1.641
  888    HA   THR 117           HA       THR 117 -19.162 -18.889  -1.540
  889    HB   THR 117           HB       THR 117 -18.991 -19.172   0.973
  890    HG1  THR 117           HG1      THR 117 -17.946 -20.847   1.759
  891   HG21  THR 117          HG21      THR 117 -20.707 -20.933   1.078
  892   HG22  THR 117          HG22      THR 117 -20.338 -21.383  -0.586
  893   HG23  THR 117          HG23      THR 117 -21.019 -19.795  -0.230
  894    H    ARG 118           H        ARG 118 -18.218 -17.292   0.193
  895    HA   ARG 118           HA       ARG 118 -15.307 -17.249   0.096
  896    HB2  ARG 118           HB3      ARG 118 -15.320 -14.812  -0.484
  897    HB3  ARG 118           HB2      ARG 118 -15.816 -15.863  -1.791
  898    HG2  ARG 118           HG3      ARG 118 -17.815 -14.480  -0.033
  899    HG3  ARG 118           HG2      ARG 118 -17.096 -13.687  -1.432
  900    HD2  ARG 118           HD3      ARG 118 -18.714 -16.239  -1.445
  901    HD3  ARG 118           HD2      ARG 118 -19.240 -14.662  -2.030
  902    HE   ARG 118           HE       ARG 118 -16.951 -15.258  -3.443
  903   HH11  ARG 118          HH11      ARG 118 -20.111 -16.695  -3.021
  904   HH12  ARG 118          HH12      ARG 118 -20.129 -17.425  -4.596
  905   HH21  ARG 118          HH21      ARG 118 -16.969 -16.224  -5.512
  906   HH22  ARG 118          HH22      ARG 118 -18.337 -17.169  -6.007
  907    H1   SER   1           H1       SER   1 -22.683   3.348  -2.498
  908    H2   SER   1           H2       SER   1 -24.170   3.056  -3.241
  909    H3   SER   1           H3       SER   1 -22.738   2.673  -4.047
  910    HA   SER   1           HA       SER   1 -22.221   0.999  -2.427
  911    HB2  SER   1           HB3      SER   1 -24.099   0.406  -0.800
  912    HB3  SER   1           HB2      SER   1 -23.191   1.875  -0.446
  913    HG   SER   1           HG       SER   1 -25.838   1.550  -1.092
  914    H    SER   2           H        SER   2 -22.277  -0.244  -4.235
  915    HA   SER   2           HA       SER   2 -24.747  -1.718  -4.700
  916    HB2  SER   2           HB3      SER   2 -23.235  -0.371  -6.958
  917    HB3  SER   2           HB2      SER   2 -24.613  -1.454  -7.142
  918    HG   SER   2           HG       SER   2 -25.679   0.191  -5.668
  919    H    THR   3           H        THR   3 -21.441  -1.258  -5.912
  920    HA   THR   3           HA       THR   3 -21.052  -4.110  -6.201
  921    HB   THR   3           HB       THR   3 -18.650  -3.277  -6.764
  922    HG1  THR   3           HG1      THR   3 -19.048  -0.982  -7.668
  923   HG21  THR   3          HG21      THR   3 -19.333  -2.745  -9.058
  924   HG22  THR   3          HG22      THR   3 -20.998  -2.536  -8.517
  925   HG23  THR   3          HG23      THR   3 -20.235  -4.124  -8.426
  926    H    HIS   4           H        HIS   4 -21.267  -4.794  -4.053
  927    HA   HIS   4           HA       HIS   4 -19.027  -4.053  -2.287
  928    HB2  HIS   4           HB3      HIS   4 -21.296  -2.980  -1.723
  929    HB3  HIS   4           HB2      HIS   4 -21.821  -4.598  -1.286
  930    HD1  HIS   4           HD1      HIS   4 -19.859  -1.715  -0.067
  931    HD2  HIS   4           HD2      HIS   4 -20.573  -5.651   1.047
  932    HE1  HIS   4           HE1      HIS   4 -19.132  -1.878   2.333
  933    HE2  HIS   4           HE2      HIS   4 -19.837  -4.184   3.046
  934    HA   PRO   5           HA       PRO   5 -19.482  -8.655  -2.653
  935    HB2  PRO   5           HB3      PRO   5 -17.153  -9.235  -3.845
  936    HB3  PRO   5           HB2      PRO   5 -18.542  -8.657  -4.770
  937    HG2  PRO   5           HG3      PRO   5 -16.079  -7.206  -3.947
  938    HG3  PRO   5           HG2      PRO   5 -17.056  -7.017  -5.410
  939    HD2  PRO   5           HD3      PRO   5 -17.148  -5.391  -3.114
  940    HD3  PRO   5           HD2      PRO   5 -18.325  -5.405  -4.441
  941    H    VAL   6           H        VAL   6 -19.267  -8.096  -0.296
  942    HA   VAL   6           HA       VAL   6 -18.348  -8.402   1.753
  943    HB   VAL   6           HB       VAL   6 -16.252 -10.073   0.364
  944   HG11  VAL   6          HG11      VAL   6 -17.249 -10.086   3.208
  945   HG12  VAL   6          HG12      VAL   6 -15.689  -9.477   2.661
  946   HG13  VAL   6          HG13      VAL   6 -16.060 -11.197   2.532
  947   HG21  VAL   6          HG21      VAL   6 -18.479 -10.859  -0.233
  948   HG22  VAL   6          HG22      VAL   6 -18.928 -10.913   1.471
  949   HG23  VAL   6          HG23      VAL   6 -17.683 -11.999   0.854
  950    H    PHE   7           H        PHE   7 -17.849  -6.105   1.572
  951    HA   PHE   7           HA       PHE   7 -14.971  -5.588   1.291
  952    HB2  PHE   7           HB3      PHE   7 -16.464  -4.286  -0.217
  953    HB3  PHE   7           HB2      PHE   7 -17.245  -3.591   1.195
  954    HD1  PHE   7           HD1      PHE   7 -13.829  -3.992  -0.259
  955    HD2  PHE   7           HD2      PHE   7 -16.533  -1.535   1.928
  956    HE1  PHE   7           HE1      PHE   7 -12.162  -2.191  -0.233
  957    HE2  PHE   7           HE2      PHE   7 -14.865   0.273   1.960
  958    HZ   PHE   7           HZ       PHE   7 -12.679  -0.050   0.880
  959    H    HIS   8           H        HIS   8 -17.507  -5.838   3.510
  960    HA   HIS   8           HA       HIS   8 -16.335  -4.120   5.520
  961    HB2  HIS   8           HB3      HIS   8 -18.842  -4.681   5.241
  962    HB3  HIS   8           HB2      HIS   8 -18.453  -6.208   6.016
  963    HD1  HIS   8           HD1      HIS   8 -19.037  -2.626   6.700
  964    HD2  HIS   8           HD2      HIS   8 -17.660  -5.971   8.757
  965    HE1  HIS   8           HE1      HIS   8 -19.112  -2.005   9.137
  966    HE2  HIS   8           HE2      HIS   8 -18.317  -4.056  10.365
  967    H    MET   9           H        MET   9 -14.307  -5.356   5.016
  968    HA   MET   9           HA       MET   9 -13.445  -7.012   7.071
  969    HB2  MET   9           HB3      MET   9 -14.940  -8.727   6.055
  970    HB3  MET   9           HB2      MET   9 -14.099  -8.538   4.523
  971    HG2  MET   9           HG3      MET   9 -11.991  -9.210   5.803
  972    HG3  MET   9           HG2      MET   9 -13.087  -9.737   7.077
  973    HE1  MET   9           HE1      MET   9 -15.235 -12.416   5.085
  974    HE2  MET   9           HE2      MET   9 -15.568 -10.688   5.207
  975    HE3  MET   9           HE3      MET   9 -15.040 -11.588   6.629
  976    H    GLY  10           H        GLY  10 -13.306  -5.999   3.764
  977    HA2  GLY  10           HA3      GLY  10 -11.247  -4.770   3.122
  978    HA3  GLY  10           HA2      GLY  10 -10.361  -6.127   3.809
  979    H    GLU  11           H        GLU  11  -9.672  -5.647   1.321
  980    HA   GLU  11           HA       GLU  11 -11.350  -7.150  -0.504
  981    HB2  GLU  11           HB3      GLU  11  -9.478  -6.694  -2.148
  982    HB3  GLU  11           HB2      GLU  11 -10.302  -5.278  -1.506
  983    HG2  GLU  11           HG3      GLU  11  -7.759  -6.246  -0.264
  984    HG3  GLU  11           HG2      GLU  11  -7.730  -5.260  -1.724
  985    H    PHE  12           H        PHE  12 -10.294  -8.501   1.792
  986    HA   PHE  12           HA       PHE  12  -9.530 -10.538   2.392
  987    HB2  PHE  12           HB3      PHE  12  -9.640 -10.970  -0.588
  988    HB3  PHE  12           HB2      PHE  12  -9.188 -12.244   0.537
  989    HD1  PHE  12           HD1      PHE  12 -11.906 -10.239  -0.805
  990    HD2  PHE  12           HD2      PHE  12 -10.830 -13.166   2.089
  991    HE1  PHE  12           HE1      PHE  12 -14.279 -10.795  -0.486
  992    HE2  PHE  12           HE2      PHE  12 -13.202 -13.724   2.414
  993    HZ   PHE  12           HZ       PHE  12 -14.930 -12.540   1.124
  994    H    SER  13           H        SER  13  -7.666 -12.081   2.215
  995    HA   SER  13           HA       SER  13  -5.331 -11.428   0.778
  996    HB2  SER  13           HB3      SER  13  -5.235  -9.561   2.421
  997    HB3  SER  13           HB2      SER  13  -5.262 -10.733   3.733
  998    HG   SER  13           HG       SER  13  -3.134  -9.867   2.914
  999    H    VAL  14           H        VAL  14  -3.691 -12.989   1.111
 1000    HA   VAL  14           HA       VAL  14  -4.645 -15.504   2.140
 1001    HB   VAL  14           HB       VAL  14  -2.472 -16.404   1.374
 1002   HG11  VAL  14          HG11      VAL  14  -3.890 -14.640  -0.616
 1003   HG12  VAL  14          HG12      VAL  14  -4.297 -16.305  -0.206
 1004   HG13  VAL  14          HG13      VAL  14  -2.781 -15.945  -1.031
 1005   HG21  VAL  14          HG21      VAL  14  -0.877 -14.996   0.211
 1006   HG22  VAL  14          HG22      VAL  14  -1.109 -14.413   1.860
 1007   HG23  VAL  14          HG23      VAL  14  -1.877 -13.576   0.512
 1008    H    CYS  15           H        CYS  15  -3.211 -12.872   3.502
 1009    HA   CYS  15           HA       CYS  15  -2.233 -14.445   5.786
 1010    HB2  CYS  15           HB3      CYS  15  -0.343 -13.461   4.471
 1011    HB3  CYS  15           HB2      CYS  15  -1.025 -11.858   4.759
 1012    H    ASP  16           H        ASP  16  -2.519 -13.354   7.858
 1013    HA   ASP  16           HA       ASP  16  -5.035 -11.973   7.913
 1014    HB2  ASP  16           HB3      ASP  16  -4.074 -13.643   9.672
 1015    HB3  ASP  16           HB2      ASP  16  -3.226 -12.236  10.307
 1016    H    SER  17           H        SER  17  -5.267  -9.897   7.597
 1017    HA   SER  17           HA       SER  17  -2.984  -8.118   8.108
 1018    HB2  SER  17           HB3      SER  17  -5.248  -7.753   6.126
 1019    HB3  SER  17           HB2      SER  17  -3.818  -6.729   6.289
 1020    HG   SER  17           HG       SER  17  -3.521  -9.488   5.809
 1021    H    VAL  18           H        VAL  18  -3.256  -6.398   9.422
 1022    HA   VAL  18           HA       VAL  18  -5.976  -5.934  10.444
 1023    HB   VAL  18           HB       VAL  18  -4.527  -6.651  12.212
 1024   HG11  VAL  18          HG11      VAL  18  -2.371  -6.144  11.250
 1025   HG12  VAL  18          HG12      VAL  18  -2.502  -5.425  12.855
 1026   HG13  VAL  18          HG13      VAL  18  -2.673  -4.415  11.419
 1027   HG21  VAL  18          HG21      VAL  18  -6.135  -4.948  12.810
 1028   HG22  VAL  18          HG22      VAL  18  -4.995  -3.681  12.364
 1029   HG23  VAL  18          HG23      VAL  18  -4.653  -4.729  13.740
 1030    H    SER  19           H        SER  19  -6.917  -4.205   9.640
 1031    HA   SER  19           HA       SER  19  -5.297  -1.984   8.649
 1032    HB2  SER  19           HB3      SER  19  -8.260  -2.537   8.331
 1033    HB3  SER  19           HB2      SER  19  -7.364  -1.234   7.546
 1034    HG   SER  19           HG       SER  19  -6.179  -2.762   6.408
 1035    H    VAL  20           H        VAL  20  -4.960  -0.296   9.912
 1036    HA   VAL  20           HA       VAL  20  -6.986   0.374  11.948
 1037    HB   VAL  20           HB       VAL  20  -4.012   0.888  12.096
 1038   HG11  VAL  20          HG11      VAL  20  -5.290   2.544  13.305
 1039   HG12  VAL  20          HG12      VAL  20  -4.458   1.475  14.434
 1040   HG13  VAL  20          HG13      VAL  20  -6.184   1.275  14.142
 1041   HG21  VAL  20          HG21      VAL  20  -5.662  -1.180  13.533
 1042   HG22  VAL  20          HG22      VAL  20  -3.952  -0.845  13.812
 1043   HG23  VAL  20          HG23      VAL  20  -4.483  -1.492  12.259
 1044    H    TRP  21           H        TRP  21  -7.712   2.441  11.990
 1045    HA   TRP  21           HA       TRP  21  -6.577   4.323  10.054
 1046    HB2  TRP  21           HB3      TRP  21  -9.151   4.422  11.658
 1047    HB3  TRP  21           HB2      TRP  21  -8.604   5.705  10.584
 1048    HD1  TRP  21           HD1      TRP  21 -10.234   2.272  10.564
 1049    HE1  TRP  21           HE1      TRP  21 -11.040   1.733   8.181
 1050    HE3  TRP  21           HE3      TRP  21  -8.033   6.160   8.055
 1051    HZ2  TRP  21           HZ2      TRP  21 -10.776   2.807   5.583
 1052    HZ3  TRP  21           HZ3      TRP  21  -8.363   6.327   5.621
 1053    HH2  TRP  21           HH2      TRP  21  -9.705   4.685   4.415
 1054    H    VAL  22           H        VAL  22  -4.782   5.110  11.003
 1055    HA   VAL  22           HA       VAL  22  -4.793   5.783  13.830
 1056    HB   VAL  22           HB       VAL  22  -2.567   6.050  11.802
 1057   HG11  VAL  22          HG11      VAL  22  -2.258   7.487  13.744
 1058   HG12  VAL  22          HG12      VAL  22  -1.095   6.163  13.748
 1059   HG13  VAL  22          HG13      VAL  22  -2.498   6.105  14.815
 1060   HG21  VAL  22          HG21      VAL  22  -1.692   3.977  12.748
 1061   HG22  VAL  22          HG22      VAL  22  -3.288   3.733  12.039
 1062   HG23  VAL  22          HG23      VAL  22  -3.110   3.849  13.788
 1063    H    GLY  23           H        GLY  23  -5.545   7.706  14.436
 1064    HA2  GLY  23           HA3      GLY  23  -5.610   9.886  12.511
 1065    HA3  GLY  23           HA2      GLY  23  -6.396   9.862  14.087
 1066    H    ASP  24           H        ASP  24  -3.531   8.822  14.950
 1067    HA   ASP  24           HA       ASP  24  -2.164  11.402  14.922
 1068    HB2  ASP  24           HB3      ASP  24  -3.125   9.982  17.392
 1069    HB3  ASP  24           HB2      ASP  24  -1.690  11.004  17.447
 1070    H    LYS  25           H        LYS  25  -0.943   9.935  13.416
 1071    HA   LYS  25           HA       LYS  25   0.789   7.972  14.582
 1072    HB2  LYS  25           HB3      LYS  25   0.142   8.066  12.149
 1073    HB3  LYS  25           HB2      LYS  25   1.143   9.502  11.993
 1074    HG2  LYS  25           HG3      LYS  25   3.116   8.229  12.581
 1075    HG3  LYS  25           HG2      LYS  25   2.134   6.782  12.819
 1076    HD2  LYS  25           HD3      LYS  25   1.442   6.934  10.439
 1077    HD3  LYS  25           HD2      LYS  25   2.555   8.287  10.242
 1078    HE2  LYS  25           HE3      LYS  25   3.611   6.246   9.465
 1079    HE3  LYS  25           HE2      LYS  25   4.417   6.820  10.927
 1080    HZ1  LYS  25           HZ1      LYS  25   3.130   5.203  12.201
 1081    HZ2  LYS  25           HZ2      LYS  25   4.069   4.448  11.021
 1082    HZ3  LYS  25           HZ3      LYS  25   2.401   4.636  10.779
 1083    H    THR  26           H        THR  26   2.727   8.305  15.576
 1084    HA   THR  26           HA       THR  26   3.267  11.049  16.287
 1085    HB   THR  26           HB       THR  26   3.206   9.438  18.089
 1086    HG1  THR  26           HG1      THR  26   4.776  11.231  18.115
 1087   HG21  THR  26          HG21      THR  26   3.919   7.434  16.896
 1088   HG22  THR  26          HG22      THR  26   4.912   7.692  18.328
 1089   HG23  THR  26          HG23      THR  26   5.547   8.094  16.736
 1090    H    THR  27           H        THR  27   5.009   8.437  14.643
 1091    HA   THR  27           HA       THR  27   6.861  10.440  13.603
 1092    HB   THR  27           HB       THR  27   8.692   8.610  13.931
 1093    HG1  THR  27           HG1      THR  27   7.728   7.932  16.346
 1094   HG21  THR  27          HG21      THR  27   7.709  10.303  16.228
 1095   HG22  THR  27          HG22      THR  27   8.792  10.825  14.936
 1096   HG23  THR  27          HG23      THR  27   9.321   9.600  16.089
 1097    H    ALA  28           H        ALA  28   7.734   9.975  11.611
 1098    HA   ALA  28           HA       ALA  28   7.312   7.355  10.443
 1099    HB1  ALA  28           HB1      ALA  28   5.193   8.555   9.993
 1100    HB2  ALA  28           HB2      ALA  28   6.072   8.116   8.530
 1101    HB3  ALA  28           HB3      ALA  28   6.111   9.780   9.118
 1102    H    THR  29           H        THR  29   8.338   7.185   8.312
 1103    HA   THR  29           HA       THR  29  10.733   8.866   8.222
 1104    HB   THR  29           HB       THR  29  10.256   6.327   6.674
 1105    HG1  THR  29           HG1      THR  29  10.387   6.534   9.302
 1106   HG21  THR  29          HG21      THR  29  12.697   6.218   6.638
 1107   HG22  THR  29          HG22      THR  29  12.784   7.709   7.577
 1108   HG23  THR  29          HG23      THR  29  12.126   7.735   5.941
 1109    H    ASP  30           H        ASP  30  10.754  10.467   6.822
 1110    HA   ASP  30           HA       ASP  30   8.983  10.700   4.598
 1111    HB2  ASP  30           HB3      ASP  30   9.907  12.700   5.669
 1112    HB3  ASP  30           HB2      ASP  30  11.548  12.179   5.290
 1113    H    ILE  31           H        ILE  31   9.677  10.790   2.359
 1114    HA   ILE  31           HA       ILE  31  10.868   8.411   1.521
 1115    HB   ILE  31           HB       ILE  31   9.228   9.673   0.199
 1116   HG12  ILE  31          HG13      ILE  31  11.844   9.357  -1.294
 1117   HG13  ILE  31          HG12      ILE  31  10.722   8.046  -0.936
 1118   HG21  ILE  31          HG21      ILE  31  11.465  11.642  -0.255
 1119   HG22  ILE  31          HG22      ILE  31   9.993  11.924   0.674
 1120   HG23  ILE  31          HG23      ILE  31   9.900  11.660  -1.066
 1121   HD11  ILE  31          HD11      ILE  31   9.012   9.159  -2.288
 1122   HD12  ILE  31          HD12      ILE  31  10.467   8.803  -3.219
 1123   HD13  ILE  31          HD13      ILE  31  10.157  10.447  -2.661
 1124    H    LYS  32           H        LYS  32  12.343  11.360   2.449
 1125    HA   LYS  32           HA       LYS  32  14.812  10.927   1.002
 1126    HB2  LYS  32           HB3      LYS  32  14.164  12.838   3.245
 1127    HB3  LYS  32           HB2      LYS  32  15.600  12.889   2.228
 1128    HG2  LYS  32           HG3      LYS  32  14.391  13.588   0.360
 1129    HG3  LYS  32           HG2      LYS  32  12.852  13.077   1.053
 1130    HD2  LYS  32           HD3      LYS  32  13.319  14.827   2.864
 1131    HD3  LYS  32           HD2      LYS  32  14.531  15.464   1.749
 1132    HE2  LYS  32           HE3      LYS  32  12.362  16.614   1.538
 1133    HE3  LYS  32           HE2      LYS  32  12.842  15.791   0.054
 1134    HZ1  LYS  32           HZ1      LYS  32  11.113  14.382   1.974
 1135    HZ2  LYS  32           HZ2      LYS  32  11.215  14.215   0.291
 1136    HZ3  LYS  32           HZ3      LYS  32  10.432  15.554   0.960
 1137    H    GLY  33           H        GLY  33  13.454   9.384   3.527
 1138    HA2  GLY  33           HA3      GLY  33  14.426   7.690   4.796
 1139    HA3  GLY  33           HA2      GLY  33  16.015   8.296   4.342
 1140    H    LYS  34           H        LYS  34  13.645  10.474   5.612
 1141    HA   LYS  34           HA       LYS  34  15.284  10.733   8.035
 1142    HB2  LYS  34           HB3      LYS  34  13.442  12.743   6.738
 1143    HB3  LYS  34           HB2      LYS  34  14.424  13.030   8.166
 1144    HG2  LYS  34           HG3      LYS  34  15.457  12.424   5.407
 1145    HG3  LYS  34           HG2      LYS  34  15.427  14.002   6.180
 1146    HD2  LYS  34           HD3      LYS  34  16.908  13.148   7.945
 1147    HD3  LYS  34           HD2      LYS  34  16.971  11.591   7.115
 1148    HE2  LYS  34           HE3      LYS  34  17.869  14.222   5.959
 1149    HE3  LYS  34           HE2      LYS  34  18.938  13.001   6.638
 1150    HZ1  LYS  34           HZ1      LYS  34  18.856  12.842   4.241
 1151    HZ2  LYS  34           HZ2      LYS  34  17.181  12.654   4.271
 1152    HZ3  LYS  34           HZ3      LYS  34  18.176  11.457   4.928
 1153    H    GLU  35           H        GLU  35  14.427  10.262   9.946
 1154    HA   GLU  35           HA       GLU  35  11.603   9.582  10.117
 1155    HB2  GLU  35           HB3      GLU  35  13.227   8.058  11.131
 1156    HB3  GLU  35           HB2      GLU  35  13.837   9.357  12.144
 1157    HG2  GLU  35           HG3      GLU  35  11.683   9.494  13.278
 1158    HG3  GLU  35           HG2      GLU  35  11.057   8.205  12.254
 1159    H    VAL  36           H        VAL  36  10.168  11.071  10.640
 1160    HA   VAL  36           HA       VAL  36  11.008  13.284  12.379
 1161    HB   VAL  36           HB       VAL  36   9.512  14.773  10.964
 1162   HG11  VAL  36          HG11      VAL  36  11.935  14.955  10.902
 1163   HG12  VAL  36          HG12      VAL  36  11.261  15.179   9.287
 1164   HG13  VAL  36          HG13      VAL  36  12.019  13.647   9.721
 1165   HG21  VAL  36          HG21      VAL  36   8.343  13.003   9.753
 1166   HG22  VAL  36          HG22      VAL  36   9.860  12.514   8.996
 1167   HG23  VAL  36          HG23      VAL  36   9.168  14.097   8.642
 1168    H    THR  37           H        THR  37   9.215  14.473  13.338
 1169    HA   THR  37           HA       THR  37   7.252  12.643  14.397
 1170    HB   THR  37           HB       THR  37   7.652  15.575  15.008
 1171    HG1  THR  37           HG1      THR  37   9.472  13.970  15.379
 1172   HG21  THR  37          HG21      THR  37   5.488  14.701  15.742
 1173   HG22  THR  37          HG22      THR  37   6.530  15.035  17.123
 1174   HG23  THR  37          HG23      THR  37   6.298  13.375  16.578
 1175    H    VAL  38           H        VAL  38   5.248  12.444  13.659
 1176    HA   VAL  38           HA       VAL  38   4.410  14.146  11.461
 1177    HB   VAL  38           HB       VAL  38   3.125  11.650  12.584
 1178   HG11  VAL  38          HG11      VAL  38   2.610  13.119  10.001
 1179   HG12  VAL  38          HG12      VAL  38   1.524  13.042  11.388
 1180   HG13  VAL  38          HG13      VAL  38   1.891  11.579  10.473
 1181   HG21  VAL  38          HG21      VAL  38   4.091  10.531  10.627
 1182   HG22  VAL  38          HG22      VAL  38   5.333  11.190  11.694
 1183   HG23  VAL  38          HG23      VAL  38   4.922  12.025  10.196
 1184    H    LEU  39           H        LEU  39   2.796  15.587  11.524
 1185    HA   LEU  39           HA       LEU  39   1.276  15.863  14.022
 1186    HB2  LEU  39           HB3      LEU  39   1.601  17.827  11.744
 1187    HB3  LEU  39           HB2      LEU  39   0.788  18.137  13.266
 1188    HG   LEU  39           HG       LEU  39   3.737  17.583  12.954
 1189   HD11  LEU  39          HD11      LEU  39   2.239  20.147  13.454
 1190   HD12  LEU  39          HD12      LEU  39   3.160  19.727  12.009
 1191   HD13  LEU  39          HD13      LEU  39   3.989  19.958  13.548
 1192   HD21  LEU  39          HD21      LEU  39   2.104  18.385  15.356
 1193   HD22  LEU  39          HD22      LEU  39   3.864  18.305  15.298
 1194   HD23  LEU  39          HD23      LEU  39   2.911  16.836  15.103
 1195    H    ALA  40           H        ALA  40  -0.808  15.322  14.021
 1196    HA   ALA  40           HA       ALA  40  -2.078  14.226  11.732
 1197    HB1  ALA  40           HB1      ALA  40  -2.577  13.502  14.020
 1198    HB2  ALA  40           HB2      ALA  40  -4.031  14.018  13.163
 1199    HB3  ALA  40           HB3      ALA  40  -3.287  15.084  14.357
 1200    H    GLU  41           H        GLU  41  -1.817  17.349  13.051
 1201    HA   GLU  41           HA       GLU  41  -4.069  18.377  11.480
 1202    HB2  GLU  41           HB3      GLU  41  -2.490  19.609  13.749
 1203    HB3  GLU  41           HB2      GLU  41  -3.832  20.380  12.919
 1204    HG2  GLU  41           HG3      GLU  41  -4.233  17.722  14.200
 1205    HG3  GLU  41           HG2      GLU  41  -4.195  19.174  15.197
 1206    H    VAL  42           H        VAL  42  -3.506  19.199   9.564
 1207    HA   VAL  42           HA       VAL  42  -0.758  20.088   9.185
 1208    HB   VAL  42           HB       VAL  42  -1.284  20.183   6.766
 1209   HG11  VAL  42          HG11      VAL  42  -1.407  17.770   6.437
 1210   HG12  VAL  42          HG12      VAL  42  -1.949  17.564   8.102
 1211   HG13  VAL  42          HG13      VAL  42  -0.328  18.176   7.769
 1212   HG21  VAL  42          HG21      VAL  42  -3.942  18.992   7.550
 1213   HG22  VAL  42          HG22      VAL  42  -3.340  19.218   5.909
 1214   HG23  VAL  42          HG23      VAL  42  -3.694  20.620   6.918
 1215    H    ASN  43           H        ASN  43  -0.516  22.019   9.996
 1216    HA   ASN  43           HA       ASN  43  -2.445  24.127   9.700
 1217    HB2  ASN  43           HB3      ASN  43   0.443  24.304  10.621
 1218    HB3  ASN  43           HB2      ASN  43  -0.804  25.525  10.853
 1219   HD21  ASN  43          HD21      ASN  43   0.514  22.529  11.961
 1220   HD22  ASN  43          HD22      ASN  43  -0.469  22.375  13.372
 1221    H    ILE  44           H        ILE  44  -2.748  24.662   7.593
 1222    HA   ILE  44           HA       ILE  44  -0.543  24.996   5.780
 1223    HB   ILE  44           HB       ILE  44  -3.432  25.850   5.452
 1224   HG12  ILE  44          HG13      ILE  44  -2.016  23.354   4.479
 1225   HG13  ILE  44          HG12      ILE  44  -3.162  23.412   5.817
 1226   HG21  ILE  44          HG21      ILE  44  -1.234  25.496   3.419
 1227   HG22  ILE  44          HG22      ILE  44  -1.927  27.029   3.943
 1228   HG23  ILE  44          HG23      ILE  44  -2.916  25.872   3.055
 1229   HD11  ILE  44          HD11      ILE  44  -4.921  24.114   4.269
 1230   HD12  ILE  44          HD12      ILE  44  -4.210  22.567   3.801
 1231   HD13  ILE  44          HD13      ILE  44  -3.769  24.039   2.934
 1232    H    ASN  45           H        ASN  45  -3.060  27.398   6.554
 1233    HA   ASN  45           HA       ASN  45  -0.946  29.273   7.368
 1234    HB2  ASN  45           HB3      ASN  45  -3.343  30.113   5.714
 1235    HB3  ASN  45           HB2      ASN  45  -1.992  31.120   6.213
 1236   HD21  ASN  45          HD21      ASN  45   0.042  30.821   5.184
 1237   HD22  ASN  45          HD22      ASN  45   0.138  30.070   3.626
 1238    H    ASN  46           H        ASN  46  -4.468  29.202   7.017
 1239    HA   ASN  46           HA       ASN  46  -4.704  29.693   9.913
 1240    HB2  ASN  46           HB3      ASN  46  -6.724  31.028   9.458
 1241    HB3  ASN  46           HB2      ASN  46  -5.314  31.724   8.667
 1242   HD21  ASN  46          HD21      ASN  46  -8.386  30.205   8.239
 1243   HD22  ASN  46          HD22      ASN  46  -8.479  30.405   6.522
 1244    H    SER  47           H        SER  47  -5.524  27.806   7.215
 1245    HA   SER  47           HA       SER  47  -7.787  26.542   8.548
 1246    HB2  SER  47           HB3      SER  47  -6.641  26.027   5.789
 1247    HB3  SER  47           HB2      SER  47  -8.190  25.453   6.409
 1248    HG   SER  47           HG       SER  47  -8.717  27.748   6.676
 1249    H    VAL  48           H        VAL  48  -7.582  24.682   9.607
 1250    HA   VAL  48           HA       VAL  48  -5.096  23.136   9.261
 1251    HB   VAL  48           HB       VAL  48  -6.817  23.311  11.742
 1252   HG11  VAL  48          HG11      VAL  48  -4.954  22.176  12.840
 1253   HG12  VAL  48          HG12      VAL  48  -4.115  22.058  11.293
 1254   HG13  VAL  48          HG13      VAL  48  -5.636  21.199  11.539
 1255   HG21  VAL  48          HG21      VAL  48  -5.031  24.646  12.716
 1256   HG22  VAL  48          HG22      VAL  48  -5.694  25.437  11.287
 1257   HG23  VAL  48          HG23      VAL  48  -4.146  24.599  11.192
 1258    H    PHE  49           H        PHE  49  -5.363  21.149   8.463
 1259    HA   PHE  49           HA       PHE  49  -8.018  19.893   8.715
 1260    HB2  PHE  49           HB3      PHE  49  -6.098  19.763   6.374
 1261    HB3  PHE  49           HB2      PHE  49  -7.556  18.786   6.518
 1262    HD1  PHE  49           HD1      PHE  49  -6.186  21.977   5.577
 1263    HD2  PHE  49           HD2      PHE  49  -9.780  19.924   6.560
 1264    HE1  PHE  49           HE1      PHE  49  -7.501  23.775   4.520
 1265    HE2  PHE  49           HE2      PHE  49 -11.097  21.714   5.512
 1266    HZ   PHE  49           HZ       PHE  49  -9.960  23.641   4.491
 1267    H    ARG  50           H        ARG  50  -7.994  17.519   8.619
 1268    HA   ARG  50           HA       ARG  50  -5.449  16.286   9.372
 1269    HB2  ARG  50           HB3      ARG  50  -6.407  15.185  11.306
 1270    HB3  ARG  50           HB2      ARG  50  -6.621  16.922  11.476
 1271    HG2  ARG  50           HG3      ARG  50  -8.948  16.679  10.717
 1272    HG3  ARG  50           HG2      ARG  50  -8.714  14.932  10.621
 1273    HD2  ARG  50           HD3      ARG  50  -9.809  15.501  12.698
 1274    HD3  ARG  50           HD2      ARG  50  -8.185  14.897  13.023
 1275    HE   ARG  50           HE       ARG  50  -7.635  17.437  13.077
 1276   HH11  ARG  50          HH11      ARG  50 -10.568  15.926  14.265
 1277   HH12  ARG  50          HH12      ARG  50 -10.851  17.129  15.479
 1278   HH21  ARG  50          HH21      ARG  50  -7.998  19.024  14.668
 1279   HH22  ARG  50          HH22      ARG  50  -9.388  18.897  15.708
 1280    H    GLN  51           H        GLN  51  -5.614  13.882   9.376
 1281    HA   GLN  51           HA       GLN  51  -7.922  12.740   8.041
 1282    HB2  GLN  51           HB3      GLN  51  -6.838  11.871   6.158
 1283    HB3  GLN  51           HB2      GLN  51  -6.151  13.486   6.271
 1284    HG2  GLN  51           HG3      GLN  51  -4.123  12.653   7.178
 1285    HG3  GLN  51           HG2      GLN  51  -4.814  11.050   7.424
 1286   HE21  GLN  51          HE21      GLN  51  -5.152   9.708   5.625
 1287   HE22  GLN  51          HE22      GLN  51  -4.326   9.979   4.122
 1288    H    TYR  52           H        TYR  52  -7.795  10.340   8.075
 1289    HA   TYR  52           HA       TYR  52  -6.140   9.429  10.327
 1290    HB2  TYR  52           HB3      TYR  52  -8.535   8.009   9.129
 1291    HB3  TYR  52           HB2      TYR  52  -7.736   7.655  10.660
 1292    HD1  TYR  52           HD1      TYR  52  -7.634   9.847  12.271
 1293    HD2  TYR  52           HD2      TYR  52 -10.550   9.096   9.272
 1294    HE1  TYR  52           HE1      TYR  52  -9.192  11.357  13.416
 1295    HE2  TYR  52           HE2      TYR  52 -12.119  10.606  10.409
 1296    HH   TYR  52           HH       TYR  52 -12.500  11.504  12.669
 1297    H    PHE  53           H        PHE  53  -4.502   8.090   9.937
 1298    HA   PHE  53           HA       PHE  53  -3.899   7.433   7.202
 1299    HB2  PHE  53           HB3      PHE  53  -2.388   6.744   9.737
 1300    HB3  PHE  53           HB2      PHE  53  -1.770   6.587   8.094
 1301    HD1  PHE  53           HD1      PHE  53  -1.758   8.776   6.684
 1302    HD2  PHE  53           HD2      PHE  53  -1.964   8.668  10.930
 1303    HE1  PHE  53           HE1      PHE  53  -0.916  11.086   6.776
 1304    HE2  PHE  53           HE2      PHE  53  -1.126  10.978  11.034
 1305    HZ   PHE  53           HZ       PHE  53  -0.602  12.191   8.957
 1306    H    PHE  54           H        PHE  54  -4.337   5.611   6.204
 1307    HA   PHE  54           HA       PHE  54  -5.604   3.438   7.636
 1308    HB2  PHE  54           HB3      PHE  54  -6.520   4.245   5.486
 1309    HB3  PHE  54           HB2      PHE  54  -5.014   3.827   4.683
 1310    HD1  PHE  54           HD1      PHE  54  -4.874   1.810   3.587
 1311    HD2  PHE  54           HD2      PHE  54  -7.701   2.260   6.735
 1312    HE1  PHE  54           HE1      PHE  54  -5.779  -0.419   3.085
 1313    HE2  PHE  54           HE2      PHE  54  -8.611   0.029   6.241
 1314    HZ   PHE  54           HZ       PHE  54  -7.650  -1.314   4.412
 1315    H    GLU  55           H        GLU  55  -4.024   2.409   8.811
 1316    HA   GLU  55           HA       GLU  55  -1.668   1.444   7.339
 1317    HB2  GLU  55           HB3      GLU  55  -2.089   1.518  10.337
 1318    HB3  GLU  55           HB2      GLU  55  -0.611   1.065   9.502
 1319    HG2  GLU  55           HG3      GLU  55  -0.695   3.459   8.527
 1320    HG3  GLU  55           HG2      GLU  55  -1.829   3.779   9.843
 1321    H    THR  56           H        THR  56  -2.188  -0.447   6.430
 1322    HA   THR  56           HA       THR  56  -3.454  -2.494   8.103
 1323    HB   THR  56           HB       THR  56  -2.841  -2.591   5.143
 1324    HG1  THR  56           HG1      THR  56  -4.535  -1.324   5.077
 1325   HG21  THR  56          HG21      THR  56  -2.967  -4.809   6.172
 1326   HG22  THR  56          HG22      THR  56  -4.359  -4.521   5.128
 1327   HG23  THR  56          HG23      THR  56  -4.530  -4.400   6.880
 1328    H    LYS  57           H        LYS  57  -2.162  -3.802   9.175
 1329    HA   LYS  57           HA       LYS  57   0.592  -4.166   8.189
 1330    HB2  LYS  57           HB3      LYS  57  -0.400  -4.007  11.045
 1331    HB3  LYS  57           HB2      LYS  57   1.272  -4.274  10.562
 1332    HG2  LYS  57           HG3      LYS  57   1.374  -2.094   9.544
 1333    HG3  LYS  57           HG2      LYS  57  -0.337  -1.827   9.865
 1334    HD2  LYS  57           HD3      LYS  57   0.159  -2.000  12.295
 1335    HD3  LYS  57           HD2      LYS  57   1.876  -2.092  11.893
 1336    HE2  LYS  57           HE3      LYS  57   1.734   0.080  10.792
 1337    HE3  LYS  57           HE2      LYS  57   0.022   0.168  11.183
 1338    HZ1  LYS  57           HZ1      LYS  57   2.267   0.149  13.119
 1339    HZ2  LYS  57           HZ2      LYS  57   0.633   0.118  13.545
 1340    HZ3  LYS  57           HZ3      LYS  57   1.268   1.461  12.740
 1341    H    CYS  58           H        CYS  58   1.663  -6.131   9.002
 1342    HA   CYS  58           HA       CYS  58  -0.082  -8.411   8.627
 1343    HB2  CYS  58           HB3      CYS  58   2.918  -8.275   9.021
 1344    HB3  CYS  58           HB2      CYS  58   2.018  -9.722   8.596
 1345    H    ARG  59           H        ARG  59  -1.150  -9.175  10.334
 1346    HA   ARG  59           HA       ARG  59   0.372  -9.525  12.828
 1347    HB2  ARG  59           HB3      ARG  59  -1.781  -9.628  14.013
 1348    HB3  ARG  59           HB2      ARG  59  -1.578  -8.096  13.180
 1349    HG2  ARG  59           HG3      ARG  59  -3.103  -8.717  11.480
 1350    HG3  ARG  59           HG2      ARG  59  -3.154 -10.386  12.046
 1351    HD2  ARG  59           HD3      ARG  59  -4.241  -9.699  14.087
 1352    HD3  ARG  59           HD2      ARG  59  -4.084  -8.002  13.638
 1353    HE   ARG  59           HE       ARG  59  -5.548  -9.661  11.762
 1354   HH11  ARG  59          HH11      ARG  59  -5.740  -7.568  14.571
 1355   HH12  ARG  59          HH12      ARG  59  -7.395  -7.131  14.291
 1356   HH21  ARG  59          HH21      ARG  59  -7.726  -9.094  11.404
 1357   HH22  ARG  59          HH22      ARG  59  -8.533  -8.014  12.497
 1358    H    ALA  60           H        ALA  60   0.701 -11.559  13.518
 1359    HA   ALA  60           HA       ALA  60   0.931 -13.819  13.384
 1360    HB1  ALA  60           HB1      ALA  60  -1.901 -13.751  12.329
 1361    HB2  ALA  60           HB2      ALA  60  -1.444 -13.810  14.030
 1362    HB3  ALA  60           HB3      ALA  60  -1.058 -15.164  12.969
 1363    H    SER  61           H        SER  61   2.523 -13.443  11.756
 1364    HA   SER  61           HA       SER  61   1.934 -13.287   9.001
 1365    HB2  SER  61           HB3      SER  61   4.045 -12.469   9.930
 1366    HB3  SER  61           HB2      SER  61   4.498 -14.109  10.387
 1367    HG   SER  61           HG       SER  61   3.963 -14.336   7.894
 1368    H    ASN  62           H        ASN  62   1.819 -15.909  11.117
 1369    HA   ASN  62           HA       ASN  62   1.736 -17.734   8.814
 1370    HB2  ASN  62           HB3      ASN  62   2.844 -18.346  11.566
 1371    HB3  ASN  62           HB2      ASN  62   2.536 -19.558  10.331
 1372   HD21  ASN  62          HD21      ASN  62   3.433 -17.790   8.159
 1373   HD22  ASN  62          HD22      ASN  62   5.156 -17.763   8.272
 1374    HA   PRO  63           HA       PRO  63  -2.402 -17.695  11.022
 1375    HB2  PRO  63           HB3      PRO  63  -3.696 -18.240   8.610
 1376    HB3  PRO  63           HB2      PRO  63  -3.538 -16.638   9.346
 1377    HG2  PRO  63           HG3      PRO  63  -1.942 -17.896   7.160
 1378    HG3  PRO  63           HG2      PRO  63  -2.446 -16.209   7.356
 1379    HD2  PRO  63           HD3      PRO  63   0.082 -16.993   7.864
 1380    HD3  PRO  63           HD2      PRO  63  -0.713 -15.727   8.835
 1381    H    VAL  64           H        VAL  64  -0.934 -19.711   8.553
 1382    HA   VAL  64           HA       VAL  64  -1.956 -22.090   9.952
 1383    HB   VAL  64           HB       VAL  64  -1.457 -23.337   7.831
 1384   HG11  VAL  64          HG11      VAL  64  -3.429 -22.486   6.584
 1385   HG12  VAL  64          HG12      VAL  64  -3.475 -21.107   7.684
 1386   HG13  VAL  64          HG13      VAL  64  -3.732 -22.739   8.303
 1387   HG21  VAL  64          HG21      VAL  64  -1.178 -22.099   5.760
 1388   HG22  VAL  64          HG22      VAL  64   0.137 -21.740   6.878
 1389   HG23  VAL  64          HG23      VAL  64  -1.171 -20.580   6.652
 1390    H    GLU  65           H        GLU  65  -0.357 -23.918   9.997
 1391    HA   GLU  65           HA       GLU  65   2.150 -22.830  10.928
 1392    HB2  GLU  65           HB3      GLU  65   0.856 -24.645  12.108
 1393    HB3  GLU  65           HB2      GLU  65   1.333 -25.734  10.813
 1394    HG2  GLU  65           HG3      GLU  65   3.685 -25.343  11.362
 1395    HG3  GLU  65           HG2      GLU  65   3.192 -24.278  12.676
 1396    H    SER  66           H        SER  66   2.362 -22.161   8.530
 1397    HA   SER  66           HA       SER  66   4.503 -23.685   7.399
 1398    HB2  SER  66           HB3      SER  66   1.984 -23.403   5.722
 1399    HB3  SER  66           HB2      SER  66   3.501 -24.146   5.220
 1400    HG   SER  66           HG       SER  66   2.771 -25.378   7.427
 1401    H    GLY  67           H        GLY  67   2.044 -21.210   6.861
 1402    HA2  GLY  67           HA3      GLY  67   3.645 -18.992   6.770
 1403    HA3  GLY  67           HA2      GLY  67   3.634 -19.611   5.117
 1404    H    CYS  68           H        CYS  68   2.231 -18.484   3.924
 1405    HA   CYS  68           HA       CYS  68  -0.185 -17.385   5.056
 1406    HB2  CYS  68           HB3      CYS  68   0.731 -17.580   2.171
 1407    HB3  CYS  68           HB2      CYS  68  -0.638 -16.626   2.750
 1408    H    ARG  69           H        ARG  69  -2.329 -17.868   4.036
 1409    HA   ARG  69           HA       ARG  69  -2.729 -20.724   4.137
 1410    HB2  ARG  69           HB3      ARG  69  -4.750 -18.527   3.614
 1411    HB3  ARG  69           HB2      ARG  69  -5.121 -20.206   3.986
 1412    HG2  ARG  69           HG3      ARG  69  -3.844 -19.780   6.180
 1413    HG3  ARG  69           HG2      ARG  69  -4.032 -18.073   5.780
 1414    HD2  ARG  69           HD3      ARG  69  -5.841 -18.770   7.230
 1415    HD3  ARG  69           HD2      ARG  69  -6.472 -18.402   5.619
 1416    HE   ARG  69           HE       ARG  69  -5.946 -21.098   5.593
 1417   HH11  ARG  69          HH11      ARG  69  -7.967 -18.958   7.489
 1418   HH12  ARG  69          HH12      ARG  69  -9.146 -20.182   7.838
 1419   HH21  ARG  69          HH21      ARG  69  -7.472 -22.704   6.056
 1420   HH22  ARG  69          HH22      ARG  69  -8.858 -22.321   7.026
 1421    H    GLY  70           H        GLY  70  -3.144 -22.081   2.492
 1422    HA2  GLY  70           HA3      GLY  70  -4.027 -22.571   0.314
 1423    HA3  GLY  70           HA2      GLY  70  -3.617 -20.934  -0.178
 1424    H    ILE  71           H        ILE  71  -0.985 -20.948   0.953
 1425    HA   ILE  71           HA       ILE  71   0.477 -21.920  -1.246
 1426    HB   ILE  71           HB       ILE  71   1.587 -21.284   1.493
 1427   HG12  ILE  71          HG13      ILE  71   0.185 -19.423   0.735
 1428   HG13  ILE  71          HG12      ILE  71   1.886 -18.979   0.686
 1429   HG21  ILE  71          HG21      ILE  71   3.610 -20.662   0.229
 1430   HG22  ILE  71          HG22      ILE  71   2.828 -21.209  -1.255
 1431   HG23  ILE  71          HG23      ILE  71   3.182 -22.362   0.031
 1432   HD11  ILE  71          HD11      ILE  71   0.703 -18.149  -1.260
 1433   HD12  ILE  71          HD12      ILE  71   0.202 -19.788  -1.673
 1434   HD13  ILE  71          HD13      ILE  71   1.909 -19.349  -1.729
 1435    H    ASP  72           H        ASP  72   1.123 -23.928  -1.708
 1436    HA   ASP  72           HA       ASP  72   0.545 -26.130  -0.062
 1437    HB2  ASP  72           HB3      ASP  72   1.780 -27.494  -1.674
 1438    HB3  ASP  72           HB2      ASP  72   0.727 -26.353  -2.492
 1439    H    SER  73           H        SER  73   3.334 -24.126  -0.262
 1440    HA   SER  73           HA       SER  73   5.070 -23.822   1.144
 1441    HB2  SER  73           HB3      SER  73   3.671 -25.841   2.907
 1442    HB3  SER  73           HB2      SER  73   4.926 -24.702   3.409
 1443    HG   SER  73           HG       SER  73   2.334 -24.068   2.421
 1444    H    LYS  74           H        LYS  74   4.721 -26.380  -0.682
 1445    HA   LYS  74           HA       LYS  74   7.133 -27.734   0.308
 1446    HB2  LYS  74           HB3      LYS  74   5.144 -29.150  -0.156
 1447    HB3  LYS  74           HB2      LYS  74   5.178 -28.611  -1.826
 1448    HG2  LYS  74           HG3      LYS  74   7.332 -29.663  -2.157
 1449    HG3  LYS  74           HG2      LYS  74   7.382 -30.144  -0.458
 1450    HD2  LYS  74           HD3      LYS  74   6.691 -32.008  -1.860
 1451    HD3  LYS  74           HD2      LYS  74   5.375 -31.506  -0.801
 1452    HE2  LYS  74           HE3      LYS  74   4.349 -30.278  -2.619
 1453    HE3  LYS  74           HE2      LYS  74   5.687 -30.700  -3.683
 1454    HZ1  LYS  74           HZ1      LYS  74   5.068 -33.039  -3.419
 1455    HZ2  LYS  74           HZ2      LYS  74   3.814 -32.128  -4.091
 1456    HZ3  LYS  74           HZ3      LYS  74   3.747 -32.588  -2.467
 1457    H    HIS  75           H        HIS  75   5.694 -26.066  -2.426
 1458    HA   HIS  75           HA       HIS  75   8.220 -26.115  -3.895
 1459    HB2  HIS  75           HB3      HIS  75   5.623 -24.719  -4.595
 1460    HB3  HIS  75           HB2      HIS  75   7.000 -24.953  -5.665
 1461    HD1  HIS  75           HD1      HIS  75   3.837 -26.421  -4.693
 1462    HD2  HIS  75           HD2      HIS  75   7.418 -27.803  -6.299
 1463    HE1  HIS  75           HE1      HIS  75   3.313 -28.676  -5.686
 1464    HE2  HIS  75           HE2      HIS  75   5.518 -29.541  -6.542
 1465    H    TRP  76           H        TRP  76   6.466 -24.146  -1.713
 1466    HA   TRP  76           HA       TRP  76   8.261 -21.888  -2.218
 1467    HB2  TRP  76           HB3      TRP  76   5.251 -21.734  -1.933
 1468    HB3  TRP  76           HB2      TRP  76   6.326 -20.336  -1.900
 1469    HD1  TRP  76           HD1      TRP  76   4.388 -22.483  -4.228
 1470    HE1  TRP  76           HE1      TRP  76   4.885 -21.827  -6.667
 1471    HE3  TRP  76           HE3      TRP  76   8.475 -19.512  -3.454
 1472    HZ2  TRP  76           HZ2      TRP  76   6.754 -20.255  -8.071
 1473    HZ3  TRP  76           HZ3      TRP  76   9.554 -18.470  -5.398
 1474    HH2  TRP  76           HH2      TRP  76   8.714 -18.834  -7.659
 1475    H    ASN  77           H        ASN  77   8.988 -20.892  -0.461
 1476    HA   ASN  77           HA       ASN  77   7.859 -21.538   2.164
 1477    HB2  ASN  77           HB3      ASN  77  10.280 -21.698   2.074
 1478    HB3  ASN  77           HB2      ASN  77  10.405 -20.103   1.348
 1479   HD21  ASN  77          HD21      ASN  77  10.365 -18.317   2.632
 1480   HD22  ASN  77          HD22      ASN  77  10.345 -18.386   4.364
 1481    H    SER  78           H        SER  78   6.875 -19.960   3.416
 1482    HA   SER  78           HA       SER  78   6.209 -17.505   1.949
 1483    HB2  SER  78           HB3      SER  78   4.465 -19.031   1.409
 1484    HB3  SER  78           HB2      SER  78   4.331 -19.582   3.075
 1485    HG   SER  78           HG       SER  78   3.610 -17.044   2.029
 1486    H    TYR  79           H        TYR  79   6.087 -15.719   3.124
 1487    HA   TYR  79           HA       TYR  79   5.027 -15.748   5.781
 1488    HB2  TYR  79           HB3      TYR  79   6.881 -14.570   6.881
 1489    HB3  TYR  79           HB2      TYR  79   7.392 -16.157   6.321
 1490    HD1  TYR  79           HD1      TYR  79   7.641 -12.518   5.646
 1491    HD2  TYR  79           HD2      TYR  79   9.185 -16.394   4.794
 1492    HE1  TYR  79           HE1      TYR  79   9.592 -11.496   4.549
 1493    HE2  TYR  79           HE2      TYR  79  11.133 -15.379   3.691
 1494    HH   TYR  79           HH       TYR  79  11.837 -12.016   3.930
 1495    H    CYS  80           H        CYS  80   4.948 -13.345   6.591
 1496    HA   CYS  80           HA       CYS  80   3.853 -11.937   4.253
 1497    HB2  CYS  80           HB3      CYS  80   3.086 -11.529   7.147
 1498    HB3  CYS  80           HB2      CYS  80   2.195 -11.020   5.709
 1499    H    THR  81           H        THR  81   4.284  -9.827   3.856
 1500    HA   THR  81           HA       THR  81   6.024  -8.395   5.745
 1501    HB   THR  81           HB       THR  81   6.397  -8.432   2.734
 1502    HG1  THR  81           HG1      THR  81   7.656 -10.077   3.107
 1503   HG21  THR  81          HG21      THR  81   7.010  -6.284   3.736
 1504   HG22  THR  81          HG22      THR  81   8.445  -7.157   3.195
 1505   HG23  THR  81          HG23      THR  81   8.033  -7.115   4.909
 1506    H    THR  82           H        THR  82   5.484  -6.256   6.021
 1507    HA   THR  82           HA       THR  82   2.957  -5.446   4.847
 1508    HB   THR  82           HB       THR  82   4.609  -3.966   6.899
 1509    HG1  THR  82           HG1      THR  82   3.441  -6.340   7.127
 1510   HG21  THR  82          HG21      THR  82   2.425  -3.026   7.537
 1511   HG22  THR  82          HG22      THR  82   1.669  -3.903   6.206
 1512   HG23  THR  82          HG23      THR  82   2.849  -2.635   5.871
 1513    H    THR  83           H        THR  83   2.743  -4.019   3.232
 1514    HA   THR  83           HA       THR  83   5.148  -2.753   2.183
 1515    HB   THR  83           HB       THR  83   3.548  -4.001   0.672
 1516    HG1  THR  83           HG1      THR  83   4.993  -2.575  -0.263
 1517   HG21  THR  83          HG21      THR  83   1.548  -2.815  -0.083
 1518   HG22  THR  83          HG22      THR  83   1.837  -1.550   1.109
 1519   HG23  THR  83          HG23      THR  83   1.445  -3.186   1.637
 1520    H    HIS  84           H        HIS  84   4.744  -0.453   1.242
 1521    HA   HIS  84           HA       HIS  84   3.360   1.158   3.257
 1522    HB2  HIS  84           HB3      HIS  84   5.407   2.535   3.611
 1523    HB3  HIS  84           HB2      HIS  84   5.589   0.879   4.180
 1524    HD1  HIS  84           HD1      HIS  84   7.419  -0.526   3.137
 1525    HD2  HIS  84           HD2      HIS  84   6.912   3.132   1.230
 1526    HE1  HIS  84           HE1      HIS  84   9.369  -0.306   1.575
 1527    HE2  HIS  84           HE2      HIS  84   8.872   1.770   0.241
 1528    H    THR  85           H        THR  85   2.697   3.147   2.572
 1529    HA   THR  85           HA       THR  85   3.429   3.925  -0.184
 1530    HB   THR  85           HB       THR  85   0.979   3.340   0.218
 1531    HG1  THR  85           HG1      THR  85   0.528   4.757  -1.315
 1532   HG21  THR  85          HG21      THR  85   0.804   4.332   2.469
 1533   HG22  THR  85          HG22      THR  85  -0.408   4.980   1.368
 1534   HG23  THR  85          HG23      THR  85   1.019   5.935   1.768
 1535    H    PHE  86           H        PHE  86   3.103   6.433  -0.438
 1536    HA   PHE  86           HA       PHE  86   4.347   7.693   1.916
 1537    HB2  PHE  86           HB3      PHE  86   4.911   8.211  -1.016
 1538    HB3  PHE  86           HB2      PHE  86   5.514   9.223   0.298
 1539    HD1  PHE  86           HD1      PHE  86   7.177   8.354   1.871
 1540    HD2  PHE  86           HD2      PHE  86   5.879   6.076  -1.481
 1541    HE1  PHE  86           HE1      PHE  86   9.126   6.874   2.130
 1542    HE2  PHE  86           HE2      PHE  86   7.824   4.590  -1.229
 1543    HZ   PHE  86           HZ       PHE  86   9.449   4.986   0.578
 1544    H    VAL  87           H        VAL  87   3.094   9.123   2.832
 1545    HA   VAL  87           HA       VAL  87   1.049  10.485   1.197
 1546    HB   VAL  87           HB       VAL  87  -0.237  10.750   3.317
 1547   HG11  VAL  87          HG11      VAL  87   0.445   7.956   2.442
 1548   HG12  VAL  87          HG12      VAL  87  -0.884   8.970   1.881
 1549   HG13  VAL  87          HG13      VAL  87  -0.888   8.345   3.528
 1550   HG21  VAL  87          HG21      VAL  87   0.357   9.416   5.266
 1551   HG22  VAL  87          HG22      VAL  87   1.629  10.581   4.890
 1552   HG23  VAL  87          HG23      VAL  87   1.832   8.882   4.462
 1553    H    LYS  88           H        LYS  88   0.671  12.694   1.528
 1554    HA   LYS  88           HA       LYS  88   2.898  14.250   2.443
 1555    HB2  LYS  88           HB3      LYS  88   0.109  15.160   1.689
 1556    HB3  LYS  88           HB2      LYS  88   1.496  16.209   1.921
 1557    HG2  LYS  88           HG3      LYS  88   2.591  15.017   0.003
 1558    HG3  LYS  88           HG2      LYS  88   1.045  14.217  -0.284
 1559    HD2  LYS  88           HD3      LYS  88  -0.013  16.463  -0.445
 1560    HD3  LYS  88           HD2      LYS  88   1.593  17.177  -0.321
 1561    HE2  LYS  88           HE3      LYS  88   0.944  17.082  -2.637
 1562    HE3  LYS  88           HE2      LYS  88   2.260  15.945  -2.351
 1563    HZ1  LYS  88           HZ1      LYS  88  -0.597  15.148  -2.365
 1564    HZ2  LYS  88           HZ2      LYS  88   0.764  14.134  -2.388
 1565    HZ3  LYS  88           HZ3      LYS  88   0.393  15.084  -3.739
 1566    H    ALA  89           H        ALA  89   3.291  14.468   4.540
 1567    HA   ALA  89           HA       ALA  89   1.017  15.128   6.293
 1568    HB1  ALA  89           HB1      ALA  89   3.363  13.392   7.059
 1569    HB2  ALA  89           HB2      ALA  89   1.731  12.815   6.717
 1570    HB3  ALA  89           HB3      ALA  89   2.023  13.865   8.103
 1571    H    LEU  90           H        LEU  90   1.337  16.809   7.666
 1572    HA   LEU  90           HA       LEU  90   3.725  18.381   7.380
 1573    HB2  LEU  90           HB3      LEU  90   1.453  19.387   7.724
 1574    HB3  LEU  90           HB2      LEU  90   1.445  18.708   9.346
 1575    HG   LEU  90           HG       LEU  90   3.545  20.075   9.788
 1576   HD11  LEU  90          HD11      LEU  90   3.849  22.049   8.357
 1577   HD12  LEU  90          HD12      LEU  90   2.661  21.396   7.230
 1578   HD13  LEU  90          HD13      LEU  90   4.179  20.541   7.505
 1579   HD21  LEU  90          HD21      LEU  90   2.275  22.116  10.220
 1580   HD22  LEU  90          HD22      LEU  90   1.355  20.681  10.674
 1581   HD23  LEU  90          HD23      LEU  90   0.979  21.532   9.176
 1582    H    THR  91           H        THR  91   5.500  18.201   8.609
 1583    HA   THR  91           HA       THR  91   5.280  16.584  11.063
 1584    HB   THR  91           HB       THR  91   7.518  15.673  10.574
 1585    HG1  THR  91           HG1      THR  91   7.210  17.256   8.235
 1586   HG21  THR  91          HG21      THR  91   5.487  15.270   8.373
 1587   HG22  THR  91          HG22      THR  91   5.596  14.362   9.881
 1588   HG23  THR  91          HG23      THR  91   6.871  14.220   8.672
 1589    H    THR  92           H        THR  92   6.791  17.073  12.733
 1590    HA   THR  92           HA       THR  92   8.006  19.732  12.436
 1591    HB   THR  92           HB       THR  92   6.247  19.850  14.077
 1592    HG1  THR  92           HG1      THR  92   7.855  21.118  14.779
 1593   HG21  THR  92          HG21      THR  92   6.249  18.501  16.121
 1594   HG22  THR  92          HG22      THR  92   7.633  17.589  15.518
 1595   HG23  THR  92          HG23      THR  92   6.083  17.493  14.684
 1596    H    ASP  93           H        ASP  93  10.077  19.576  12.121
 1597    HA   ASP  93           HA       ASP  93  11.537  17.196  12.739
 1598    HB2  ASP  93           HB3      ASP  93  12.017  18.518  10.714
 1599    HB3  ASP  93           HB2      ASP  93  12.535  19.867  11.723
 1600    H    GLU  94           H        GLU  94  11.793  20.566  13.844
 1601    HA   GLU  94           HA       GLU  94  12.718  19.553  16.430
 1602    HB2  GLU  94           HB3      GLU  94  14.083  21.614  14.730
 1603    HB3  GLU  94           HB2      GLU  94  14.238  21.658  16.478
 1604    HG2  GLU  94           HG3      GLU  94  14.919  19.258  14.808
 1605    HG3  GLU  94           HG2      GLU  94  16.079  20.502  15.255
 1606    H    LYS  95           H        LYS  95  12.244  22.811  15.045
 1607    HA   LYS  95           HA       LYS  95  10.094  23.206  17.017
 1608    HB2  LYS  95           HB3      LYS  95  12.295  25.146  16.296
 1609    HB3  LYS  95           HB2      LYS  95  10.880  25.570  17.246
 1610    HG2  LYS  95           HG3      LYS  95  11.535  23.947  18.949
 1611    HG3  LYS  95           HG2      LYS  95  12.955  23.524  17.992
 1612    HD2  LYS  95           HD3      LYS  95  13.760  25.826  18.180
 1613    HD3  LYS  95           HD2      LYS  95  12.349  26.240  19.155
 1614    HE2  LYS  95           HE3      LYS  95  13.051  24.619  20.846
 1615    HE3  LYS  95           HE2      LYS  95  14.451  24.199  19.864
 1616    HZ1  LYS  95           HZ1      LYS  95  15.269  26.446  20.115
 1617    HZ2  LYS  95           HZ2      LYS  95  15.013  25.750  21.631
 1618    HZ3  LYS  95           HZ3      LYS  95  13.911  26.877  21.025
 1619    H    GLN  96           H        GLN  96  10.591  22.852  13.897
 1620    HA   GLN  96           HA       GLN  96   8.528  24.813  13.176
 1621    HB2  GLN  96           HB3      GLN  96  11.034  24.124  11.645
 1622    HB3  GLN  96           HB2      GLN  96   9.648  24.893  10.887
 1623    HG2  GLN  96           HG3      GLN  96  11.129  26.030  13.244
 1624    HG3  GLN  96           HG2      GLN  96  11.452  26.455  11.563
 1625   HE21  GLN  96          HE21      GLN  96   9.236  26.750  14.221
 1626   HE22  GLN  96          HE22      GLN  96   8.259  27.996  13.526
 1627    H    ALA  97           H        ALA  97   7.167  24.199  11.435
 1628    HA   ALA  97           HA       ALA  97   6.955  21.281  11.152
 1629    HB1  ALA  97           HB1      ALA  97   4.578  21.620  10.756
 1630    HB2  ALA  97           HB2      ALA  97   4.793  23.366  10.877
 1631    HB3  ALA  97           HB3      ALA  97   5.061  22.344  12.290
 1632    H    ALA  98           H        ALA  98   7.153  20.397   9.197
 1633    HA   ALA  98           HA       ALA  98   6.910  22.108   6.827
 1634    HB1  ALA  98           HB1      ALA  98   8.959  21.145   5.892
 1635    HB2  ALA  98           HB2      ALA  98   9.215  20.242   7.384
 1636    HB3  ALA  98           HB3      ALA  98   9.283  22.004   7.398
 1637    H    TRP  99           H        TRP  99   6.308  21.024   4.937
 1638    HA   TRP  99           HA       TRP  99   4.748  18.655   5.368
 1639    HB2  TRP  99           HB3      TRP  99   5.329  20.307   2.908
 1640    HB3  TRP  99           HB2      TRP  99   4.328  18.862   2.870
 1641    HD1  TRP  99           HD1      TRP  99   4.375  22.384   4.428
 1642    HE1  TRP  99           HE1      TRP  99   1.949  23.077   4.934
 1643    HE3  TRP  99           HE3      TRP  99   2.029  18.019   3.209
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.627  21.918   4.815
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.421  17.892   3.427
 1646    HH2  TRP  99           HH2      TRP  99  -1.719  19.802   4.214
 1647    H    ARG 100           H        ARG 100   5.373  16.638   5.168
 1648    HA   ARG 100           HA       ARG 100   7.681  16.032   3.448
 1649    HB2  ARG 100           HB3      ARG 100   7.013  14.826   6.144
 1650    HB3  ARG 100           HB2      ARG 100   8.272  14.226   5.072
 1651    HG2  ARG 100           HG3      ARG 100   8.188  16.955   6.345
 1652    HG3  ARG 100           HG2      ARG 100   9.187  15.595   6.863
 1653    HD2  ARG 100           HD3      ARG 100  10.337  15.618   4.703
 1654    HD3  ARG 100           HD2      ARG 100   9.333  16.968   4.181
 1655    HE   ARG 100           HE       ARG 100  11.317  17.088   6.356
 1656   HH11  ARG 100          HH11      ARG 100   9.416  18.633   3.850
 1657   HH12  ARG 100          HH12      ARG 100  10.229  20.157   3.995
 1658   HH21  ARG 100          HH21      ARG 100  12.400  19.094   6.540
 1659   HH22  ARG 100          HH22      ARG 100  11.927  20.420   5.524
 1660    H    PHE 101           H        PHE 101   7.770  13.762   2.793
 1661    HA   PHE 101           HA       PHE 101   5.060  12.663   2.360
 1662    HB2  PHE 101           HB3      PHE 101   7.529  12.043   0.717
 1663    HB3  PHE 101           HB2      PHE 101   5.855  11.675   0.322
 1664    HD1  PHE 101           HD1      PHE 101   4.286  13.635  -0.123
 1665    HD2  PHE 101           HD2      PHE 101   8.524  14.002  -0.028
 1666    HE1  PHE 101           HE1      PHE 101   4.130  15.735  -1.395
 1667    HE2  PHE 101           HE2      PHE 101   8.376  16.103  -1.299
 1668    HZ   PHE 101           HZ       PHE 101   6.175  16.971  -1.982
 1669    H    ILE 102           H        ILE 102   4.732  11.046   3.794
 1670    HA   ILE 102           HA       ILE 102   7.151   9.681   4.787
 1671    HB   ILE 102           HB       ILE 102   5.897   9.287   6.889
 1672   HG12  ILE 102          HG13      ILE 102   3.879  11.251   5.808
 1673   HG13  ILE 102          HG12      ILE 102   3.625   9.512   5.809
 1674   HG21  ILE 102          HG21      ILE 102   7.445  11.142   6.735
 1675   HG22  ILE 102          HG22      ILE 102   6.059  11.583   7.734
 1676   HG23  ILE 102          HG23      ILE 102   6.173  12.174   6.074
 1677   HD11  ILE 102          HD11      ILE 102   4.014  11.263   8.224
 1678   HD12  ILE 102          HD12      ILE 102   3.826   9.509   8.256
 1679   HD13  ILE 102          HD13      ILE 102   2.503  10.528   7.683
 1680    H    ARG 103           H        ARG 103   7.171   7.531   5.115
 1681    HA   ARG 103           HA       ARG 103   5.327   5.981   3.537
 1682    HB2  ARG 103           HB3      ARG 103   6.745   4.055   4.163
 1683    HB3  ARG 103           HB2      ARG 103   7.696   5.384   3.515
 1684    HG2  ARG 103           HG3      ARG 103   8.465   5.987   5.694
 1685    HG3  ARG 103           HG2      ARG 103   7.350   4.859   6.456
 1686    HD2  ARG 103           HD3      ARG 103   8.546   2.983   5.412
 1687    HD3  ARG 103           HD2      ARG 103   9.672   4.125   4.672
 1688    HE   ARG 103           HE       ARG 103   9.871   4.733   7.284
 1689   HH11  ARG 103          HH11      ARG 103   9.959   1.631   5.660
 1690   HH12  ARG 103          HH12      ARG 103  11.131   0.958   6.743
 1691   HH21  ARG 103          HH21      ARG 103  11.396   3.852   8.717
 1692   HH22  ARG 103          HH22      ARG 103  11.946   2.219   8.493
 1693    H    ILE 104           H        ILE 104   3.497   5.177   4.254
 1694    HA   ILE 104           HA       ILE 104   3.357   4.348   7.080
 1695    HB   ILE 104           HB       ILE 104   0.919   4.697   7.014
 1696   HG12  ILE 104          HG13      ILE 104   1.395   6.022   4.339
 1697   HG13  ILE 104          HG12      ILE 104   0.658   4.441   4.550
 1698   HG21  ILE 104          HG21      ILE 104   0.933   7.149   7.059
 1699   HG22  ILE 104          HG22      ILE 104   2.518   7.145   6.287
 1700   HG23  ILE 104          HG23      ILE 104   2.322   6.463   7.901
 1701   HD11  ILE 104          HD11      ILE 104  -1.013   6.156   4.174
 1702   HD12  ILE 104          HD12      ILE 104  -0.433   7.046   5.580
 1703   HD13  ILE 104          HD13      ILE 104  -1.179   5.460   5.786
 1704    H    ASP 105           H        ASP 105   2.504   2.354   7.514
 1705    HA   ASP 105           HA       ASP 105   2.740   0.342   5.551
 1706    HB2  ASP 105           HB3      ASP 105   1.298   0.252   8.221
 1707    HB3  ASP 105           HB2      ASP 105   1.750  -1.154   7.256
 1708    H    THR 106           H        THR 106   1.281  -0.416   4.095
 1709    HA   THR 106           HA       THR 106  -1.400   0.806   4.275
 1710    HB   THR 106           HB       THR 106  -0.092   0.030   1.679
 1711    HG1  THR 106           HG1      THR 106   0.658   1.977   3.380
 1712   HG21  THR 106          HG21      THR 106  -1.664   1.648   0.764
 1713   HG22  THR 106          HG22      THR 106  -2.227   2.051   2.384
 1714   HG23  THR 106          HG23      THR 106  -2.530   0.446   1.717
 1715    H    ALA 107           H        ALA 107   0.358  -2.138   3.429
 1716    HA   ALA 107           HA       ALA 107  -2.050  -3.687   3.744
 1717    HB1  ALA 107           HB1      ALA 107  -2.250  -2.946   1.415
 1718    HB2  ALA 107           HB2      ALA 107  -2.019  -4.690   1.530
 1719    HB3  ALA 107           HB3      ALA 107  -0.673  -3.650   1.061
 1720    H    CYS 108           H        CYS 108  -1.636  -5.983   3.712
 1721    HA   CYS 108           HA       CYS 108   1.165  -6.603   4.336
 1722    HB2  CYS 108           HB3      CYS 108  -0.434  -7.026   6.167
 1723    HB3  CYS 108           HB2      CYS 108  -1.362  -8.090   5.105
 1724    H    VAL 109           H        VAL 109   2.255  -7.654   2.818
 1725    HA   VAL 109           HA       VAL 109   0.719  -9.143   0.799
 1726    HB   VAL 109           HB       VAL 109   2.553  -8.854  -0.728
 1727   HG11  VAL 109          HG11      VAL 109   2.002  -6.259   0.703
 1728   HG12  VAL 109          HG12      VAL 109   1.024  -6.976  -0.577
 1729   HG13  VAL 109          HG13      VAL 109   2.659  -6.415  -0.926
 1730   HG21  VAL 109          HG21      VAL 109   4.405  -9.134   0.832
 1731   HG22  VAL 109          HG22      VAL 109   4.061  -7.555   1.540
 1732   HG23  VAL 109          HG23      VAL 109   4.610  -7.671  -0.131
 1733    H    CYS 110           H        CYS 110   1.701 -11.129  -0.012
 1734    HA   CYS 110           HA       CYS 110   3.129 -12.545   2.129
 1735    HB2  CYS 110           HB3      CYS 110   0.861 -13.410   1.624
 1736    HB3  CYS 110           HB2      CYS 110   1.361 -13.701  -0.035
 1737    H    VAL 111           H        VAL 111   5.128 -13.216   1.715
 1738    HA   VAL 111           HA       VAL 111   6.138 -12.846  -0.998
 1739    HB   VAL 111           HB       VAL 111   8.317 -12.826  -0.112
 1740   HG11  VAL 111          HG11      VAL 111   8.285 -11.179   1.643
 1741   HG12  VAL 111          HG12      VAL 111   6.625 -11.605   2.059
 1742   HG13  VAL 111          HG13      VAL 111   6.977 -10.849   0.507
 1743   HG21  VAL 111          HG21      VAL 111   8.156 -14.871   1.211
 1744   HG22  VAL 111          HG22      VAL 111   7.243 -14.002   2.445
 1745   HG23  VAL 111          HG23      VAL 111   8.921 -13.570   2.123
 1746    H    LEU 112           H        LEU 112   7.367 -14.484  -2.062
 1747    HA   LEU 112           HA       LEU 112   6.987 -17.193  -0.989
 1748    HB2  LEU 112           HB3      LEU 112   6.830 -16.323  -3.878
 1749    HB3  LEU 112           HB2      LEU 112   6.822 -17.990  -3.337
 1750    HG   LEU 112           HG       LEU 112   4.697 -15.929  -2.716
 1751   HD11  LEU 112          HD11      LEU 112   4.680 -18.320  -4.555
 1752   HD12  LEU 112          HD12      LEU 112   4.684 -16.625  -5.047
 1753   HD13  LEU 112          HD13      LEU 112   3.296 -17.291  -4.188
 1754   HD21  LEU 112          HD21      LEU 112   4.823 -18.874  -2.062
 1755   HD22  LEU 112          HD22      LEU 112   3.438 -17.816  -1.795
 1756   HD23  LEU 112          HD23      LEU 112   4.936 -17.548  -0.905
 1757    H    SER 113           H        SER 113   8.713 -18.484  -1.001
 1758    HA   SER 113           HA       SER 113  11.063 -17.713  -2.574
 1759    HB2  SER 113           HB3      SER 113  12.377 -18.525  -0.439
 1760    HB3  SER 113           HB2      SER 113  11.774 -16.869  -0.529
 1761    HG   SER 113           HG       SER 113   9.814 -17.851   0.527
 1762    H    ARG 114           H        ARG 114  12.724 -19.613  -2.443
 1763    HA   ARG 114           HA       ARG 114  11.177 -21.894  -3.361
 1764    HB2  ARG 114           HB3      ARG 114  14.032 -21.049  -3.710
 1765    HB3  ARG 114           HB2      ARG 114  13.525 -22.687  -4.102
 1766    HG2  ARG 114           HG3      ARG 114  12.379 -20.167  -5.291
 1767    HG3  ARG 114           HG2      ARG 114  13.537 -21.246  -6.074
 1768    HD2  ARG 114           HD3      ARG 114  11.905 -23.077  -5.922
 1769    HD3  ARG 114           HD2      ARG 114  10.747 -21.975  -5.185
 1770    HE   ARG 114           HE       ARG 114  11.658 -20.991  -7.692
 1771   HH11  ARG 114          HH11      ARG 114   9.511 -23.325  -6.211
 1772   HH12  ARG 114          HH12      ARG 114   8.416 -23.365  -7.556
 1773   HH21  ARG 114          HH21      ARG 114  10.219 -21.062  -9.487
 1774   HH22  ARG 114          HH22      ARG 114   8.822 -22.090  -9.419
 1775    H    LYS 115           H        LYS 115  11.988 -21.166  -0.428
 1776    HA   LYS 115           HA       LYS 115  12.314 -22.321   1.504
 1777    HB2  LYS 115           HB3      LYS 115  12.102 -24.790  -0.250
 1778    HB3  LYS 115           HB2      LYS 115  12.089 -24.797   1.506
 1779    HG2  LYS 115           HG3      LYS 115  10.008 -23.478   1.467
 1780    HG3  LYS 115           HG2      LYS 115  10.029 -23.546  -0.297
 1781    HD2  LYS 115           HD3      LYS 115   8.535 -25.238   0.549
 1782    HD3  LYS 115           HD2      LYS 115   9.946 -26.008  -0.175
 1783    HE2  LYS 115           HE3      LYS 115  10.908 -26.395   1.992
 1784    HE3  LYS 115           HE2      LYS 115   9.616 -25.488   2.772
 1785    HZ1  LYS 115           HZ1      LYS 115   9.262 -27.869   2.953
 1786    HZ2  LYS 115           HZ2      LYS 115   9.278 -28.030   1.272
 1787    HZ3  LYS 115           HZ3      LYS 115   8.036 -27.158   2.029
 1788    H    ALA 116           H        ALA 116  14.419 -21.367  -0.090
 1789    HA   ALA 116           HA       ALA 116  16.696 -22.357   1.170
 1790    HB1  ALA 116           HB1      ALA 116  16.388 -24.356  -0.220
 1791    HB2  ALA 116           HB2      ALA 116  17.845 -23.483  -0.681
 1792    HB3  ALA 116           HB3      ALA 116  16.392 -23.353  -1.669
 1793    H    THR 117           H        THR 117  15.681 -21.253  -2.042
 1794    HA   THR 117           HA       THR 117  17.382 -18.880  -1.693
 1795    HB   THR 117           HB       THR 117  17.214 -18.699  -4.216
 1796    HG1  THR 117           HG1      THR 117  16.162 -20.195  -5.291
 1797   HG21  THR 117          HG21      THR 117  18.937 -20.401  -4.638
 1798   HG22  THR 117          HG22      THR 117  18.566 -21.152  -3.085
 1799   HG23  THR 117          HG23      THR 117  19.242 -19.524  -3.138
 1800    H    ARG 118           H        ARG 118  16.443 -16.990  -3.106
 1801    HA   ARG 118           HA       ARG 118  13.532 -16.956  -3.026
 1802    HB2  ARG 118           HB3      ARG 118  13.542 -14.672  -1.994
 1803    HB3  ARG 118           HB2      ARG 118  14.036 -15.949  -0.903
 1804    HG2  ARG 118           HG3      ARG 118  16.042 -14.265  -2.369
 1805    HG3  ARG 118           HG2      ARG 118  15.316 -13.741  -0.853
 1806    HD2  ARG 118           HD3      ARG 118  16.932 -16.254  -1.296
 1807    HD3  ARG 118           HD2      ARG 118  17.458 -14.809  -0.433
 1808    HE   ARG 118           HE       ARG 118  15.162 -15.646   0.839
 1809   HH11  ARG 118          HH11      ARG 118  18.321 -17.001   0.171
 1810   HH12  ARG 118          HH12      ARG 118  18.330 -18.003   1.586
 1811   HH21  ARG 118          HH21      ARG 118  15.169 -16.983   2.700
 1812   HH22  ARG 118          HH22      ARG 118  16.538 -18.004   3.014
  Start of MODEL    9
    1    H1   SER   1           H1       SER   1  28.444 -13.625   7.398
    2    H2   SER   1           H2       SER   1  27.601 -12.205   7.039
    3    H3   SER   1           H3       SER   1  27.270 -13.625   6.184
    4    HA   SER   1           HA       SER   1  26.405 -14.680   8.122
    5    HB2  SER   1           HB3      SER   1  27.872 -13.529   9.751
    6    HB3  SER   1           HB2      SER   1  26.959 -12.041   9.502
    7    HG   SER   1           HG       SER   1  26.083 -14.470  10.665
    8    H    SER   2           H        SER   2  25.819 -11.150   7.999
    9    HA   SER   2           HA       SER   2  22.978 -11.629   7.702
   10    HB2  SER   2           HB3      SER   2  24.494  -9.005   7.702
   11    HB3  SER   2           HB2      SER   2  22.759  -9.217   7.933
   12    HG   SER   2           HG       SER   2  23.709 -10.717   9.750
   13    H    THR   3           H        THR   3  23.161 -12.722   5.618
   14    HA   THR   3           HA       THR   3  23.597 -10.836   3.398
   15    HB   THR   3           HB       THR   3  24.036 -12.929   2.017
   16    HG1  THR   3           HG1      THR   3  24.156 -14.803   3.008
   17   HG21  THR   3          HG21      THR   3  26.378 -13.078   2.759
   18   HG22  THR   3          HG22      THR   3  25.957 -12.199   4.228
   19   HG23  THR   3          HG23      THR   3  25.820 -11.411   2.658
   20    H    HIS   4           H        HIS   4  21.095 -11.218   4.806
   21    HA   HIS   4           HA       HIS   4  19.520 -11.963   2.460
   22    HB2  HIS   4           HB3      HIS   4  17.779 -13.018   3.887
   23    HB3  HIS   4           HB2      HIS   4  19.300 -13.894   3.895
   24    HD1  HIS   4           HD1      HIS   4  20.634 -13.920   6.136
   25    HD2  HIS   4           HD2      HIS   4  16.938 -12.035   6.344
   26    HE1  HIS   4           HE1      HIS   4  20.126 -13.696   8.586
   27    HE2  HIS   4           HE2      HIS   4  17.808 -12.724   8.677
   28    HA   PRO   5           HA       PRO   5  18.367  -7.791   3.731
   29    HB2  PRO   5           HB3      PRO   5  17.762  -6.859   1.291
   30    HB3  PRO   5           HB2      PRO   5  19.438  -7.092   1.806
   31    HG2  PRO   5           HG3      PRO   5  17.720  -8.846   0.085
   32    HG3  PRO   5           HG2      PRO   5  19.421  -8.394  -0.130
   33    HD2  PRO   5           HD3      PRO   5  18.601 -10.781   0.941
   34    HD3  PRO   5           HD2      PRO   5  20.158 -10.016   1.316
   35    H    VAL   6           H        VAL   6  16.512 -10.319   2.589
   36    HA   VAL   6           HA       VAL   6  14.313 -10.833   2.727
   37    HB   VAL   6           HB       VAL   6  14.003  -8.136   4.049
   38   HG11  VAL   6          HG11      VAL   6  11.885  -9.016   4.902
   39   HG12  VAL   6          HG12      VAL   6  12.115 -10.484   3.955
   40   HG13  VAL   6          HG13      VAL   6  11.887  -8.938   3.140
   41   HG21  VAL   6          HG21      VAL   6  14.294 -10.899   5.222
   42   HG22  VAL   6          HG22      VAL   6  13.983  -9.421   6.134
   43   HG23  VAL   6          HG23      VAL   6  15.504  -9.616   5.263
   44    H    PHE   7           H        PHE   7  14.540  -7.368   1.878
   45    HA   PHE   7           HA       PHE   7  12.256  -7.554   0.150
   46    HB2  PHE   7           HB3      PHE   7  14.227  -5.295   0.553
   47    HB3  PHE   7           HB2      PHE   7  12.717  -5.176  -0.339
   48    HD1  PHE   7           HD1      PHE   7  10.550  -5.509   0.905
   49    HD2  PHE   7           HD2      PHE   7  14.290  -5.043   2.880
   50    HE1  PHE   7           HE1      PHE   7   9.373  -4.921   2.980
   51    HE2  PHE   7           HE2      PHE   7  13.122  -4.455   4.962
   52    HZ   PHE   7           HZ       PHE   7  10.661  -4.393   5.018
   53    H    HIS   8           H        HIS   8  13.580  -9.385  -0.922
   54    HA   HIS   8           HA       HIS   8  13.960  -8.714  -3.590
   55    HB2  HIS   8           HB3      HIS   8  16.099  -7.690  -2.689
   56    HB3  HIS   8           HB2      HIS   8  16.603  -9.314  -2.237
   57    HD1  HIS   8           HD1      HIS   8  16.289  -7.026  -5.138
   58    HD2  HIS   8           HD2      HIS   8  17.240 -11.013  -4.431
   59    HE1  HIS   8           HE1      HIS   8  17.306  -7.870  -7.277
   60    HE2  HIS   8           HE2      HIS   8  17.852 -10.288  -6.838
   61    H    MET   9           H        MET   9  14.856 -10.817  -0.936
   62    HA   MET   9           HA       MET   9  14.896 -13.192  -2.579
   63    HB2  MET   9           HB3      MET   9  15.233 -14.381  -0.426
   64    HB3  MET   9           HB2      MET   9  16.398 -13.087  -0.671
   65    HG2  MET   9           HG3      MET   9  15.045 -11.630   0.785
   66    HG3  MET   9           HG2      MET   9  13.951 -12.978   1.074
   67    HE1  MET   9           HE1      MET   9  15.839 -15.459   1.306
   68    HE2  MET   9           HE2      MET   9  14.559 -15.120   2.471
   69    HE3  MET   9           HE3      MET   9  16.188 -15.488   3.035
   70    H    GLY  10           H        GLY  10  12.577 -11.349  -0.903
   71    HA2  GLY  10           HA3      GLY  10  10.656 -13.585  -1.002
   72    HA3  GLY  10           HA2      GLY  10  10.517 -12.199   0.068
   73    H    GLU  11           H        GLU  11  11.566 -11.524  -3.120
   74    HA   GLU  11           HA       GLU  11   9.049 -10.142  -3.609
   75    HB2  GLU  11           HB3      GLU  11  11.704 -10.045  -5.049
   76    HB3  GLU  11           HB2      GLU  11  10.272  -9.177  -5.590
   77    HG2  GLU  11           HG3      GLU  11  10.247  -8.054  -3.332
   78    HG3  GLU  11           HG2      GLU  11  11.841  -8.761  -3.059
   79    H    PHE  12           H        PHE  12   8.719 -12.836  -3.710
   80    HA   PHE  12           HA       PHE  12   8.481 -13.417  -6.572
   81    HB2  PHE  12           HB3      PHE  12   8.220 -15.181  -4.131
   82    HB3  PHE  12           HB2      PHE  12   7.747 -15.710  -5.744
   83    HD1  PHE  12           HD1      PHE  12  10.651 -14.377  -3.828
   84    HD2  PHE  12           HD2      PHE  12   9.306 -16.625  -7.184
   85    HE1  PHE  12           HE1      PHE  12  12.970 -15.034  -4.316
   86    HE2  PHE  12           HE2      PHE  12  11.623 -17.286  -7.671
   87    HZ   PHE  12           HZ       PHE  12  13.457 -16.491  -6.240
   88    H    SER  13           H        SER  13   6.904 -11.813  -6.827
   89    HA   SER  13           HA       SER  13   4.541 -11.565  -5.371
   90    HB2  SER  13           HB3      SER  13   4.996 -10.874  -8.284
   91    HB3  SER  13           HB2      SER  13   3.785 -10.171  -7.218
   92    HG   SER  13           HG       SER  13   5.405  -8.742  -7.130
   93    H    VAL  14           H        VAL  14   2.754 -12.763  -5.287
   94    HA   VAL  14           HA       VAL  14   2.362 -15.080  -6.874
   95    HB   VAL  14           HB       VAL  14   0.102 -15.172  -5.832
   96   HG11  VAL  14          HG11      VAL  14   0.882 -15.470  -3.528
   97   HG12  VAL  14          HG12      VAL  14   2.373 -14.619  -3.928
   98   HG13  VAL  14          HG13      VAL  14   2.008 -16.164  -4.694
   99   HG21  VAL  14          HG21      VAL  14  -0.345 -12.774  -5.703
  100   HG22  VAL  14          HG22      VAL  14   0.933 -12.596  -4.500
  101   HG23  VAL  14          HG23      VAL  14  -0.507 -13.540  -4.123
  102    H    CYS  15           H        CYS  15   1.391 -11.779  -7.167
  103    HA   CYS  15           HA       CYS  15   0.249 -12.394  -9.804
  104    HB2  CYS  15           HB3      CYS  15  -0.639 -10.220  -7.880
  105    HB3  CYS  15           HB2      CYS  15  -1.233 -10.418  -9.529
  106    H    ASP  16           H        ASP  16   1.302 -11.375 -11.435
  107    HA   ASP  16           HA       ASP  16   3.696  -9.970 -10.843
  108    HB2  ASP  16           HB3      ASP  16   3.148 -11.381 -12.938
  109    HB3  ASP  16           HB2      ASP  16   2.357  -9.926 -13.539
  110    H    SER  17           H        SER  17   3.899  -7.937 -10.266
  111    HA   SER  17           HA       SER  17   1.674  -6.105 -10.856
  112    HB2  SER  17           HB3      SER  17   3.566  -6.086  -8.491
  113    HB3  SER  17           HB2      SER  17   2.189  -5.005  -8.737
  114    HG   SER  17           HG       SER  17   1.928  -7.830  -8.623
  115    H    VAL  18           H        VAL  18   2.098  -4.029 -11.503
  116    HA   VAL  18           HA       VAL  18   4.926  -3.342 -11.952
  117    HB   VAL  18           HB       VAL  18   3.935  -3.629 -14.097
  118   HG11  VAL  18          HG11      VAL  18   1.716  -1.811 -13.189
  119   HG12  VAL  18          HG12      VAL  18   1.595  -3.543 -13.502
  120   HG13  VAL  18          HG13      VAL  18   1.925  -2.430 -14.828
  121   HG21  VAL  18          HG21      VAL  18   4.093  -1.377 -15.062
  122   HG22  VAL  18          HG22      VAL  18   5.401  -1.721 -13.932
  123   HG23  VAL  18          HG23      VAL  18   4.054  -0.698 -13.437
  124    H    SER  19           H        SER  19   5.584  -1.797 -10.637
  125    HA   SER  19           HA       SER  19   3.617   0.050  -9.490
  126    HB2  SER  19           HB3      SER  19   6.444  -0.586  -8.589
  127    HB3  SER  19           HB2      SER  19   5.309   0.472  -7.748
  128    HG   SER  19           HG       SER  19   3.985  -1.283  -7.347
  129    H    VAL  20           H        VAL  20   3.523   2.054 -10.216
  130    HA   VAL  20           HA       VAL  20   5.937   3.279 -11.380
  131    HB   VAL  20           HB       VAL  20   3.127   3.562 -12.459
  132   HG11  VAL  20          HG11      VAL  20   5.736   4.671 -13.471
  133   HG12  VAL  20          HG12      VAL  20   4.416   5.589 -12.744
  134   HG13  VAL  20          HG13      VAL  20   4.183   4.788 -14.298
  135   HG21  VAL  20          HG21      VAL  20   4.037   1.367 -12.960
  136   HG22  VAL  20          HG22      VAL  20   5.495   2.107 -13.622
  137   HG23  VAL  20          HG23      VAL  20   3.942   2.350 -14.420
  138    H    TRP  21           H        TRP  21   6.324   5.344 -10.727
  139    HA   TRP  21           HA       TRP  21   4.432   6.599  -8.918
  140    HB2  TRP  21           HB3      TRP  21   7.211   7.359  -9.839
  141    HB3  TRP  21           HB2      TRP  21   6.212   8.436  -8.866
  142    HD1  TRP  21           HD1      TRP  21   8.380   5.336  -8.617
  143    HE1  TRP  21           HE1      TRP  21   8.615   4.655  -6.148
  144    HE3  TRP  21           HE3      TRP  21   4.897   8.486  -6.573
  145    HZ2  TRP  21           HZ2      TRP  21   7.472   5.360  -3.661
  146    HZ3  TRP  21           HZ3      TRP  21   4.530   8.415  -4.140
  147    HH2  TRP  21           HH2      TRP  21   5.791   6.886  -2.719
  148    H    VAL  22           H        VAL  22   2.717   7.249 -10.046
  149    HA   VAL  22           HA       VAL  22   3.032   8.411 -12.680
  150    HB   VAL  22           HB       VAL  22   0.533   7.828 -11.082
  151   HG11  VAL  22          HG11      VAL  22  -0.655   8.075 -13.210
  152   HG12  VAL  22          HG12      VAL  22   0.850   8.558 -13.991
  153   HG13  VAL  22          HG13      VAL  22   0.146   9.573 -12.733
  154   HG21  VAL  22          HG21      VAL  22   1.854   6.285 -13.311
  155   HG22  VAL  22          HG22      VAL  22   0.288   5.905 -12.593
  156   HG23  VAL  22          HG23      VAL  22   1.755   5.803 -11.618
  157    H    GLY  23           H        GLY  23   3.340  10.508 -12.930
  158    HA2  GLY  23           HA3      GLY  23   2.194  12.355 -10.935
  159    HA3  GLY  23           HA2      GLY  23   3.567  12.722 -11.983
  160    H    ASP  24           H        ASP  24   1.186  10.984 -13.580
  161    HA   ASP  24           HA       ASP  24   0.158  13.448 -14.822
  162    HB2  ASP  24           HB3      ASP  24   0.553  10.695 -16.021
  163    HB3  ASP  24           HB2      ASP  24  -0.273  12.019 -16.838
  164    H    LYS  25           H        LYS  25  -0.817  11.591 -12.527
  165    HA   LYS  25           HA       LYS  25  -3.322  10.590 -13.517
  166    HB2  LYS  25           HB3      LYS  25  -1.999   9.620 -11.573
  167    HB3  LYS  25           HB2      LYS  25  -2.523  11.008 -10.632
  168    HG2  LYS  25           HG3      LYS  25  -4.822  10.356 -10.842
  169    HG3  LYS  25           HG2      LYS  25  -4.392   9.041 -11.938
  170    HD2  LYS  25           HD3      LYS  25  -3.021   8.062 -10.082
  171    HD3  LYS  25           HD2      LYS  25  -3.683   9.301  -9.017
  172    HE2  LYS  25           HE3      LYS  25  -5.944   8.478  -9.460
  173    HE3  LYS  25           HE2      LYS  25  -5.291   7.238 -10.534
  174    HZ1  LYS  25           HZ1      LYS  25  -4.016   6.397  -8.568
  175    HZ2  LYS  25           HZ2      LYS  25  -5.700   6.235  -8.449
  176    HZ3  LYS  25           HZ3      LYS  25  -4.913   7.464  -7.602
  177    H    THR  26           H        THR  26  -4.724  12.098 -14.208
  178    HA   THR  26           HA       THR  26  -4.828  14.676 -12.839
  179    HB   THR  26           HB       THR  26  -4.496  14.719 -15.268
  180    HG1  THR  26           HG1      THR  26  -6.746  15.851 -14.053
  181   HG21  THR  26          HG21      THR  26  -7.214  13.408 -15.394
  182   HG22  THR  26          HG22      THR  26  -5.682  12.702 -15.913
  183   HG23  THR  26          HG23      THR  26  -6.350  14.088 -16.775
  184    H    THR  27           H        THR  27  -6.470  11.800 -12.733
  185    HA   THR  27           HA       THR  27  -8.738  13.100 -11.442
  186    HB   THR  27           HB       THR  27 -10.152  11.162 -12.541
  187    HG1  THR  27           HG1      THR  27  -9.191  11.376 -14.916
  188   HG21  THR  27          HG21      THR  27  -9.434  13.703 -14.005
  189   HG22  THR  27          HG22      THR  27 -10.643  13.548 -12.731
  190   HG23  THR  27          HG23      THR  27 -10.880  12.731 -14.275
  191    H    ALA  28           H        ALA  28  -9.388  12.108  -9.623
  192    HA   ALA  28           HA       ALA  28  -8.715   9.294  -9.217
  193    HB1  ALA  28           HB1      ALA  28  -7.648   9.675  -7.080
  194    HB2  ALA  28           HB2      ALA  28  -7.854  11.418  -7.261
  195    HB3  ALA  28           HB3      ALA  28  -6.780  10.540  -8.349
  196    H    THR  29           H        THR  29  -9.701   8.467  -7.166
  197    HA   THR  29           HA       THR  29 -12.347   9.679  -6.852
  198    HB   THR  29           HB       THR  29 -11.532   6.983  -5.797
  199    HG1  THR  29           HG1      THR  29 -12.169   7.744  -8.449
  200   HG21  THR  29          HG21      THR  29 -14.173   8.122  -6.718
  201   HG22  THR  29          HG22      THR  29 -13.669   7.905  -5.042
  202   HG23  THR  29          HG23      THR  29 -13.917   6.500  -6.078
  203    H    ASP  30           H        ASP  30 -12.631  10.932  -5.144
  204    HA   ASP  30           HA       ASP  30 -10.935  10.931  -2.847
  205    HB2  ASP  30           HB3      ASP  30 -12.126  12.959  -3.574
  206    HB3  ASP  30           HB2      ASP  30 -13.674  12.167  -3.284
  207    H    ILE  31           H        ILE  31 -11.808  10.587  -0.607
  208    HA   ILE  31           HA       ILE  31 -12.641   7.930  -0.307
  209    HB   ILE  31           HB       ILE  31 -11.338   9.107   1.397
  210   HG12  ILE  31          HG13      ILE  31 -14.018   8.225   2.493
  211   HG13  ILE  31          HG12      ILE  31 -12.706   7.139   2.046
  212   HG21  ILE  31          HG21      ILE  31 -13.849  10.687   1.926
  213   HG22  ILE  31          HG22      ILE  31 -12.355  11.307   1.225
  214   HG23  ILE  31          HG23      ILE  31 -12.377  10.739   2.894
  215   HD11  ILE  31          HD11      ILE  31 -12.625   9.220   4.217
  216   HD12  ILE  31          HD12      ILE  31 -11.292   8.160   3.762
  217   HD13  ILE  31          HD13      ILE  31 -12.770   7.476   4.439
  218    H    LYS  32           H        LYS  32 -14.467  10.872  -0.608
  219    HA   LYS  32           HA       LYS  32 -16.924   9.752   0.401
  220    HB2  LYS  32           HB3      LYS  32 -16.386  12.271  -1.176
  221    HB3  LYS  32           HB2      LYS  32 -17.921  11.859  -0.417
  222    HG2  LYS  32           HG3      LYS  32 -16.898  11.948   1.771
  223    HG3  LYS  32           HG2      LYS  32 -15.320  12.248   1.044
  224    HD2  LYS  32           HD3      LYS  32 -16.166  14.329   0.095
  225    HD3  LYS  32           HD2      LYS  32 -17.731  14.043   0.852
  226    HE2  LYS  32           HE3      LYS  32 -16.694  14.118   3.052
  227    HE3  LYS  32           HE2      LYS  32 -15.113  14.349   2.306
  228    HZ1  LYS  32           HZ1      LYS  32 -16.040  16.438   3.075
  229    HZ2  LYS  32           HZ2      LYS  32 -17.406  16.220   2.103
  230    HZ3  LYS  32           HZ3      LYS  32 -15.890  16.443   1.392
  231    H    GLY  33           H        GLY  33 -15.212   9.344  -2.428
  232    HA2  GLY  33           HA3      GLY  33 -15.925   7.895  -4.159
  233    HA3  GLY  33           HA2      GLY  33 -17.597   8.273  -3.755
  234    H    LYS  34           H        LYS  34 -15.607  10.995  -3.881
  235    HA   LYS  34           HA       LYS  34 -16.958  11.948  -6.255
  236    HB2  LYS  34           HB3      LYS  34 -14.863  13.300  -4.550
  237    HB3  LYS  34           HB2      LYS  34 -15.871  14.078  -5.755
  238    HG2  LYS  34           HG3      LYS  34 -16.895  12.788  -3.240
  239    HG3  LYS  34           HG2      LYS  34 -16.578  14.505  -3.437
  240    HD2  LYS  34           HD3      LYS  34 -18.188  14.446  -5.382
  241    HD3  LYS  34           HD2      LYS  34 -18.644  12.831  -4.834
  242    HE2  LYS  34           HE3      LYS  34 -20.190  14.432  -3.913
  243    HE3  LYS  34           HE2      LYS  34 -19.187  13.787  -2.619
  244    HZ1  LYS  34           HZ1      LYS  34 -18.777  16.400  -3.970
  245    HZ2  LYS  34           HZ2      LYS  34 -17.831  15.782  -2.710
  246    HZ3  LYS  34           HZ3      LYS  34 -19.451  16.181  -2.434
  247    H    GLU  35           H        GLU  35 -16.093  11.953  -8.269
  248    HA   GLU  35           HA       GLU  35 -13.310  11.261  -8.650
  249    HB2  GLU  35           HB3      GLU  35 -14.952  10.468 -10.284
  250    HB3  GLU  35           HB2      GLU  35 -15.439  12.121 -10.622
  251    HG2  GLU  35           HG3      GLU  35 -13.203  12.593 -11.501
  252    HG3  GLU  35           HG2      GLU  35 -12.735  10.925 -11.182
  253    H    VAL  36           H        VAL  36 -11.783  12.728  -8.373
  254    HA   VAL  36           HA       VAL  36 -12.493  15.554  -8.782
  255    HB   VAL  36           HB       VAL  36 -10.742  16.117  -7.131
  256   HG11  VAL  36          HG11      VAL  36 -11.962  15.359  -5.135
  257   HG12  VAL  36          HG12      VAL  36 -12.861  14.218  -6.137
  258   HG13  VAL  36          HG13      VAL  36 -13.043  15.954  -6.395
  259   HG21  VAL  36          HG21      VAL  36  -9.343  14.132  -7.393
  260   HG22  VAL  36          HG22      VAL  36 -10.611  13.139  -6.669
  261   HG23  VAL  36          HG23      VAL  36  -9.800  14.376  -5.708
  262    H    THR  37           H        THR  37 -10.913  16.956  -9.600
  263    HA   THR  37           HA       THR  37  -9.170  15.710 -11.543
  264    HB   THR  37           HB       THR  37  -9.588  18.652 -11.004
  265    HG1  THR  37           HG1      THR  37 -11.248  16.803 -12.126
  266   HG21  THR  37          HG21      THR  37  -8.581  17.189 -13.448
  267   HG22  THR  37          HG22      THR  37  -7.591  18.116 -12.319
  268   HG23  THR  37          HG23      THR  37  -8.804  18.934 -13.304
  269    H    VAL  38           H        VAL  38  -7.293  15.011 -10.781
  270    HA   VAL  38           HA       VAL  38  -6.033  16.236  -8.502
  271    HB   VAL  38           HB       VAL  38  -5.006  14.005 -10.260
  272   HG11  VAL  38          HG11      VAL  38  -3.605  13.447  -8.338
  273   HG12  VAL  38          HG12      VAL  38  -4.222  14.858  -7.480
  274   HG13  VAL  38          HG13      VAL  38  -3.260  15.066  -8.945
  275   HG21  VAL  38          HG21      VAL  38  -6.553  13.846  -7.678
  276   HG22  VAL  38          HG22      VAL  38  -5.856  12.482  -8.553
  277   HG23  VAL  38          HG23      VAL  38  -7.161  13.420  -9.278
  278    H    LEU  39           H        LEU  39  -4.270  17.520  -8.511
  279    HA   LEU  39           HA       LEU  39  -3.570  18.728 -11.050
  280    HB2  LEU  39           HB3      LEU  39  -2.643  19.401  -8.251
  281    HB3  LEU  39           HB2      LEU  39  -2.378  20.374  -9.686
  282    HG   LEU  39           HG       LEU  39  -5.070  19.790  -8.456
  283   HD11  LEU  39          HD11      LEU  39  -3.397  22.294  -8.414
  284   HD12  LEU  39          HD12      LEU  39  -3.714  21.233  -7.042
  285   HD13  LEU  39          HD13      LEU  39  -5.037  22.135  -7.781
  286   HD21  LEU  39          HD21      LEU  39  -4.276  21.607 -10.726
  287   HD22  LEU  39          HD22      LEU  39  -5.881  21.511 -10.001
  288   HD23  LEU  39          HD23      LEU  39  -5.217  20.121 -10.857
  289    H    ALA  40           H        ALA  40  -2.031  17.785 -12.214
  290    HA   ALA  40           HA       ALA  40   0.015  16.120 -11.201
  291    HB1  ALA  40           HB1      ALA  40   1.028  16.337 -13.411
  292    HB2  ALA  40           HB2      ALA  40  -0.041  17.688 -13.780
  293    HB3  ALA  40           HB3      ALA  40  -0.710  16.072 -13.553
  294    H    GLU  41           H        GLU  41  -0.233  19.518 -11.958
  295    HA   GLU  41           HA       GLU  41   2.329  20.035 -10.611
  296    HB2  GLU  41           HB3      GLU  41   0.597  21.964 -12.174
  297    HB3  GLU  41           HB2      GLU  41   2.239  22.234 -11.621
  298    HG2  GLU  41           HG3      GLU  41   1.468  20.149 -13.639
  299    HG3  GLU  41           HG2      GLU  41   2.003  21.775 -14.056
  300    H    VAL  42           H        VAL  42   2.057  20.452  -8.472
  301    HA   VAL  42           HA       VAL  42  -0.525  21.538  -7.616
  302    HB   VAL  42           HB       VAL  42   0.092  20.869  -5.332
  303   HG11  VAL  42          HG11      VAL  42  -1.144  19.306  -6.698
  304   HG12  VAL  42          HG12      VAL  42  -0.009  18.439  -5.663
  305   HG13  VAL  42          HG13      VAL  42   0.356  18.672  -7.375
  306   HG21  VAL  42          HG21      VAL  42   2.527  21.099  -5.538
  307   HG22  VAL  42          HG22      VAL  42   2.563  19.669  -6.571
  308   HG23  VAL  42          HG23      VAL  42   2.056  19.529  -4.890
  309    H    ASN  43           H        ASN  43  -0.738  23.468  -6.678
  310    HA   ASN  43           HA       ASN  43   1.627  25.181  -6.613
  311    HB2  ASN  43           HB3      ASN  43  -1.309  25.898  -6.340
  312    HB3  ASN  43           HB2      ASN  43   0.023  27.050  -6.412
  313   HD21  ASN  43          HD21      ASN  43  -2.030  24.930  -8.209
  314   HD22  ASN  43          HD22      ASN  43  -1.495  25.403  -9.782
  315    H    ILE  44           H        ILE  44   2.674  24.762  -4.732
  316    HA   ILE  44           HA       ILE  44   1.101  25.055  -2.252
  317    HB   ILE  44           HB       ILE  44   3.717  23.567  -2.608
  318   HG12  ILE  44          HG13      ILE  44   0.933  22.482  -2.108
  319   HG13  ILE  44          HG12      ILE  44   1.763  22.439  -3.662
  320   HG21  ILE  44          HG21      ILE  44   3.352  22.805  -0.312
  321   HG22  ILE  44          HG22      ILE  44   1.896  23.792  -0.210
  322   HG23  ILE  44          HG23      ILE  44   3.473  24.561  -0.387
  323   HD11  ILE  44          HD11      ILE  44   2.657  21.060  -1.138
  324   HD12  ILE  44          HD12      ILE  44   3.496  21.018  -2.689
  325   HD13  ILE  44          HD13      ILE  44   1.895  20.295  -2.532
  326    H    ASN  45           H        ASN  45   1.287  27.218  -1.964
  327    HA   ASN  45           HA       ASN  45   2.173  29.207  -1.337
  328    HB2  ASN  45           HB3      ASN  45   4.323  27.344  -0.333
  329    HB3  ASN  45           HB2      ASN  45   4.457  29.088  -0.141
  330   HD21  ASN  45          HD21      ASN  45   1.426  27.311   0.021
  331   HD22  ASN  45          HD22      ASN  45   1.151  27.589   1.703
  332    H    ASN  46           H        ASN  46   2.327  28.753  -3.936
  333    HA   ASN  46           HA       ASN  46   3.210  29.599  -5.834
  334    HB2  ASN  46           HB3      ASN  46   5.083  31.015  -3.931
  335    HB3  ASN  46           HB2      ASN  46   5.057  31.296  -5.670
  336   HD21  ASN  46          HD21      ASN  46   3.486  31.860  -2.658
  337   HD22  ASN  46          HD22      ASN  46   2.286  32.957  -3.248
  338    H    SER  47           H        SER  47   4.389  27.191  -4.286
  339    HA   SER  47           HA       SER  47   6.690  26.869  -6.093
  340    HB2  SER  47           HB3      SER  47   7.145  26.641  -3.606
  341    HB3  SER  47           HB2      SER  47   6.080  25.237  -3.608
  342    HG   SER  47           HG       SER  47   8.550  25.574  -4.956
  343    H    VAL  48           H        VAL  48   6.204  25.707  -7.831
  344    HA   VAL  48           HA       VAL  48   3.888  23.895  -7.691
  345    HB   VAL  48           HB       VAL  48   5.065  25.150 -10.174
  346   HG11  VAL  48          HG11      VAL  48   3.793  23.124 -10.577
  347   HG12  VAL  48          HG12      VAL  48   2.921  24.532 -11.185
  348   HG13  VAL  48          HG13      VAL  48   2.431  23.777  -9.668
  349   HG21  VAL  48          HG21      VAL  48   3.197  26.730 -10.107
  350   HG22  VAL  48          HG22      VAL  48   4.246  26.909  -8.701
  351   HG23  VAL  48          HG23      VAL  48   2.700  26.075  -8.548
  352    H    PHE  49           H        PHE  49   4.277  21.778  -7.880
  353    HA   PHE  49           HA       PHE  49   6.315  20.793  -9.656
  354    HB2  PHE  49           HB3      PHE  49   7.549  19.507  -7.951
  355    HB3  PHE  49           HB2      PHE  49   7.685  21.238  -7.676
  356    HD1  PHE  49           HD1      PHE  49   6.273  22.286  -5.844
  357    HD2  PHE  49           HD2      PHE  49   6.708  18.074  -6.316
  358    HE1  PHE  49           HE1      PHE  49   5.543  21.950  -3.518
  359    HE2  PHE  49           HE2      PHE  49   5.976  17.737  -3.993
  360    HZ   PHE  49           HZ       PHE  49   5.394  19.676  -2.594
  361    H    ARG  50           H        ARG  50   6.376  18.344  -9.598
  362    HA   ARG  50           HA       ARG  50   3.625  17.411  -9.563
  363    HB2  ARG  50           HB3      ARG  50   6.172  16.138 -10.579
  364    HB3  ARG  50           HB2      ARG  50   4.594  15.372 -10.659
  365    HG2  ARG  50           HG3      ARG  50   3.777  17.146 -12.088
  366    HG3  ARG  50           HG2      ARG  50   5.323  17.986 -11.963
  367    HD2  ARG  50           HD3      ARG  50   4.958  15.220 -13.102
  368    HD3  ARG  50           HD2      ARG  50   5.048  16.693 -14.066
  369    HE   ARG  50           HE       ARG  50   7.309  16.712 -12.512
  370   HH11  ARG  50          HH11      ARG  50   5.907  14.516 -14.847
  371   HH12  ARG  50          HH12      ARG  50   7.444  13.923 -15.397
  372   HH21  ARG  50          HH21      ARG  50   9.328  15.942 -13.234
  373   HH22  ARG  50          HH22      ARG  50   9.390  14.738 -14.486
  374    H    GLN  51           H        GLN  51   2.771  16.117  -8.123
  375    HA   GLN  51           HA       GLN  51   4.229  15.527  -5.727
  376    HB2  GLN  51           HB3      GLN  51   1.393  15.239  -6.623
  377    HB3  GLN  51           HB2      GLN  51   1.932  14.386  -5.184
  378    HG2  GLN  51           HG3      GLN  51   2.130  17.356  -5.619
  379    HG3  GLN  51           HG2      GLN  51   0.892  16.537  -4.662
  380   HE21  GLN  51          HE21      GLN  51   2.833  18.520  -3.792
  381   HE22  GLN  51          HE22      GLN  51   3.773  17.768  -2.548
  382    H    TYR  52           H        TYR  52   2.933  13.636  -8.392
  383    HA   TYR  52           HA       TYR  52   3.228  11.481  -9.066
  384    HB2  TYR  52           HB3      TYR  52   5.362  11.325  -6.925
  385    HB3  TYR  52           HB2      TYR  52   5.087  10.133  -8.187
  386    HD1  TYR  52           HD1      TYR  52   4.929  11.519 -10.648
  387    HD2  TYR  52           HD2      TYR  52   7.286  12.494  -7.241
  388    HE1  TYR  52           HE1      TYR  52   6.534  12.688 -12.096
  389    HE2  TYR  52           HE2      TYR  52   8.891  13.670  -8.680
  390    HH   TYR  52           HH       TYR  52   8.254  14.531 -11.839
  391    H    PHE  53           H        PHE  53   2.285   9.544  -8.650
  392    HA   PHE  53           HA       PHE  53   1.552   8.931  -5.865
  393    HB2  PHE  53           HB3      PHE  53  -0.226   8.571  -8.294
  394    HB3  PHE  53           HB2      PHE  53  -0.644   8.153  -6.633
  395    HD1  PHE  53           HD1      PHE  53  -0.692  10.032  -4.923
  396    HD2  PHE  53           HD2      PHE  53  -0.642  10.702  -9.119
  397    HE1  PHE  53           HE1      PHE  53  -1.538  12.310  -4.558
  398    HE2  PHE  53           HE2      PHE  53  -1.489  12.983  -8.768
  399    HZ   PHE  53           HZ       PHE  53  -1.935  13.790  -6.486
  400    H    PHE  54           H        PHE  54   1.590   6.764  -5.308
  401    HA   PHE  54           HA       PHE  54   3.267   5.139  -7.028
  402    HB2  PHE  54           HB3      PHE  54   3.689   5.407  -4.560
  403    HB3  PHE  54           HB2      PHE  54   2.204   4.517  -4.259
  404    HD1  PHE  54           HD1      PHE  54   5.410   4.176  -6.134
  405    HD2  PHE  54           HD2      PHE  54   2.341   2.253  -3.899
  406    HE1  PHE  54           HE1      PHE  54   6.678   2.071  -6.212
  407    HE2  PHE  54           HE2      PHE  54   3.602   0.144  -3.976
  408    HZ   PHE  54           HZ       PHE  54   5.774   0.049  -5.133
  409    H    GLU  55           H        GLU  55   2.017   4.386  -8.674
  410    HA   GLU  55           HA       GLU  55  -0.475   2.967  -8.016
  411    HB2  GLU  55           HB3      GLU  55   0.640   3.920 -10.668
  412    HB3  GLU  55           HB2      GLU  55  -0.860   3.023 -10.488
  413    HG2  GLU  55           HG3      GLU  55  -0.392   5.670  -9.137
  414    HG3  GLU  55           HG2      GLU  55  -1.049   5.534 -10.768
  415    H    THR  56           H        THR  56  -0.213   0.867  -7.657
  416    HA   THR  56           HA       THR  56   1.717  -0.615  -9.317
  417    HB   THR  56           HB       THR  56   0.501  -1.443  -6.671
  418    HG1  THR  56           HG1      THR  56   2.112  -0.353  -5.857
  419   HG21  THR  56          HG21      THR  56   2.611  -2.764  -8.386
  420   HG22  THR  56          HG22      THR  56   0.978  -3.363  -8.089
  421   HG23  THR  56          HG23      THR  56   2.141  -3.283  -6.766
  422    H    LYS  57           H        LYS  57   0.790  -1.611 -10.966
  423    HA   LYS  57           HA       LYS  57  -2.070  -2.268 -10.758
  424    HB2  LYS  57           HB3      LYS  57  -0.400  -1.844 -13.247
  425    HB3  LYS  57           HB2      LYS  57  -2.145  -2.071 -13.187
  426    HG2  LYS  57           HG3      LYS  57  -2.317   0.025 -11.872
  427    HG3  LYS  57           HG2      LYS  57  -0.588   0.270 -12.104
  428    HD2  LYS  57           HD3      LYS  57  -1.678   1.569 -13.755
  429    HD3  LYS  57           HD2      LYS  57  -1.038   0.151 -14.585
  430    HE2  LYS  57           HE3      LYS  57  -3.304   0.655 -15.322
  431    HE3  LYS  57           HE2      LYS  57  -3.229  -0.900 -14.498
  432    HZ1  LYS  57           HZ1      LYS  57  -4.139   1.644 -13.264
  433    HZ2  LYS  57           HZ2      LYS  57  -4.119   0.128 -12.518
  434    HZ3  LYS  57           HZ3      LYS  57  -5.156   0.415 -13.820
  435    H    CYS  58           H        CYS  58  -2.850  -4.228 -11.451
  436    HA   CYS  58           HA       CYS  58  -0.998  -6.449 -11.369
  437    HB2  CYS  58           HB3      CYS  58  -3.975  -6.507 -11.932
  438    HB3  CYS  58           HB2      CYS  58  -2.973  -7.859 -11.430
  439    H    ARG  59           H        ARG  59   0.236  -6.204 -13.257
  440    HA   ARG  59           HA       ARG  59  -1.036  -5.825 -15.799
  441    HB2  ARG  59           HB3      ARG  59   1.206  -6.032 -16.755
  442    HB3  ARG  59           HB2      ARG  59   1.195  -4.919 -15.397
  443    HG2  ARG  59           HG3      ARG  59   2.165  -6.613 -13.969
  444    HG3  ARG  59           HG2      ARG  59   2.121  -7.777 -15.292
  445    HD2  ARG  59           HD3      ARG  59   3.679  -5.198 -15.255
  446    HD3  ARG  59           HD2      ARG  59   4.351  -6.806 -15.006
  447    HE   ARG  59           HE       ARG  59   2.950  -6.497 -17.504
  448   HH11  ARG  59          HH11      ARG  59   6.021  -6.184 -15.854
  449   HH12  ARG  59          HH12      ARG  59   6.956  -6.219 -17.313
  450   HH21  ARG  59          HH21      ARG  59   4.181  -6.563 -19.434
  451   HH22  ARG  59          HH22      ARG  59   5.908  -6.440 -19.353
  452    H    ALA  60           H        ALA  60  -0.259  -8.527 -13.857
  453    HA   ALA  60           HA       ALA  60  -1.362 -10.250 -15.939
  454    HB1  ALA  60           HB1      ALA  60   0.291 -11.963 -15.676
  455    HB2  ALA  60           HB2      ALA  60   1.093 -11.063 -14.393
  456    HB3  ALA  60           HB3      ALA  60   1.123 -10.453 -16.046
  457    H    SER  61           H        SER  61  -3.247 -10.177 -14.675
  458    HA   SER  61           HA       SER  61  -3.235 -11.198 -11.981
  459    HB2  SER  61           HB3      SER  61  -5.594 -10.778 -13.832
  460    HB3  SER  61           HB2      SER  61  -5.639 -10.931 -12.077
  461    HG   SER  61           HG       SER  61  -5.056  -8.752 -13.642
  462    H    ASN  62           H        ASN  62  -3.573 -13.259 -11.345
  463    HA   ASN  62           HA       ASN  62  -3.612 -15.537 -11.458
  464    HB2  ASN  62           HB3      ASN  62  -5.430 -14.949 -13.805
  465    HB3  ASN  62           HB2      ASN  62  -5.114 -16.574 -13.217
  466   HD21  ASN  62          HD21      ASN  62  -5.097 -15.954 -10.434
  467   HD22  ASN  62          HD22      ASN  62  -6.728 -15.583  -9.987
  468    HA   PRO  63           HA       PRO  63  -0.268 -15.198 -14.757
  469    HB2  PRO  63           HB3      PRO  63   1.675 -16.283 -13.122
  470    HB3  PRO  63           HB2      PRO  63   1.383 -14.548 -13.315
  471    HG2  PRO  63           HG3      PRO  63   0.468 -16.406 -11.155
  472    HG3  PRO  63           HG2      PRO  63   1.057 -14.739 -11.025
  473    HD2  PRO  63           HD3      PRO  63  -1.571 -15.318 -10.883
  474    HD3  PRO  63           HD2      PRO  63  -0.988 -13.829 -11.670
  475    H    VAL  64           H        VAL  64  -1.119 -17.737 -12.472
  476    HA   VAL  64           HA       VAL  64  -0.272 -19.782 -14.384
  477    HB   VAL  64           HB       VAL  64  -0.770 -21.400 -12.553
  478   HG11  VAL  64          HG11      VAL  64   1.154 -20.821 -11.154
  479   HG12  VAL  64          HG12      VAL  64   1.143 -19.189 -11.822
  480   HG13  VAL  64          HG13      VAL  64   1.493 -20.567 -12.866
  481   HG21  VAL  64          HG21      VAL  64  -1.118 -20.563 -10.279
  482   HG22  VAL  64          HG22      VAL  64  -2.448 -20.112 -11.347
  483   HG23  VAL  64          HG23      VAL  64  -1.227 -18.918 -10.904
  484    H    GLU  65           H        GLU  65  -1.770 -21.504 -14.954
  485    HA   GLU  65           HA       GLU  65  -4.397 -20.423 -15.478
  486    HB2  GLU  65           HB3      GLU  65  -3.107 -21.684 -17.197
  487    HB3  GLU  65           HB2      GLU  65  -3.265 -23.128 -16.209
  488    HG2  GLU  65           HG3      GLU  65  -5.708 -22.983 -16.426
  489    HG3  GLU  65           HG2      GLU  65  -5.510 -21.579 -17.475
  490    H    SER  66           H        SER  66  -4.789 -20.355 -13.135
  491    HA   SER  66           HA       SER  66  -6.684 -22.295 -12.404
  492    HB2  SER  66           HB3      SER  66  -5.468 -23.092 -10.305
  493    HB3  SER  66           HB2      SER  66  -4.880 -23.763 -11.827
  494    HG   SER  66           HG       SER  66  -3.045 -23.110 -10.952
  495    H    GLY  67           H        GLY  67  -4.313 -20.490 -10.485
  496    HA2  GLY  67           HA3      GLY  67  -6.217 -18.360  -9.984
  497    HA3  GLY  67           HA2      GLY  67  -5.820 -19.355  -8.584
  498    H    CYS  68           H        CYS  68  -3.732 -19.278  -7.719
  499    HA   CYS  68           HA       CYS  68  -1.974 -17.205  -8.820
  500    HB2  CYS  68           HB3      CYS  68  -2.896 -17.418  -5.945
  501    HB3  CYS  68           HB2      CYS  68  -1.552 -16.401  -6.474
  502    H    ARG  69           H        ARG  69   0.212 -17.321  -8.036
  503    HA   ARG  69           HA       ARG  69   1.263 -19.918  -8.247
  504    HB2  ARG  69           HB3      ARG  69   2.571 -17.361  -7.287
  505    HB3  ARG  69           HB2      ARG  69   3.442 -18.838  -7.683
  506    HG2  ARG  69           HG3      ARG  69   2.743 -18.662  -9.998
  507    HG3  ARG  69           HG2      ARG  69   1.765 -17.246  -9.613
  508    HD2  ARG  69           HD3      ARG  69   3.756 -16.000  -8.989
  509    HD3  ARG  69           HD2      ARG  69   4.764 -17.421  -9.283
  510    HE   ARG  69           HE       ARG  69   3.712 -17.158 -11.668
  511   HH11  ARG  69          HH11      ARG  69   4.785 -14.583  -9.547
  512   HH12  ARG  69          HH12      ARG  69   5.293 -13.558 -10.850
  513   HH21  ARG  69          HH21      ARG  69   4.366 -15.800 -13.380
  514   HH22  ARG  69          HH22      ARG  69   5.053 -14.245 -13.028
  515    H    GLY  70           H        GLY  70   1.102 -21.456  -6.735
  516    HA2  GLY  70           HA3      GLY  70   2.046 -22.374  -4.737
  517    HA3  GLY  70           HA2      GLY  70   2.023 -20.769  -4.024
  518    H    ILE  71           H        ILE  71  -0.808 -20.485  -5.130
  519    HA   ILE  71           HA       ILE  71  -2.096 -21.330  -2.705
  520    HB   ILE  71           HB       ILE  71  -3.178 -19.984  -5.182
  521   HG12  ILE  71          HG13      ILE  71  -1.593 -18.642  -3.834
  522   HG13  ILE  71          HG12      ILE  71  -3.218 -17.967  -3.826
  523   HG21  ILE  71          HG21      ILE  71  -5.198 -19.515  -3.888
  524   HG22  ILE  71          HG22      ILE  71  -4.568 -20.479  -2.553
  525   HG23  ILE  71          HG23      ILE  71  -4.949 -21.249  -4.093
  526   HD11  ILE  71          HD11      ILE  71  -3.594 -18.971  -1.611
  527   HD12  ILE  71          HD12      ILE  71  -2.249 -17.830  -1.625
  528   HD13  ILE  71          HD13      ILE  71  -1.934 -19.566  -1.622
  529    H    ASP  72           H        ASP  72  -3.435 -23.025  -2.383
  530    HA   ASP  72           HA       ASP  72  -3.803 -25.048  -4.363
  531    HB2  ASP  72           HB3      ASP  72  -3.816 -25.551  -1.929
  532    HB3  ASP  72           HB2      ASP  72  -5.305 -24.628  -1.759
  533    H    SER  73           H        SER  73  -4.841 -24.302  -6.149
  534    HA   SER  73           HA       SER  73  -7.093 -22.515  -5.908
  535    HB2  SER  73           HB3      SER  73  -5.316 -22.303  -7.688
  536    HB3  SER  73           HB2      SER  73  -5.974 -23.768  -8.422
  537    HG   SER  73           HG       SER  73  -8.057 -22.500  -8.311
  538    H    LYS  74           H        LYS  74  -7.025 -25.571  -5.225
  539    HA   LYS  74           HA       LYS  74  -9.326 -26.407  -6.813
  540    HB2  LYS  74           HB3      LYS  74  -7.476 -28.006  -6.491
  541    HB3  LYS  74           HB2      LYS  74  -7.708 -27.916  -4.754
  542    HG2  LYS  74           HG3      LYS  74  -9.864 -28.945  -4.924
  543    HG3  LYS  74           HG2      LYS  74  -9.796 -28.893  -6.688
  544    HD2  LYS  74           HD3      LYS  74  -9.270 -31.124  -5.815
  545    HD3  LYS  74           HD2      LYS  74  -7.907 -30.417  -6.678
  546    HE2  LYS  74           HE3      LYS  74  -6.849 -29.817  -4.602
  547    HE3  LYS  74           HE2      LYS  74  -8.243 -30.381  -3.685
  548    HZ1  LYS  74           HZ1      LYS  74  -6.488 -32.082  -5.371
  549    HZ2  LYS  74           HZ2      LYS  74  -7.806 -32.618  -4.460
  550    HZ3  LYS  74           HZ3      LYS  74  -6.441 -31.995  -3.683
  551    H    HIS  75           H        HIS  75  -8.345 -25.799  -3.471
  552    HA   HIS  75           HA       HIS  75 -11.133 -26.002  -2.587
  553    HB2  HIS  75           HB3      HIS  75  -8.568 -25.582  -1.031
  554    HB3  HIS  75           HB2      HIS  75 -10.167 -25.672  -0.304
  555    HD1  HIS  75           HD1      HIS  75 -11.167 -27.983   0.053
  556    HD2  HIS  75           HD2      HIS  75  -7.587 -28.050  -2.055
  557    HE1  HIS  75           HE1      HIS  75 -10.480 -30.398  -0.030
  558    HE2  HIS  75           HE2      HIS  75  -8.255 -30.401  -1.215
  559    H    TRP  76           H        TRP  76  -8.850 -23.692  -3.571
  560    HA   TRP  76           HA       TRP  76 -10.473 -21.526  -2.422
  561    HB2  TRP  76           HB3      TRP  76  -7.478 -21.582  -2.872
  562    HB3  TRP  76           HB2      TRP  76  -8.390 -20.146  -2.402
  563    HD1  TRP  76           HD1      TRP  76  -6.712 -23.178  -0.989
  564    HE1  TRP  76           HE1      TRP  76  -7.004 -23.223   1.567
  565    HE3  TRP  76           HE3      TRP  76 -10.225 -19.493  -0.504
  566    HZ2  TRP  76           HZ2      TRP  76  -8.518 -21.874   3.525
  567    HZ3  TRP  76           HZ3      TRP  76 -11.040 -18.932   1.747
  568    HH2  TRP  76           HH2      TRP  76 -10.203 -20.101   3.720
  569    H    ASN  77           H        ASN  77 -11.022 -19.872  -3.727
  570    HA   ASN  77           HA       ASN  77 -10.173 -19.968  -6.535
  571    HB2  ASN  77           HB3      ASN  77 -12.593 -19.821  -6.201
  572    HB3  ASN  77           HB2      ASN  77 -12.390 -18.418  -5.163
  573   HD21  ASN  77          HD21      ASN  77 -13.658 -17.087  -6.425
  574   HD22  ASN  77          HD22      ASN  77 -13.155 -16.518  -7.981
  575    H    SER  78           H        SER  78  -8.927 -18.331  -7.378
  576    HA   SER  78           HA       SER  78  -8.067 -16.275  -5.457
  577    HB2  SER  78           HB3      SER  78  -6.173 -17.728  -7.307
  578    HB3  SER  78           HB2      SER  78  -5.774 -16.670  -5.954
  579    HG   SER  78           HG       SER  78  -7.158 -18.440  -4.804
  580    H    TYR  79           H        TYR  79  -7.910 -14.278  -6.255
  581    HA   TYR  79           HA       TYR  79  -7.331 -13.887  -9.051
  582    HB2  TYR  79           HB3      TYR  79  -9.238 -12.239  -9.314
  583    HB3  TYR  79           HB2      TYR  79  -9.689 -13.939  -9.288
  584    HD1  TYR  79           HD1      TYR  79 -10.087 -10.712  -7.700
  585    HD2  TYR  79           HD2      TYR  79 -10.778 -14.886  -7.248
  586    HE1  TYR  79           HE1      TYR  79 -11.771 -10.241  -5.968
  587    HE2  TYR  79           HE2      TYR  79 -12.458 -14.428  -5.513
  588    HH   TYR  79           HH       TYR  79 -13.722 -11.322  -4.961
  589    H    CYS  80           H        CYS  80  -6.547 -11.844  -9.551
  590    HA   CYS  80           HA       CYS  80  -5.181 -10.692  -7.262
  591    HB2  CYS  80           HB3      CYS  80  -4.801 -10.057 -10.198
  592    HB3  CYS  80           HB2      CYS  80  -3.693  -9.685  -8.874
  593    H    THR  81           H        THR  81  -5.726  -8.867  -6.346
  594    HA   THR  81           HA       THR  81  -7.376  -6.938  -7.821
  595    HB   THR  81           HB       THR  81  -7.836  -7.784  -4.944
  596    HG1  THR  81           HG1      THR  81  -8.520  -9.401  -6.406
  597   HG21  THR  81          HG21      THR  81  -9.876  -6.444  -5.108
  598   HG22  THR  81          HG22      THR  81  -9.445  -5.975  -6.752
  599   HG23  THR  81          HG23      THR  81  -8.447  -5.453  -5.395
  600    H    THR  82           H        THR  82  -6.718  -4.847  -7.544
  601    HA   THR  82           HA       THR  82  -4.273  -4.393  -6.125
  602    HB   THR  82           HB       THR  82  -4.684  -1.987  -6.871
  603    HG1  THR  82           HG1      THR  82  -6.630  -1.633  -7.584
  604   HG21  THR  82          HG21      THR  82  -3.166  -3.464  -8.061
  605   HG22  THR  82          HG22      THR  82  -4.075  -2.477  -9.204
  606   HG23  THR  82          HG23      THR  82  -4.517  -4.164  -8.952
  607    H    THR  83           H        THR  83  -3.952  -3.360  -4.230
  608    HA   THR  83           HA       THR  83  -6.283  -2.811  -2.596
  609    HB   THR  83           HB       THR  83  -4.518  -2.276  -0.841
  610    HG1  THR  83           HG1      THR  83  -2.545  -2.127  -1.563
  611   HG21  THR  83          HG21      THR  83  -5.648  -4.444  -0.931
  612   HG22  THR  83          HG22      THR  83  -3.961  -4.630  -0.449
  613   HG23  THR  83          HG23      THR  83  -4.457  -5.021  -2.096
  614    H    HIS  84           H        HIS  84  -7.147  -0.861  -2.404
  615    HA   HIS  84           HA       HIS  84  -5.606   1.401  -3.442
  616    HB2  HIS  84           HB3      HIS  84  -7.832   2.542  -3.700
  617    HB3  HIS  84           HB2      HIS  84  -7.607   1.133  -4.723
  618    HD1  HIS  84           HD1      HIS  84  -9.203  -0.814  -4.418
  619    HD2  HIS  84           HD2      HIS  84  -9.769   2.218  -1.628
  620    HE1  HIS  84           HE1      HIS  84 -11.363  -1.359  -3.254
  621    HE2  HIS  84           HE2      HIS  84 -11.779   0.595  -1.723
  622    H    THR  85           H        THR  85  -4.877   2.844  -2.102
  623    HA   THR  85           HA       THR  85  -6.072   2.990   0.594
  624    HB   THR  85           HB       THR  85  -3.666   2.170   0.433
  625    HG1  THR  85           HG1      THR  85  -3.365   3.041   2.352
  626   HG21  THR  85          HG21      THR  85  -1.923   3.867   0.084
  627   HG22  THR  85          HG22      THR  85  -3.161   5.045  -0.349
  628   HG23  THR  85          HG23      THR  85  -2.897   3.628  -1.367
  629    H    PHE  86           H        PHE  86  -5.885   5.226   1.582
  630    HA   PHE  86           HA       PHE  86  -6.601   7.136  -0.527
  631    HB2  PHE  86           HB3      PHE  86  -7.383   7.088   2.399
  632    HB3  PHE  86           HB2      PHE  86  -7.815   8.374   1.272
  633    HD1  PHE  86           HD1      PHE  86  -9.284   7.851  -0.672
  634    HD2  PHE  86           HD2      PHE  86  -8.610   5.077   2.483
  635    HE1  PHE  86           HE1      PHE  86 -11.280   6.593  -1.362
  636    HE2  PHE  86           HE2      PHE  86 -10.607   3.811   1.802
  637    HZ   PHE  86           HZ       PHE  86 -11.943   4.566  -0.122
  638    H    VAL  87           H        VAL  87  -5.220   8.647  -0.986
  639    HA   VAL  87           HA       VAL  87  -3.203   9.381   1.022
  640    HB   VAL  87           HB       VAL  87  -1.782  10.098  -0.870
  641   HG11  VAL  87          HG11      VAL  87  -1.240   7.859  -1.718
  642   HG12  VAL  87          HG12      VAL  87  -2.751   7.252  -1.040
  643   HG13  VAL  87          HG13      VAL  87  -1.493   7.872   0.028
  644   HG21  VAL  87          HG21      VAL  87  -2.367   9.474  -3.156
  645   HG22  VAL  87          HG22      VAL  87  -3.532  10.618  -2.488
  646   HG23  VAL  87          HG23      VAL  87  -3.941   8.906  -2.603
  647    H    LYS  88           H        LYS  88  -2.545  11.574   1.099
  648    HA   LYS  88           HA       LYS  88  -4.806  13.382   0.781
  649    HB2  LYS  88           HB3      LYS  88  -2.170  13.963   2.142
  650    HB3  LYS  88           HB2      LYS  88  -3.727  14.741   2.411
  651    HG2  LYS  88           HG3      LYS  88  -4.593  12.809   3.500
  652    HG3  LYS  88           HG2      LYS  88  -3.197  11.847   3.031
  653    HD2  LYS  88           HD3      LYS  88  -1.783  13.392   4.403
  654    HD3  LYS  88           HD2      LYS  88  -3.275  14.134   4.988
  655    HE2  LYS  88           HE3      LYS  88  -2.471  11.242   5.292
  656    HE3  LYS  88           HE2      LYS  88  -2.465  12.464   6.562
  657    HZ1  LYS  88           HZ1      LYS  88  -4.433  11.123   6.747
  658    HZ2  LYS  88           HZ2      LYS  88  -4.845  11.409   5.132
  659    HZ3  LYS  88           HZ3      LYS  88  -4.889  12.679   6.248
  660    H    ALA  89           H        ALA  89  -4.895  14.346  -1.159
  661    HA   ALA  89           HA       ALA  89  -2.366  15.347  -2.302
  662    HB1  ALA  89           HB1      ALA  89  -3.063  13.259  -3.423
  663    HB2  ALA  89           HB2      ALA  89  -3.037  14.650  -4.507
  664    HB3  ALA  89           HB3      ALA  89  -4.574  14.045  -3.887
  665    H    LEU  90           H        LEU  90  -2.438  17.281  -3.351
  666    HA   LEU  90           HA       LEU  90  -4.706  18.969  -2.883
  667    HB2  LEU  90           HB3      LEU  90  -2.335  19.772  -2.823
  668    HB3  LEU  90           HB2      LEU  90  -2.239  19.500  -4.558
  669    HG   LEU  90           HG       LEU  90  -4.154  21.156  -4.795
  670   HD11  LEU  90          HD11      LEU  90  -4.971  21.129  -2.522
  671   HD12  LEU  90          HD12      LEU  90  -4.428  22.751  -2.944
  672   HD13  LEU  90          HD13      LEU  90  -3.419  21.721  -1.928
  673   HD21  LEU  90          HD21      LEU  90  -1.523  22.112  -3.673
  674   HD22  LEU  90          HD22      LEU  90  -2.672  23.105  -4.572
  675   HD23  LEU  90          HD23      LEU  90  -1.873  21.745  -5.362
  676    H    THR  91           H        THR  91  -6.460  18.564  -4.042
  677    HA   THR  91           HA       THR  91  -6.172  18.221  -6.961
  678    HB   THR  91           HB       THR  91  -8.205  16.847  -6.922
  679    HG1  THR  91           HG1      THR  91  -8.447  17.909  -4.471
  680   HG21  THR  91          HG21      THR  91  -7.336  14.871  -5.777
  681   HG22  THR  91          HG22      THR  91  -6.181  15.873  -4.900
  682   HG23  THR  91          HG23      THR  91  -6.047  15.698  -6.647
  683    H    THR  92           H        THR  92  -7.926  19.175  -8.237
  684    HA   THR  92           HA       THR  92  -9.040  21.470  -6.813
  685    HB   THR  92           HB       THR  92  -7.790  22.018  -8.848
  686    HG1  THR  92           HG1      THR  92  -9.256  23.474  -9.540
  687   HG21  THR  92          HG21      THR  92  -8.220  19.994 -10.152
  688   HG22  THR  92          HG22      THR  92  -8.655  21.445 -11.056
  689   HG23  THR  92          HG23      THR  92  -9.915  20.459 -10.316
  690    H    ASP  93           H        ASP  93 -11.010  21.495  -6.181
  691    HA   ASP  93           HA       ASP  93 -12.786  19.321  -6.542
  692    HB2  ASP  93           HB3      ASP  93 -12.732  20.854  -4.551
  693    HB3  ASP  93           HB2      ASP  93 -13.438  22.113  -5.557
  694    H    GLU  94           H        GLU  94 -12.250  22.268  -8.216
  695    HA   GLU  94           HA       GLU  94 -13.673  21.547 -10.509
  696    HB2  GLU  94           HB3      GLU  94 -15.551  22.177  -8.796
  697    HB3  GLU  94           HB2      GLU  94 -15.038  23.828  -9.093
  698    HG2  GLU  94           HG3      GLU  94 -15.970  21.919 -11.218
  699    HG3  GLU  94           HG2      GLU  94 -16.984  23.122 -10.433
  700    H    LYS  95           H        LYS  95 -13.298  24.609  -8.729
  701    HA   LYS  95           HA       LYS  95 -11.008  25.265 -10.437
  702    HB2  LYS  95           HB3      LYS  95 -11.768  27.600 -10.630
  703    HB3  LYS  95           HB2      LYS  95 -12.893  26.490 -11.393
  704    HG2  LYS  95           HG3      LYS  95 -14.391  26.661  -9.499
  705    HG3  LYS  95           HG2      LYS  95 -13.247  27.714  -8.664
  706    HD2  LYS  95           HD3      LYS  95 -13.483  29.382 -10.417
  707    HD3  LYS  95           HD2      LYS  95 -14.569  28.314 -11.305
  708    HE2  LYS  95           HE3      LYS  95 -16.167  28.402  -9.463
  709    HE3  LYS  95           HE2      LYS  95 -15.084  29.465  -8.567
  710    HZ1  LYS  95           HZ1      LYS  95 -15.338  31.137 -10.248
  711    HZ2  LYS  95           HZ2      LYS  95 -16.872  30.660  -9.731
  712    HZ3  LYS  95           HZ3      LYS  95 -16.270  30.109 -11.209
  713    H    GLN  96           H        GLN  96 -11.200  24.200  -7.808
  714    HA   GLN  96           HA       GLN  96  -9.829  26.267  -6.282
  715    HB2  GLN  96           HB3      GLN  96 -12.192  26.430  -5.600
  716    HB3  GLN  96           HB2      GLN  96 -12.207  24.713  -5.230
  717    HG2  GLN  96           HG3      GLN  96 -12.012  26.013  -3.208
  718    HG3  GLN  96           HG2      GLN  96 -10.544  25.075  -3.480
  719   HE21  GLN  96          HE21      GLN  96  -9.290  26.417  -2.220
  720   HE22  GLN  96          HE22      GLN  96  -8.836  28.010  -2.718
  721    H    ALA  97           H        ALA  97  -7.970  25.378  -5.675
  722    HA   ALA  97           HA       ALA  97  -7.621  22.521  -5.649
  723    HB1  ALA  97           HB1      ALA  97  -5.694  24.727  -4.939
  724    HB2  ALA  97           HB2      ALA  97  -5.848  23.943  -6.512
  725    HB3  ALA  97           HB3      ALA  97  -5.283  23.022  -5.118
  726    H    ALA  98           H        ALA  98  -7.823  21.225  -3.969
  727    HA   ALA  98           HA       ALA  98  -7.427  22.235  -1.260
  728    HB1  ALA  98           HB1      ALA  98  -9.913  20.757  -2.131
  729    HB2  ALA  98           HB2      ALA  98  -9.832  22.460  -1.684
  730    HB3  ALA  98           HB3      ALA  98  -9.512  21.216  -0.477
  731    H    TRP  99           H        TRP  99  -6.895  20.595   0.240
  732    HA   TRP  99           HA       TRP  99  -5.626  18.303  -0.971
  733    HB2  TRP  99           HB3      TRP  99  -5.810  19.232   1.905
  734    HB3  TRP  99           HB2      TRP  99  -4.942  17.787   1.407
  735    HD1  TRP  99           HD1      TRP  99  -4.720  21.603   1.281
  736    HE1  TRP  99           HE1      TRP  99  -2.331  22.269   0.587
  737    HE3  TRP  99           HE3      TRP  99  -2.899  16.976   0.109
  738    HZ2  TRP  99           HZ2      TRP  99   0.013  20.998  -0.341
  739    HZ3  TRP  99           HZ3      TRP  99  -0.571  16.787  -0.674
  740    HH2  TRP  99           HH2      TRP  99   0.852  18.757  -0.891
  741    H    ARG 100           H        ARG 100  -7.002  16.795  -1.650
  742    HA   ARG 100           HA       ARG 100  -9.198  15.965   0.113
  743    HB2  ARG 100           HB3      ARG 100  -8.663  15.364  -2.807
  744    HB3  ARG 100           HB2      ARG 100 -10.030  14.739  -1.900
  745    HG2  ARG 100           HG3      ARG 100  -9.489  17.653  -2.431
  746    HG3  ARG 100           HG2      ARG 100 -10.609  16.642  -3.337
  747    HD2  ARG 100           HD3      ARG 100 -11.752  16.194  -1.104
  748    HD3  ARG 100           HD2      ARG 100 -10.792  17.532  -0.475
  749    HE   ARG 100           HE       ARG 100 -12.573  17.888  -2.793
  750   HH11  ARG 100          HH11      ARG 100 -11.551  18.803   0.432
  751   HH12  ARG 100          HH12      ARG 100 -12.589  20.189   0.506
  752   HH21  ARG 100          HH21      ARG 100 -13.954  19.714  -2.700
  753   HH22  ARG 100          HH22      ARG 100 -13.949  20.711  -1.276
  754    H    PHE 101           H        PHE 101  -9.673  13.565   0.013
  755    HA   PHE 101           HA       PHE 101  -7.141  12.092   0.346
  756    HB2  PHE 101           HB3      PHE 101  -9.878  11.394   1.456
  757    HB3  PHE 101           HB2      PHE 101  -8.363  10.578   1.818
  758    HD1  PHE 101           HD1      PHE 101  -6.563  11.894   3.027
  759    HD2  PHE 101           HD2      PHE 101 -10.600  13.202   2.725
  760    HE1  PHE 101           HE1      PHE 101  -6.217  13.394   4.945
  761    HE2  PHE 101           HE2      PHE 101 -10.261  14.705   4.642
  762    HZ   PHE 101           HZ       PHE 101  -8.068  14.804   5.755
  763    H    ILE 102           H        ILE 102  -6.728  11.104  -1.563
  764    HA   ILE 102           HA       ILE 102  -9.045   9.998  -3.015
  765    HB   ILE 102           HB       ILE 102  -7.681  10.211  -5.080
  766   HG12  ILE 102          HG13      ILE 102  -5.813  11.872  -3.384
  767   HG13  ILE 102          HG12      ILE 102  -5.461  10.235  -3.917
  768   HG21  ILE 102          HG21      ILE 102  -8.151  12.766  -3.557
  769   HG22  ILE 102          HG22      ILE 102  -9.330  11.895  -4.540
  770   HG23  ILE 102          HG23      ILE 102  -7.926  12.642  -5.302
  771   HD11  ILE 102          HD11      ILE 102  -5.584  10.987  -6.247
  772   HD12  ILE 102          HD12      ILE 102  -4.352  11.853  -5.327
  773   HD13  ILE 102          HD13      ILE 102  -5.894  12.631  -5.688
  774    H    ARG 103           H        ARG 103  -8.935   7.975  -3.868
  775    HA   ARG 103           HA       ARG 103  -7.070   6.246  -2.504
  776    HB2  ARG 103           HB3      ARG 103  -8.424   4.396  -3.409
  777    HB3  ARG 103           HB2      ARG 103  -9.401   5.581  -2.564
  778    HG2  ARG 103           HG3      ARG 103 -10.710   5.191  -4.381
  779    HG3  ARG 103           HG2      ARG 103  -9.757   6.543  -4.979
  780    HD2  ARG 103           HD3      ARG 103  -8.236   4.954  -6.090
  781    HD3  ARG 103           HD2      ARG 103  -9.241   3.618  -5.525
  782    HE   ARG 103           HE       ARG 103 -10.873   5.409  -6.920
  783   HH11  ARG 103          HH11      ARG 103  -8.209   3.222  -7.569
  784   HH12  ARG 103          HH12      ARG 103  -8.706   2.911  -9.199
  785   HH21  ARG 103          HH21      ARG 103 -11.513   5.008  -9.062
  786   HH22  ARG 103          HH22      ARG 103 -10.575   3.940 -10.056
  787    H    ILE 104           H        ILE 104  -5.339   5.342  -3.289
  788    HA   ILE 104           HA       ILE 104  -5.004   5.212  -6.213
  789    HB   ILE 104           HB       ILE 104  -2.586   5.385  -5.928
  790   HG12  ILE 104          HG13      ILE 104  -3.107   5.930  -3.003
  791   HG13  ILE 104          HG12      ILE 104  -2.526   4.393  -3.627
  792   HG21  ILE 104          HG21      ILE 104  -3.780   7.445  -6.310
  793   HG22  ILE 104          HG22      ILE 104  -2.436   7.738  -5.207
  794   HG23  ILE 104          HG23      ILE 104  -4.081   7.628  -4.582
  795   HD11  ILE 104          HD11      ILE 104  -1.113   7.038  -3.820
  796   HD12  ILE 104          HD12      ILE 104  -0.530   5.515  -4.493
  797   HD13  ILE 104          HD13      ILE 104  -0.701   5.700  -2.746
  798    H    ASP 105           H        ASP 105  -4.138   3.304  -7.023
  799    HA   ASP 105           HA       ASP 105  -4.484   0.997  -5.293
  800    HB2  ASP 105           HB3      ASP 105  -3.872   1.238  -8.254
  801    HB3  ASP 105           HB2      ASP 105  -4.056  -0.298  -7.409
  802    H    THR 106           H        THR 106  -2.807   0.723  -3.953
  803    HA   THR 106           HA       THR 106  -0.182   1.635  -4.838
  804    HB   THR 106           HB       THR 106  -0.976   2.546  -2.730
  805    HG1  THR 106           HG1      THR 106   1.321   1.073  -2.967
  806   HG21  THR 106          HG21      THR 106  -2.427   0.721  -2.010
  807   HG22  THR 106          HG22      THR 106  -1.264   1.127  -0.750
  808   HG23  THR 106          HG23      THR 106  -1.019  -0.310  -1.743
  809    H    ALA 107           H        ALA 107  -1.820  -1.318  -4.498
  810    HA   ALA 107           HA       ALA 107   0.598  -2.780  -5.054
  811    HB1  ALA 107           HB1      ALA 107   0.705  -2.660  -2.610
  812    HB2  ALA 107           HB2      ALA 107   0.447  -4.314  -3.167
  813    HB3  ALA 107           HB3      ALA 107  -0.901  -3.385  -2.507
  814    H    CYS 108           H        CYS 108   0.134  -5.101  -5.447
  815    HA   CYS 108           HA       CYS 108  -2.671  -5.553  -6.216
  816    HB2  CYS 108           HB3      CYS 108  -1.343  -5.220  -8.239
  817    HB3  CYS 108           HB2      CYS 108  -0.158  -6.404  -7.685
  818    H    VAL 109           H        VAL 109  -3.534  -7.150  -5.049
  819    HA   VAL 109           HA       VAL 109  -1.681  -9.152  -3.926
  820    HB   VAL 109           HB       VAL 109  -3.078  -9.297  -1.950
  821   HG11  VAL 109          HG11      VAL 109  -1.314  -7.640  -1.904
  822   HG12  VAL 109          HG12      VAL 109  -2.715  -7.054  -1.006
  823   HG13  VAL 109          HG13      VAL 109  -2.387  -6.442  -2.629
  824   HG21  VAL 109          HG21      VAL 109  -5.251  -8.854  -2.965
  825   HG22  VAL 109          HG22      VAL 109  -4.797  -7.169  -3.229
  826   HG23  VAL 109          HG23      VAL 109  -4.977  -7.787  -1.587
  827    H    CYS 110           H        CYS 110  -2.460 -11.284  -3.692
  828    HA   CYS 110           HA       CYS 110  -4.700 -11.952  -5.442
  829    HB2  CYS 110           HB3      CYS 110  -2.668 -13.284  -5.754
  830    HB3  CYS 110           HB2      CYS 110  -2.685 -13.740  -4.057
  831    H    VAL 111           H        VAL 111  -6.647 -12.045  -4.552
  832    HA   VAL 111           HA       VAL 111  -6.811 -12.508  -1.663
  833    HB   VAL 111           HB       VAL 111  -9.138 -11.733  -1.819
  834   HG11  VAL 111          HG11      VAL 111  -7.428 -10.078  -1.392
  835   HG12  VAL 111          HG12      VAL 111  -8.680  -9.386  -2.424
  836   HG13  VAL 111          HG13      VAL 111  -7.139  -9.888  -3.121
  837   HG21  VAL 111          HG21      VAL 111  -8.555 -11.271  -4.737
  838   HG22  VAL 111          HG22      VAL 111 -10.030 -10.825  -3.879
  839   HG23  VAL 111          HG23      VAL 111  -9.610 -12.526  -4.087
  840    H    LEU 112           H        LEU 112  -8.017 -14.170  -0.781
  841    HA   LEU 112           HA       LEU 112  -8.531 -16.356  -2.661
  842    HB2  LEU 112           HB3      LEU 112  -8.087 -16.416   0.328
  843    HB3  LEU 112           HB2      LEU 112  -8.444 -17.824  -0.656
  844    HG   LEU 112           HG       LEU 112  -5.950 -16.123  -0.757
  845   HD11  LEU 112          HD11      LEU 112  -6.074 -17.723   1.093
  846   HD12  LEU 112          HD12      LEU 112  -4.836 -18.170  -0.079
  847   HD13  LEU 112          HD13      LEU 112  -6.377 -19.026  -0.060
  848   HD21  LEU 112          HD21      LEU 112  -5.164 -17.732  -2.458
  849   HD22  LEU 112          HD22      LEU 112  -6.509 -16.742  -3.016
  850   HD23  LEU 112          HD23      LEU 112  -6.789 -18.413  -2.529
  851    H    SER 113           H        SER 113 -10.456 -17.284  -2.844
  852    HA   SER 113           HA       SER 113 -12.555 -16.488  -0.945
  853    HB2  SER 113           HB3      SER 113 -12.776 -15.485  -3.281
  854    HB3  SER 113           HB2      SER 113 -13.025 -17.131  -3.864
  855    HG   SER 113           HG       SER 113 -14.618 -15.652  -2.042
  856    H    ARG 114           H        ARG 114 -13.975 -18.142  -0.339
  857    HA   ARG 114           HA       ARG 114 -12.734 -20.729  -0.338
  858    HB2  ARG 114           HB3      ARG 114 -13.903 -19.617   1.628
  859    HB3  ARG 114           HB2      ARG 114 -15.419 -20.014   0.836
  860    HG2  ARG 114           HG3      ARG 114 -14.830 -21.635   2.568
  861    HG3  ARG 114           HG2      ARG 114 -14.905 -22.378   0.970
  862    HD2  ARG 114           HD3      ARG 114 -12.500 -22.340   0.792
  863    HD3  ARG 114           HD2      ARG 114 -12.368 -21.462   2.315
  864    HE   ARG 114           HE       ARG 114 -13.635 -23.656   3.108
  865   HH11  ARG 114          HH11      ARG 114 -10.882 -23.324   0.972
  866   HH12  ARG 114          HH12      ARG 114 -10.164 -24.823   1.462
  867   HH21  ARG 114          HH21      ARG 114 -12.713 -25.628   3.735
  868   HH22  ARG 114          HH22      ARG 114 -11.220 -26.150   3.017
  869    H    LYS 115           H        LYS 115 -14.313 -19.383  -2.705
  870    HA   LYS 115           HA       LYS 115 -15.271 -20.160  -4.608
  871    HB2  LYS 115           HB3      LYS 115 -15.225 -22.877  -3.266
  872    HB3  LYS 115           HB2      LYS 115 -15.645 -22.591  -4.947
  873    HG2  LYS 115           HG3      LYS 115 -13.394 -21.791  -5.396
  874    HG3  LYS 115           HG2      LYS 115 -12.974 -21.986  -3.691
  875    HD2  LYS 115           HD3      LYS 115 -12.132 -23.865  -4.960
  876    HD3  LYS 115           HD2      LYS 115 -13.411 -24.396  -3.869
  877    HE2  LYS 115           HE3      LYS 115 -15.002 -24.391  -5.704
  878    HE3  LYS 115           HE2      LYS 115 -13.756 -23.804  -6.804
  879    HZ1  LYS 115           HZ1      LYS 115 -13.989 -26.150  -7.081
  880    HZ2  LYS 115           HZ2      LYS 115 -13.814 -26.430  -5.424
  881    HZ3  LYS 115           HZ3      LYS 115 -12.503 -25.864  -6.326
  882    H    ALA 116           H        ALA 116 -16.765 -22.009  -1.944
  883    HA   ALA 116           HA       ALA 116 -19.410 -21.239  -2.885
  884    HB1  ALA 116           HB1      ALA 116 -18.608 -22.900  -0.495
  885    HB2  ALA 116           HB2      ALA 116 -19.033 -23.528  -2.087
  886    HB3  ALA 116           HB3      ALA 116 -20.244 -22.693  -1.115
  887    H    THR 117           H        THR 117 -18.287 -18.957  -2.375
  888    HA   THR 117           HA       THR 117 -18.616 -18.209   0.420
  889    HB   THR 117           HB       THR 117 -17.794 -15.935  -0.551
  890    HG1  THR 117           HG1      THR 117 -16.315 -16.783  -2.450
  891   HG21  THR 117          HG21      THR 117 -16.011 -18.368  -0.453
  892   HG22  THR 117          HG22      THR 117 -16.461 -17.349   0.915
  893   HG23  THR 117          HG23      THR 117 -15.461 -16.695  -0.384
  894    H    ARG 118           H        ARG 118 -20.563 -18.362  -2.243
  895    HA   ARG 118           HA       ARG 118 -22.244 -16.178  -1.207
  896    HB2  ARG 118           HB3      ARG 118 -22.206 -17.192  -4.060
  897    HB3  ARG 118           HB2      ARG 118 -23.176 -15.871  -3.442
  898    HG2  ARG 118           HG3      ARG 118 -20.197 -15.951  -3.837
  899    HG3  ARG 118           HG2      ARG 118 -21.376 -14.919  -4.644
  900    HD2  ARG 118           HD3      ARG 118 -20.591 -14.814  -1.729
  901    HD3  ARG 118           HD2      ARG 118 -20.134 -13.659  -2.975
  902    HE   ARG 118           HE       ARG 118 -22.571 -13.137  -3.145
  903   HH11  ARG 118          HH11      ARG 118 -21.302 -14.582  -0.211
  904   HH12  ARG 118          HH12      ARG 118 -22.484 -13.835   0.815
  905   HH21  ARG 118          HH21      ARG 118 -24.126 -12.155  -1.788
  906   HH22  ARG 118          HH22      ARG 118 -24.092 -12.465  -0.082
  907    H1   SER   1           H1       SER   1 -30.228 -12.113  -9.597
  908    H2   SER   1           H2       SER   1 -29.394 -10.778  -8.985
  909    H3   SER   1           H3       SER   1 -29.054 -12.326  -8.401
  910    HA   SER   1           HA       SER   1 -28.187 -13.008 -10.508
  911    HB2  SER   1           HB3      SER   1 -29.661 -11.572 -11.890
  912    HB3  SER   1           HB2      SER   1 -28.746 -10.157 -11.373
  913    HG   SER   1           HG       SER   1 -27.857 -12.342 -12.951
  914    H    SER   2           H        SER   2 -27.606  -9.565  -9.738
  915    HA   SER   2           HA       SER   2 -24.763 -10.080  -9.535
  916    HB2  SER   2           HB3      SER   2 -26.286  -7.504  -9.047
  917    HB3  SER   2           HB2      SER   2 -24.548  -7.665  -9.310
  918    HG   SER   2           HG       SER   2 -25.484  -8.797 -11.379
  919    H    THR   3           H        THR   3 -24.945 -11.542  -7.687
  920    HA   THR   3           HA       THR   3 -25.388 -10.101  -5.156
  921    HB   THR   3           HB       THR   3 -25.824 -12.421  -4.197
  922    HG1  THR   3           HG1      THR   3 -25.961 -14.076  -5.530
  923   HG21  THR   3          HG21      THR   3 -28.167 -12.431  -4.942
  924   HG22  THR   3          HG22      THR   3 -27.754 -11.300  -6.229
  925   HG23  THR   3          HG23      THR   3 -27.611 -10.807  -4.542
  926    H    HIS   4           H        HIS   4 -22.877 -10.226  -6.625
  927    HA   HIS   4           HA       HIS   4 -21.310 -11.374  -4.441
  928    HB2  HIS   4           HB3      HIS   4 -19.561 -12.147  -6.031
  929    HB3  HIS   4           HB2      HIS   4 -21.078 -13.010  -6.200
  930    HD1  HIS   4           HD1      HIS   4 -22.415 -12.623  -8.408
  931    HD2  HIS   4           HD2      HIS   4 -18.718 -10.731  -8.270
  932    HE1  HIS   4           HE1      HIS   4 -21.902 -11.967 -10.777
  933    HE2  HIS   4           HE2      HIS   4 -19.593 -10.975 -10.690
  934    HA   PRO   5           HA       PRO   5 -20.163  -7.034  -4.914
  935    HB2  PRO   5           HB3      PRO   5 -19.559  -6.577  -2.343
  936    HB3  PRO   5           HB2      PRO   5 -21.234  -6.714  -2.891
  937    HG2  PRO   5           HG3      PRO   5 -19.513  -8.752  -1.527
  938    HG3  PRO   5           HG2      PRO   5 -21.214  -8.354  -1.233
  939    HD2  PRO   5           HD3      PRO   5 -20.387 -10.496  -2.731
  940    HD3  PRO   5           HD2      PRO   5 -21.946  -9.681  -2.955
  941    H    VAL   6           H        VAL   6 -18.303  -9.729  -4.263
  942    HA   VAL   6           HA       VAL   6 -16.104 -10.206  -4.489
  943    HB   VAL   6           HB       VAL   6 -15.796  -7.311  -5.282
  944   HG11  VAL   6          HG11      VAL   6 -13.674  -8.016  -6.282
  945   HG12  VAL   6          HG12      VAL   6 -13.907  -9.636  -5.623
  946   HG13  VAL   6          HG13      VAL   6 -13.681  -8.267  -4.535
  947   HG21  VAL   6          HG21      VAL   6 -16.081  -9.805  -6.955
  948   HG22  VAL   6          HG22      VAL   6 -15.773  -8.182  -7.573
  949   HG23  VAL   6          HG23      VAL   6 -17.294  -8.540  -6.755
  950    H    PHE   7           H        PHE   7 -16.325  -6.957  -3.022
  951    HA   PHE   7           HA       PHE   7 -14.052  -7.458  -1.344
  952    HB2  PHE   7           HB3      PHE   7 -16.031  -5.167  -1.323
  953    HB3  PHE   7           HB2      PHE   7 -14.520  -5.213  -0.423
  954    HD1  PHE   7           HD1      PHE   7 -12.351  -5.306  -1.703
  955    HD2  PHE   7           HD2      PHE   7 -16.091  -4.488  -3.565
  956    HE1  PHE   7           HE1      PHE   7 -11.174  -4.342  -3.633
  957    HE2  PHE   7           HE2      PHE   7 -14.919  -3.524  -5.501
  958    HZ   PHE   7           HZ       PHE   7 -12.460  -3.449  -5.538
  959    H    HIS   8           H        HIS   8 -15.372  -9.458  -0.633
  960    HA   HIS   8           HA       HIS   8 -15.758  -9.295   2.114
  961    HB2  HIS   8           HB3      HIS   8 -17.901  -8.128   1.411
  962    HB3  HIS   8           HB2      HIS   8 -18.398  -9.643   0.667
  963    HD1  HIS   8           HD1      HIS   8 -18.087  -7.931   3.940
  964    HD2  HIS   8           HD2      HIS   8 -19.034 -11.717   2.509
  965    HE1  HIS   8           HE1      HIS   8 -19.118  -9.148   5.883
  966    HE2  HIS   8           HE2      HIS   8 -19.643 -11.451   5.009
  967    H    MET   9           H        MET   9 -16.638 -10.868  -0.887
  968    HA   MET   9           HA       MET   9 -16.684 -13.505   0.291
  969    HB2  MET   9           HB3      MET   9 -17.024 -14.276  -2.042
  970    HB3  MET   9           HB2      MET   9 -18.187 -13.046  -1.561
  971    HG2  MET   9           HG3      MET   9 -16.834 -11.351  -2.726
  972    HG3  MET   9           HG2      MET   9 -15.741 -12.623  -3.258
  973    HE1  MET   9           HE1      MET   9 -17.619 -15.021  -3.944
  974    HE2  MET   9           HE2      MET   9 -16.342 -14.468  -5.026
  975    HE3  MET   9           HE3      MET   9 -17.970 -14.732  -5.647
  976    H    GLY  10           H        GLY  10 -14.366 -11.383  -1.012
  977    HA2  GLY  10           HA3      GLY  10 -12.443 -13.598  -1.322
  978    HA3  GLY  10           HA2      GLY  10 -12.304 -12.037  -2.118
  979    H    GLU  11           H        GLU  11 -13.355 -11.970   1.141
  980    HA   GLU  11           HA       GLU  11 -10.845 -10.694   1.881
  981    HB2  GLU  11           HB3      GLU  11 -13.501 -10.874   3.307
  982    HB3  GLU  11           HB2      GLU  11 -12.075 -10.116   4.006
  983    HG2  GLU  11           HG3      GLU  11 -12.050  -8.593   1.995
  984    HG3  GLU  11           HG2      GLU  11 -13.639  -9.246   1.586
  985    H    PHE  12           H        PHE  12 -10.513 -13.364   1.480
  986    HA   PHE  12           HA       PHE  12 -10.273 -14.465   4.184
  987    HB2  PHE  12           HB3      PHE  12 -10.003 -15.745   1.456
  988    HB3  PHE  12           HB2      PHE  12  -9.532 -16.565   2.945
  989    HD1  PHE  12           HD1      PHE  12 -12.440 -14.901   1.304
  990    HD2  PHE  12           HD2      PHE  12 -11.094 -17.734   4.186
  991    HE1  PHE  12           HE1      PHE  12 -14.756 -15.641   1.657
  992    HE2  PHE  12           HE2      PHE  12 -13.411 -18.479   4.537
  993    HZ   PHE  12           HZ       PHE  12 -15.244 -17.431   3.273
  994    H    SER  13           H        SER  13  -8.702 -12.915   4.719
  995    HA   SER  13           HA       SER  13  -6.335 -12.411   3.352
  996    HB2  SER  13           HB3      SER  13  -6.785 -12.277   6.343
  997    HB3  SER  13           HB2      SER  13  -5.584 -11.380   5.423
  998    HG   SER  13           HG       SER  13  -7.177  -9.947   5.544
  999    H    VAL  14           H        VAL  14  -4.551 -13.572   3.047
 1000    HA   VAL  14           HA       VAL  14  -4.153 -16.141   4.176
 1001    HB   VAL  14           HB       VAL  14  -1.894 -16.037   3.137
 1002   HG11  VAL  14          HG11      VAL  14  -2.669 -15.905   0.813
 1003   HG12  VAL  14          HG12      VAL  14  -4.163 -15.143   1.363
 1004   HG13  VAL  14          HG13      VAL  14  -3.795 -16.804   1.831
 1005   HG21  VAL  14          HG21      VAL  14  -1.449 -13.655   3.456
 1006   HG22  VAL  14          HG22      VAL  14  -2.724 -13.257   2.304
 1007   HG23  VAL  14          HG23      VAL  14  -1.282 -14.114   1.762
 1008    H    CYS  15           H        CYS  15  -3.188 -12.953   5.076
 1009    HA   CYS  15           HA       CYS  15  -2.045 -14.042   7.554
 1010    HB2  CYS  15           HB3      CYS  15  -1.160 -11.548   6.068
 1011    HB3  CYS  15           HB2      CYS  15  -0.568 -12.049   7.651
 1012    H    ASP  16           H        ASP  16  -3.093 -13.344   9.346
 1013    HA   ASP  16           HA       ASP  16  -5.491 -11.857   9.020
 1014    HB2  ASP  16           HB3      ASP  16  -4.940 -13.635  10.818
 1015    HB3  ASP  16           HB2      ASP  16  -4.165 -12.312  11.686
 1016    H    SER  17           H        SER  17  -5.696  -9.759   8.830
 1017    HA   SER  17           HA       SER  17  -3.479  -8.059   9.751
 1018    HB2  SER  17           HB3      SER  17  -5.369  -7.609   7.428
 1019    HB3  SER  17           HB2      SER  17  -3.996  -6.589   7.869
 1020    HG   SER  17           HG       SER  17  -3.730  -9.344   7.234
 1021    H    VAL  18           H        VAL  18  -3.908  -6.140  10.772
 1022    HA   VAL  18           HA       VAL  18  -6.739  -5.553  11.333
 1023    HB   VAL  18           HB       VAL  18  -5.751  -6.230  13.390
 1024   HG11  VAL  18          HG11      VAL  18  -3.532  -4.274  12.837
 1025   HG12  VAL  18          HG12      VAL  18  -3.410  -6.033  12.825
 1026   HG13  VAL  18          HG13      VAL  18  -3.743  -5.184  14.333
 1027   HG21  VAL  18          HG21      VAL  18  -5.914  -4.197  14.757
 1028   HG22  VAL  18          HG22      VAL  18  -7.220  -4.327  13.582
 1029   HG23  VAL  18          HG23      VAL  18  -5.876  -3.227  13.286
 1030    H    SER  19           H        SER  19  -7.396  -3.797  10.317
 1031    HA   SER  19           HA       SER  19  -5.434  -1.763   9.545
 1032    HB2  SER  19           HB3      SER  19  -8.257  -2.227   8.540
 1033    HB3  SER  19           HB2      SER  19  -7.123  -1.031   7.910
 1034    HG   SER  19           HG       SER  19  -5.798  -2.673   7.187
 1035    H    VAL  20           H        VAL  20  -5.346   0.072  10.629
 1036    HA   VAL  20           HA       VAL  20  -7.763   1.054  11.997
 1037    HB   VAL  20           HB       VAL  20  -4.954   1.137  13.109
 1038   HG11  VAL  20          HG11      VAL  20  -7.561   2.037  14.311
 1039   HG12  VAL  20          HG12      VAL  20  -6.242   3.074  13.765
 1040   HG13  VAL  20          HG13      VAL  20  -6.006   2.000  15.144
 1041   HG21  VAL  20          HG21      VAL  20  -5.861  -1.116  13.200
 1042   HG22  VAL  20          HG22      VAL  20  -7.319  -0.509  13.989
 1043   HG23  VAL  20          HG23      VAL  20  -5.764  -0.415  14.816
 1044    H    TRP  21           H        TRP  21  -8.151   3.207  11.742
 1045    HA   TRP  21           HA       TRP  21  -6.261   4.775  10.193
 1046    HB2  TRP  21           HB3      TRP  21  -9.043   5.348  11.234
 1047    HB3  TRP  21           HB2      TRP  21  -8.044   6.590  10.481
 1048    HD1  TRP  21           HD1      TRP  21 -10.203   3.591   9.657
 1049    HE1  TRP  21           HE1      TRP  21 -10.435   3.381   7.102
 1050    HE3  TRP  21           HE3      TRP  21  -6.724   7.065   8.240
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.292   4.535   4.794
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.355   7.451   5.836
 1053    HH2  TRP  21           HH2      TRP  21  -7.612   6.210   4.153
 1054    H    VAL  22           H        VAL  22  -4.544   5.210  11.425
 1055    HA   VAL  22           HA       VAL  22  -4.867   5.859  14.229
 1056    HB   VAL  22           HB       VAL  22  -2.365   5.588  12.555
 1057   HG11  VAL  22          HG11      VAL  22  -1.181   5.437  14.693
 1058   HG12  VAL  22          HG12      VAL  22  -2.688   5.766  15.548
 1059   HG13  VAL  22          HG13      VAL  22  -1.981   6.996  14.499
 1060   HG21  VAL  22          HG21      VAL  22  -3.685   3.659  14.458
 1061   HG22  VAL  22          HG22      VAL  22  -2.117   3.421  13.689
 1062   HG23  VAL  22          HG23      VAL  22  -3.579   3.497  12.704
 1063    H    GLY  23           H        GLY  23  -5.174   7.867  14.872
 1064    HA2  GLY  23           HA3      GLY  23  -4.045  10.060  13.252
 1065    HA3  GLY  23           HA2      GLY  23  -5.413  10.222  14.355
 1066    H    ASP  24           H        ASP  24  -3.015   8.227  15.596
 1067    HA   ASP  24           HA       ASP  24  -1.996  10.425  17.273
 1068    HB2  ASP  24           HB3      ASP  24  -2.362   7.494  17.945
 1069    HB3  ASP  24           HB2      ASP  24  -1.575   8.665  19.001
 1070    H    LYS  25           H        LYS  25  -1.020   9.030  14.672
 1071    HA   LYS  25           HA       LYS  25   1.485   7.863  15.461
 1072    HB2  LYS  25           HB3      LYS  25   0.164   7.268  13.369
 1073    HB3  LYS  25           HB2      LYS  25   0.689   8.805  12.702
 1074    HG2  LYS  25           HG3      LYS  25   2.989   8.128  12.791
 1075    HG3  LYS  25           HG2      LYS  25   2.558   6.632  13.626
 1076    HD2  LYS  25           HD3      LYS  25   1.189   6.012  11.621
 1077    HD3  LYS  25           HD2      LYS  25   1.852   7.426  10.804
 1078    HE2  LYS  25           HE3      LYS  25   4.114   6.535  11.088
 1079    HE3  LYS  25           HE2      LYS  25   3.458   5.118  11.912
 1080    HZ1  LYS  25           HZ1      LYS  25   2.186   4.657   9.822
 1081    HZ2  LYS  25           HZ2      LYS  25   3.867   4.513   9.677
 1082    HZ3  LYS  25           HZ3      LYS  25   3.085   5.884   9.072
 1083    H    THR  26           H        THR  26   2.887   9.219  16.417
 1084    HA   THR  26           HA       THR  26   2.989  12.004  15.553
 1085    HB   THR  26           HB       THR  26   2.652  11.597  17.948
 1086    HG1  THR  26           HG1      THR  26   4.906  12.931  16.964
 1087   HG21  THR  26          HG21      THR  26   5.368  10.281  17.829
 1088   HG22  THR  26          HG22      THR  26   3.836   9.495  18.209
 1089   HG23  THR  26          HG23      THR  26   4.508  10.696  19.310
 1090    H    THR  27           H        THR  27   4.641   9.188  14.940
 1091    HA   THR  27           HA       THR  27   6.896  10.715  13.894
 1092    HB   THR  27           HB       THR  27   8.330   8.629  14.601
 1093    HG1  THR  27           HG1      THR  27   7.313   8.396  16.985
 1094   HG21  THR  27          HG21      THR  27   7.581  10.823  16.533
 1095   HG22  THR  27          HG22      THR  27   8.802  10.923  15.264
 1096   HG23  THR  27          HG23      THR  27   9.032   9.825  16.624
 1097    H    ALA  28           H        ALA  28   7.546  10.081  11.924
 1098    HA   ALA  28           HA       ALA  28   6.880   7.387  11.001
 1099    HB1  ALA  28           HB1      ALA  28   5.816   8.156   8.972
 1100    HB2  ALA  28           HB2      ALA  28   6.024   9.837   9.470
 1101    HB3  ALA  28           HB3      ALA  28   4.946   8.774  10.378
 1102    H    THR  29           H        THR  29   7.872   6.961   8.832
 1103    HA   THR  29           HA       THR  29  10.518   8.212   8.756
 1104    HB   THR  29           HB       THR  29   9.707   5.750   7.225
 1105    HG1  THR  29           HG1      THR  29  10.337   6.018   9.970
 1106   HG21  THR  29          HG21      THR  29  12.347   6.704   8.334
 1107   HG22  THR  29          HG22      THR  29  11.841   6.803   6.649
 1108   HG23  THR  29          HG23      THR  29  12.093   5.229   7.403
 1109    H    ASP  30           H        ASP  30  10.797   9.761   7.308
 1110    HA   ASP  30           HA       ASP  30   9.106  10.182   5.051
 1111    HB2  ASP  30           HB3      ASP  30  10.296  12.043   6.143
 1112    HB3  ASP  30           HB2      ASP  30  11.844  11.319   5.706
 1113    H    ILE  31           H        ILE  31   9.973  10.250   2.785
 1114    HA   ILE  31           HA       ILE  31  10.824   7.705   1.995
 1115    HB   ILE  31           HB       ILE  31   9.517   9.172   0.539
 1116   HG12  ILE  31          HG13      ILE  31  12.201   8.518  -0.700
 1117   HG13  ILE  31          HG12      ILE  31  10.892   7.365  -0.465
 1118   HG21  ILE  31          HG21      ILE  31  12.024  10.832   0.314
 1119   HG22  ILE  31          HG22      ILE  31  10.527  11.305   1.118
 1120   HG23  ILE  31          HG23      ILE  31  10.550  11.059  -0.627
 1121   HD11  ILE  31          HD11      ILE  31  10.813   9.814  -2.212
 1122   HD12  ILE  31          HD12      ILE  31   9.479   8.688  -1.963
 1123   HD13  ILE  31          HD13      ILE  31  10.958   8.142  -2.754
 1124    H    LYS  32           H        LYS  32  12.640  10.539   2.849
 1125    HA   LYS  32           HA       LYS  32  15.100   9.640   1.647
 1126    HB2  LYS  32           HB3      LYS  32  14.552  11.817   3.663
 1127    HB3  LYS  32           HB2      LYS  32  16.090  11.556   2.846
 1128    HG2  LYS  32           HG3      LYS  32  15.070  12.049   0.710
 1129    HG3  LYS  32           HG2      LYS  32  13.490  12.208   1.479
 1130    HD2  LYS  32           HD3      LYS  32  14.334  14.078   2.798
 1131    HD3  LYS  32           HD2      LYS  32  15.903  13.936   2.003
 1132    HE2  LYS  32           HE3      LYS  32  14.865  14.416  -0.145
 1133    HE3  LYS  32           HE2      LYS  32  13.284  14.507   0.627
 1134    HZ1  LYS  32           HZ1      LYS  32  14.218  16.699   0.251
 1135    HZ2  LYS  32           HZ2      LYS  32  15.575  16.307   1.180
 1136    HZ3  LYS  32           HZ3      LYS  32  14.054  16.400   1.908
 1137    H    GLY  33           H        GLY  33  13.390   8.710   4.350
 1138    HA2  GLY  33           HA3      GLY  33  14.100   6.965   5.781
 1139    HA3  GLY  33           HA2      GLY  33  15.772   7.413   5.462
 1140    H    LYS  34           H        LYS  34  13.781  10.061   6.082
 1141    HA   LYS  34           HA       LYS  34  15.127  10.562   8.593
 1142    HB2  LYS  34           HB3      LYS  34  13.029  12.199   7.162
 1143    HB3  LYS  34           HB2      LYS  34  14.033  12.746   8.489
 1144    HG2  LYS  34           HG3      LYS  34  15.059  11.943   5.779
 1145    HG3  LYS  34           HG2      LYS  34  14.746  13.595   6.294
 1146    HD2  LYS  34           HD3      LYS  34  16.359  13.166   8.193
 1147    HD3  LYS  34           HD2      LYS  34  16.809  11.683   7.349
 1148    HE2  LYS  34           HE3      LYS  34  18.358  13.425   6.745
 1149    HE3  LYS  34           HE2      LYS  34  17.352  13.040   5.353
 1150    HZ1  LYS  34           HZ1      LYS  34  16.943  15.348   7.176
 1151    HZ2  LYS  34           HZ2      LYS  34  16.003  14.981   5.822
 1152    HZ3  LYS  34           HZ3      LYS  34  17.619  15.427   5.629
 1153    H    GLU  35           H        GLU  35  14.259  10.207  10.579
 1154    HA   GLU  35           HA       GLU  35  11.478   9.437  10.814
 1155    HB2  GLU  35           HB3      GLU  35  13.115   8.355  12.277
 1156    HB3  GLU  35           HB2      GLU  35  13.600   9.914  12.920
 1157    HG2  GLU  35           HG3      GLU  35  11.365  10.216  13.870
 1158    HG3  GLU  35           HG2      GLU  35  10.893   8.642  13.241
 1159    H    VAL  36           H        VAL  36   9.947  10.928  10.813
 1160    HA   VAL  36           HA       VAL  36  10.653  13.630  11.741
 1161    HB   VAL  36           HB       VAL  36   8.904  14.485  10.219
 1162   HG11  VAL  36          HG11      VAL  36  10.126  14.116   8.120
 1163   HG12  VAL  36          HG12      VAL  36  11.027  12.808   8.891
 1164   HG13  VAL  36          HG13      VAL  36  11.207  14.465   9.468
 1165   HG21  VAL  36          HG21      VAL  36   7.508  12.483  10.108
 1166   HG22  VAL  36          HG22      VAL  36   8.777  11.646   9.213
 1167   HG23  VAL  36          HG23      VAL  36   7.966  13.039   8.498
 1168    H    THR  37           H        THR  37   9.072  14.853  12.804
 1169    HA   THR  37           HA       THR  37   7.326  13.264  14.476
 1170    HB   THR  37           HB       THR  37   7.745  16.256  14.501
 1171    HG1  THR  37           HG1      THR  37   9.419  14.251  15.236
 1172   HG21  THR  37          HG21      THR  37   6.720  14.366  16.621
 1173   HG22  THR  37          HG22      THR  37   5.734  15.481  15.674
 1174   HG23  THR  37          HG23      THR  37   6.938  16.108  16.801
 1175    H    VAL  38           H        VAL  38   5.453  12.715  13.591
 1176    HA   VAL  38           HA       VAL  38   4.189  14.340  11.581
 1177    HB   VAL  38           HB       VAL  38   3.165  11.819  12.895
 1178   HG11  VAL  38          HG11      VAL  38   1.767  11.625  10.900
 1179   HG12  VAL  38          HG12      VAL  38   2.382  13.172  10.319
 1180   HG13  VAL  38          HG13      VAL  38   1.419  13.103  11.796
 1181   HG21  VAL  38          HG21      VAL  38   4.713  12.145  10.331
 1182   HG22  VAL  38          HG22      VAL  38   4.021  10.641  10.937
 1183   HG23  VAL  38          HG23      VAL  38   5.322  11.435  11.824
 1184    H    LEU  39           H        LEU  39   2.422  15.596  11.827
 1185    HA   LEU  39           HA       LEU  39   1.725  16.316  14.546
 1186    HB2  LEU  39           HB3      LEU  39   0.795  17.491  11.920
 1187    HB3  LEU  39           HB2      LEU  39   0.530  18.182  13.511
 1188    HG   LEU  39           HG       LEU  39   3.222  17.836  12.197
 1189   HD11  LEU  39          HD11      LEU  39   1.547  20.302  12.616
 1190   HD12  LEU  39          HD12      LEU  39   1.867  19.513  11.071
 1191   HD13  LEU  39          HD13      LEU  39   3.189  20.265  11.966
 1192   HD21  LEU  39          HD21      LEU  39   2.423  19.201  14.760
 1193   HD22  LEU  39          HD22      LEU  39   4.029  19.248  14.033
 1194   HD23  LEU  39          HD23      LEU  39   3.371  17.720  14.614
 1195    H    ALA  40           H        ALA  40   0.189  15.171  15.518
 1196    HA   ALA  40           HA       ALA  40  -1.856  13.719  14.218
 1197    HB1  ALA  40           HB1      ALA  40  -2.873  13.522  16.428
 1198    HB2  ALA  40           HB2      ALA  40  -1.808  14.783  17.047
 1199    HB3  ALA  40           HB3      ALA  40  -1.134  13.240  16.522
 1200    H    GLU  41           H        GLU  41  -1.615  16.917  15.584
 1201    HA   GLU  41           HA       GLU  41  -4.173  17.672  14.349
 1202    HB2  GLU  41           HB3      GLU  41  -2.446  19.280  16.246
 1203    HB3  GLU  41           HB2      GLU  41  -4.088  19.649  15.744
 1204    HG2  GLU  41           HG3      GLU  41  -3.333  17.222  17.338
 1205    HG3  GLU  41           HG2      GLU  41  -3.852  18.746  18.056
 1206    H    VAL  42           H        VAL  42  -3.898  18.471  12.327
 1207    HA   VAL  42           HA       VAL  42  -1.320  19.706  11.685
 1208    HB   VAL  42           HB       VAL  42  -1.939  19.471   9.318
 1209   HG11  VAL  42          HG11      VAL  42  -0.700  17.687  10.374
 1210   HG12  VAL  42          HG12      VAL  42  -1.834  17.023   9.196
 1211   HG13  VAL  42          HG13      VAL  42  -2.199  16.936  10.920
 1212   HG21  VAL  42          HG21      VAL  42  -4.372  19.657   9.561
 1213   HG22  VAL  42          HG22      VAL  42  -4.410  18.062  10.316
 1214   HG23  VAL  42          HG23      VAL  42  -3.902  18.231   8.638
 1215    H    ASN  43           H        ASN  43  -1.113  21.778  11.119
 1216    HA   ASN  43           HA       ASN  43  -3.486  23.469  11.374
 1217    HB2  ASN  43           HB3      ASN  43  -0.551  24.233  11.243
 1218    HB3  ASN  43           HB2      ASN  43  -1.883  25.347  11.527
 1219   HD21  ASN  43          HD21      ASN  43   0.178  22.936  12.893
 1220   HD22  ASN  43          HD22      ASN  43  -0.354  23.106  14.527
 1221    H    ILE  44           H        ILE  44  -4.530  23.399   9.448
 1222    HA   ILE  44           HA       ILE  44  -2.956  24.152   7.068
 1223    HB   ILE  44           HB       ILE  44  -5.568  22.624   7.139
 1224   HG12  ILE  44          HG13      ILE  44  -2.780  21.654   6.451
 1225   HG13  ILE  44          HG12      ILE  44  -3.614  21.322   7.969
 1226   HG21  ILE  44          HG21      ILE  44  -5.197  22.299   4.740
 1227   HG22  ILE  44          HG22      ILE  44  -3.742  23.291   4.828
 1228   HG23  ILE  44          HG23      ILE  44  -5.321  24.012   5.140
 1229   HD11  ILE  44          HD11      ILE  44  -4.501  20.431   5.232
 1230   HD12  ILE  44          HD12      ILE  44  -5.340  20.099   6.748
 1231   HD13  ILE  44          HD13      ILE  44  -3.736  19.425   6.461
 1232    H    ASN  45           H        ASN  45  -3.140  26.328   7.195
 1233    HA   ASN  45           HA       ASN  45  -4.026  28.399   6.940
 1234    HB2  ASN  45           HB3      ASN  45  -6.173  26.752   5.607
 1235    HB3  ASN  45           HB2      ASN  45  -6.312  28.501   5.741
 1236   HD21  ASN  45          HD21      ASN  45  -3.281  26.785   5.255
 1237   HD22  ASN  45          HD22      ASN  45  -3.002  27.369   3.653
 1238    H    ASN  46           H        ASN  46  -4.180  27.472   9.413
 1239    HA   ASN  46           HA       ASN  46  -5.071  27.954  11.432
 1240    HB2  ASN  46           HB3      ASN  46  -6.943  29.692   9.817
 1241    HB3  ASN  46           HB2      ASN  46  -6.918  29.650  11.578
 1242   HD21  ASN  46          HD21      ASN  46  -5.348  30.774   8.721
 1243   HD22  ASN  46          HD22      ASN  46  -4.152  31.743   9.511
 1244    H    SER  47           H        SER  47  -6.244  25.874   9.459
 1245    HA   SER  47           HA       SER  47  -8.543  25.217  11.174
 1246    HB2  SER  47           HB3      SER  47  -9.005  25.446   8.687
 1247    HB3  SER  47           HB2      SER  47  -7.937  24.067   8.431
 1248    HG   SER  47           HG       SER  47 -10.422  24.159   9.777
 1249    H    VAL  48           H        VAL  48  -8.054  23.760  12.667
 1250    HA   VAL  48           HA       VAL  48  -5.744  21.999  12.195
 1251    HB   VAL  48           HB       VAL  48  -6.915  22.770  14.868
 1252   HG11  VAL  48          HG11      VAL  48  -5.638  20.711  14.883
 1253   HG12  VAL  48          HG12      VAL  48  -4.767  21.984  15.739
 1254   HG13  VAL  48          HG13      VAL  48  -4.279  21.525  14.108
 1255   HG21  VAL  48          HG21      VAL  48  -5.059  24.344  15.095
 1256   HG22  VAL  48          HG22      VAL  48  -6.106  24.775  13.745
 1257   HG23  VAL  48          HG23      VAL  48  -4.555  23.992  13.442
 1258    H    PHE  49           H        PHE  49  -6.133  19.893  11.986
 1259    HA   PHE  49           HA       PHE  49  -8.168  18.587  13.544
 1260    HB2  PHE  49           HB3      PHE  49  -9.393  17.640  11.629
 1261    HB3  PHE  49           HB2      PHE  49  -9.532  19.391  11.678
 1262    HD1  PHE  49           HD1      PHE  49  -8.118  20.761  10.078
 1263    HD2  PHE  49           HD2      PHE  49  -8.551  16.535   9.760
 1264    HE1  PHE  49           HE1      PHE  49  -7.386  20.862   7.732
 1265    HE2  PHE  49           HE2      PHE  49  -7.814  16.634   7.418
 1266    HZ   PHE  49           HZ       PHE  49  -7.232  18.798   6.401
 1267    H    ARG  50           H        ARG  50  -8.225  16.193  13.030
 1268    HA   ARG  50           HA       ARG  50  -5.467  15.286  12.837
 1269    HB2  ARG  50           HB3      ARG  50  -8.016  13.844  13.594
 1270    HB3  ARG  50           HB2      ARG  50  -6.437  13.077  13.533
 1271    HG2  ARG  50           HG3      ARG  50  -5.622  14.559  15.266
 1272    HG3  ARG  50           HG2      ARG  50  -7.170  15.401  15.298
 1273    HD2  ARG  50           HD3      ARG  50  -6.799  12.476  15.905
 1274    HD3  ARG  50           HD2      ARG  50  -6.892  13.745  17.126
 1275    HE   ARG  50           HE       ARG  50  -9.153  14.050  15.602
 1276   HH11  ARG  50          HH11      ARG  50  -7.749  11.486  17.516
 1277   HH12  ARG  50          HH12      ARG  50  -9.279  10.775  17.919
 1278   HH21  ARG  50          HH21      ARG  50 -11.175  13.138  16.150
 1279   HH22  ARG  50          HH22      ARG  50 -11.230  11.727  17.161
 1280    H    GLN  51           H        GLN  51  -4.605  14.282  11.181
 1281    HA   GLN  51           HA       GLN  51  -6.066  14.144   8.719
 1282    HB2  GLN  51           HB3      GLN  51  -3.228  13.701   9.544
 1283    HB3  GLN  51           HB2      GLN  51  -3.765  13.129   7.972
 1284    HG2  GLN  51           HG3      GLN  51  -3.970  15.968   8.949
 1285    HG3  GLN  51           HG2      GLN  51  -2.730  15.342   7.859
 1286   HE21  GLN  51          HE21      GLN  51  -4.672  17.448   7.369
 1287   HE22  GLN  51          HE22      GLN  51  -5.609  16.936   6.006
 1288    H    TYR  52           H        TYR  52  -4.771  11.789  10.986
 1289    HA   TYR  52           HA       TYR  52  -5.064   9.554  11.250
 1290    HB2  TYR  52           HB3      TYR  52  -7.197   9.791   9.115
 1291    HB3  TYR  52           HB2      TYR  52  -6.921   8.386  10.135
 1292    HD1  TYR  52           HD1      TYR  52  -6.767   9.295  12.811
 1293    HD2  TYR  52           HD2      TYR  52  -9.122  10.875   9.642
 1294    HE1  TYR  52           HE1      TYR  52  -8.375  10.177  14.447
 1295    HE2  TYR  52           HE2      TYR  52 -10.728  11.765  11.269
 1296    HH   TYR  52           HH       TYR  52 -10.097  12.024  14.537
 1297    H    PHE  53           H        PHE  53  -4.114   7.727  10.480
 1298    HA   PHE  53           HA       PHE  53  -3.380   7.643   7.629
 1299    HB2  PHE  53           HB3      PHE  53  -1.603   6.838   9.952
 1300    HB3  PHE  53           HB2      PHE  53  -1.182   6.736   8.242
 1301    HD1  PHE  53           HD1      PHE  53  -1.137   8.899   6.911
 1302    HD2  PHE  53           HD2      PHE  53  -1.188   8.779  11.158
 1303    HE1  PHE  53           HE1      PHE  53  -0.296  11.206   6.976
 1304    HE2  PHE  53           HE2      PHE  53  -0.346  11.087  11.238
 1305    HZ   PHE  53           HZ       PHE  53   0.096  12.305   9.144
 1306    H    PHE  54           H        PHE  54  -3.415   5.612   6.683
 1307    HA   PHE  54           HA       PHE  54  -5.092   3.695   8.071
 1308    HB2  PHE  54           HB3      PHE  54  -5.509   4.415   5.695
 1309    HB3  PHE  54           HB2      PHE  54  -4.022   3.597   5.235
 1310    HD1  PHE  54           HD1      PHE  54  -7.232   2.911   7.010
 1311    HD2  PHE  54           HD2      PHE  54  -4.157   1.441   4.463
 1312    HE1  PHE  54           HE1      PHE  54  -8.495   0.825   6.696
 1313    HE2  PHE  54           HE2      PHE  54  -5.414  -0.648   4.146
 1314    HZ   PHE  54           HZ       PHE  54  -7.587  -0.959   5.260
 1315    H    GLU  55           H        GLU  55  -3.842   2.651   9.549
 1316    HA   GLU  55           HA       GLU  55  -1.346   1.385   8.646
 1317    HB2  GLU  55           HB3      GLU  55  -2.464   1.829  11.428
 1318    HB3  GLU  55           HB2      GLU  55  -0.962   0.984  11.083
 1319    HG2  GLU  55           HG3      GLU  55  -1.436   3.835  10.248
 1320    HG3  GLU  55           HG2      GLU  55  -0.779   3.400  11.826
 1321    H    THR  56           H        THR  56  -1.613  -0.609   7.894
 1322    HA   THR  56           HA       THR  56  -3.531  -2.380   9.257
 1323    HB   THR  56           HB       THR  56  -2.312  -2.700   6.502
 1324    HG1  THR  56           HG1      THR  56  -3.930  -1.486   5.905
 1325   HG21  THR  56          HG21      THR  56  -4.418  -4.321   7.944
 1326   HG22  THR  56          HG22      THR  56  -2.783  -4.852   7.542
 1327   HG23  THR  56          HG23      THR  56  -3.948  -4.531   6.257
 1328    H    LYS  57           H        LYS  57  -2.609  -3.669  10.693
 1329    HA   LYS  57           HA       LYS  57   0.255  -4.263  10.375
 1330    HB2  LYS  57           HB3      LYS  57  -1.422  -4.319  12.894
 1331    HB3  LYS  57           HB2      LYS  57   0.322  -4.530  12.799
 1332    HG2  LYS  57           HG3      LYS  57   0.495  -2.234  11.898
 1333    HG3  LYS  57           HG2      LYS  57  -1.232  -2.031  12.167
 1334    HD2  LYS  57           HD3      LYS  57  -0.148  -1.057  14.028
 1335    HD3  LYS  57           HD2      LYS  57  -0.778  -2.608  14.586
 1336    HE2  LYS  57           HE3      LYS  57   1.490  -2.231  15.395
 1337    HE3  LYS  57           HE2      LYS  57   1.419  -3.611  14.304
 1338    HZ1  LYS  57           HZ1      LYS  57   2.307  -0.880  13.542
 1339    HZ2  LYS  57           HZ2      LYS  57   2.296  -2.240  12.536
 1340    HZ3  LYS  57           HZ3      LYS  57   3.336  -2.181  13.867
 1341    H    CYS  58           H        CYS  58   1.038  -6.315  10.671
 1342    HA   CYS  58           HA       CYS  58  -0.803  -8.490  10.194
 1343    HB2  CYS  58           HB3      CYS  58   2.175  -8.644  10.739
 1344    HB3  CYS  58           HB2      CYS  58   1.174  -9.885   9.998
 1345    H    ARG  59           H        ARG  59  -2.043  -8.609  12.090
 1346    HA   ARG  59           HA       ARG  59  -0.776  -8.694  14.659
 1347    HB2  ARG  59           HB3      ARG  59  -3.016  -9.082  15.561
 1348    HB3  ARG  59           HB2      ARG  59  -3.008  -7.736  14.434
 1349    HG2  ARG  59           HG3      ARG  59  -3.973  -9.141  12.714
 1350    HG3  ARG  59           HG2      ARG  59  -3.927 -10.530  13.801
 1351    HD2  ARG  59           HD3      ARG  59  -5.494  -7.992  14.235
 1352    HD3  ARG  59           HD2      ARG  59  -6.161  -9.531  13.699
 1353    HE   ARG  59           HE       ARG  59  -4.758  -9.674  16.211
 1354   HH11  ARG  59          HH11      ARG  59  -7.829  -9.081  14.644
 1355   HH12  ARG  59          HH12      ARG  59  -8.768  -9.384  16.069
 1356   HH21  ARG  59          HH21      ARG  59  -5.989 -10.091  18.095
 1357   HH22  ARG  59          HH22      ARG  59  -7.717  -9.968  18.034
 1358    H    ALA  60           H        ALA  60  -1.544 -10.996  12.256
 1359    HA   ALA  60           HA       ALA  60  -0.440 -13.071  13.988
 1360    HB1  ALA  60           HB1      ALA  60  -2.092 -14.707  13.411
 1361    HB2  ALA  60           HB2      ALA  60  -2.894 -13.586  12.316
 1362    HB3  ALA  60           HB3      ALA  60  -2.926 -13.291  14.053
 1363    H    SER  61           H        SER  61   1.447 -12.773  12.758
 1364    HA   SER  61           HA       SER  61   1.428 -13.267   9.919
 1365    HB2  SER  61           HB3      SER  61   3.785 -13.187  11.820
 1366    HB3  SER  61           HB2      SER  61   3.835 -13.029  10.064
 1367    HG   SER  61           HG       SER  61   3.257 -11.161  11.981
 1368    H    ASN  62           H        ASN  62   1.779 -15.172   8.910
 1369    HA   ASN  62           HA       ASN  62   1.819 -17.434   8.601
 1370    HB2  ASN  62           HB3      ASN  62   3.628 -17.286  11.023
 1371    HB3  ASN  62           HB2      ASN  62   3.318 -18.775  10.140
 1372   HD21  ASN  62          HD21      ASN  62   3.311 -17.649   7.523
 1373   HD22  ASN  62          HD22      ASN  62   4.945 -17.203   7.160
 1374    HA   PRO  63           HA       PRO  63  -1.531 -17.724  11.901
 1375    HB2  PRO  63           HB3      PRO  63  -3.471 -18.481  10.091
 1376    HB3  PRO  63           HB2      PRO  63  -3.178 -16.812  10.604
 1377    HG2  PRO  63           HG3      PRO  63  -2.261 -18.235   8.137
 1378    HG3  PRO  63           HG2      PRO  63  -2.852 -16.574   8.317
 1379    HD2  PRO  63           HD3      PRO  63  -0.224 -17.115   8.073
 1380    HD3  PRO  63           HD2      PRO  63  -0.809 -15.799   9.121
 1381    H    VAL  64           H        VAL  64  -0.656 -19.785   9.187
 1382    HA   VAL  64           HA       VAL  64  -1.512 -22.149  10.684
 1383    HB   VAL  64           HB       VAL  64  -1.013 -23.401   8.586
 1384   HG11  VAL  64          HG11      VAL  64  -2.937 -22.574   7.319
 1385   HG12  VAL  64          HG12      VAL  64  -2.929 -21.094   8.276
 1386   HG13  VAL  64          HG13      VAL  64  -3.278 -22.641   9.048
 1387   HG21  VAL  64          HG21      VAL  64  -0.667 -22.156   6.508
 1388   HG22  VAL  64          HG22      VAL  64   0.663 -21.913   7.639
 1389   HG23  VAL  64          HG23      VAL  64  -0.557 -20.657   7.427
 1390    H    GLU  65           H        GLU  65  -0.012 -23.940  10.931
 1391    HA   GLU  65           HA       GLU  65   2.610 -22.973  11.653
 1392    HB2  GLU  65           HB3      GLU  65   1.321 -24.534  13.100
 1393    HB3  GLU  65           HB2      GLU  65   1.483 -25.770  11.861
 1394    HG2  GLU  65           HG3      GLU  65   3.928 -25.658  12.104
 1395    HG3  GLU  65           HG2      GLU  65   3.723 -24.477  13.397
 1396    H    SER  66           H        SER  66   3.000 -22.474   9.349
 1397    HA   SER  66           HA       SER  66   4.903 -24.248   8.282
 1398    HB2  SER  66           HB3      SER  66   3.685 -24.643   6.070
 1399    HB3  SER  66           HB2      SER  66   3.102 -25.589   7.442
 1400    HG   SER  66           HG       SER  66   1.265 -24.781   6.690
 1401    H    GLY  67           H        GLY  67   2.531 -22.115   6.739
 1402    HA2  GLY  67           HA3      GLY  67   4.432 -19.929   6.632
 1403    HA3  GLY  67           HA2      GLY  67   4.035 -20.651   5.074
 1404    H    CYS  68           H        CYS  68   1.946 -20.421   4.238
 1405    HA   CYS  68           HA       CYS  68   0.186 -18.585   5.697
 1406    HB2  CYS  68           HB3      CYS  68   1.114 -18.265   2.834
 1407    HB3  CYS  68           HB2      CYS  68  -0.234 -17.365   3.536
 1408    H    ARG  69           H        ARG  69  -2.002 -18.557   4.901
 1409    HA   ARG  69           HA       ARG  69  -3.046 -21.152   4.630
 1410    HB2  ARG  69           HB3      ARG  69  -4.358 -18.463   4.153
 1411    HB3  ARG  69           HB2      ARG  69  -5.226 -19.989   4.267
 1412    HG2  ARG  69           HG3      ARG  69  -4.537 -20.244   6.577
 1413    HG3  ARG  69           HG2      ARG  69  -3.559 -18.780   6.464
 1414    HD2  ARG  69           HD3      ARG  69  -5.551 -17.442   6.075
 1415    HD3  ARG  69           HD2      ARG  69  -6.558 -18.894   6.099
 1416    HE   ARG  69           HE       ARG  69  -5.510 -19.077   8.489
 1417   HH11  ARG  69          HH11      ARG  69  -6.575 -16.154   6.885
 1418   HH12  ARG  69          HH12      ARG  69  -7.080 -15.383   8.354
 1419   HH21  ARG  69          HH21      ARG  69  -6.170 -18.069  10.420
 1420   HH22  ARG  69          HH22      ARG  69  -6.857 -16.474  10.370
 1421    H    GLY  70           H        GLY  70  -2.877 -22.385   2.853
 1422    HA2  GLY  70           HA3      GLY  70  -3.819 -22.917   0.722
 1423    HA3  GLY  70           HA2      GLY  70  -3.799 -21.206   0.322
 1424    H    ILE  71           H        ILE  71  -0.970 -21.130   1.462
 1425    HA   ILE  71           HA       ILE  71   0.323 -21.510  -1.075
 1426    HB   ILE  71           HB       ILE  71   1.400 -20.641   1.609
 1427   HG12  ILE  71          HG13      ILE  71  -0.191 -19.076   0.530
 1428   HG13  ILE  71          HG12      ILE  71   1.432 -18.407   0.650
 1429   HG21  ILE  71          HG21      ILE  71   3.419 -19.938   0.426
 1430   HG22  ILE  71          HG22      ILE  71   2.792 -20.640  -1.064
 1431   HG23  ILE  71          HG23      ILE  71   3.172 -21.681   0.309
 1432   HD11  ILE  71          HD11      ILE  71   1.813 -18.986  -1.711
 1433   HD12  ILE  71          HD12      ILE  71   0.468 -17.868  -1.489
 1434   HD13  ILE  71          HD13      ILE  71   0.155 -19.571  -1.813
 1435    H    ASP  72           H        ASP  72   1.655 -23.116  -1.700
 1436    HA   ASP  72           HA       ASP  72   2.032 -25.470  -0.131
 1437    HB2  ASP  72           HB3      ASP  72   2.047 -25.494  -2.620
 1438    HB3  ASP  72           HB2      ASP  72   3.542 -24.565  -2.605
 1439    H    SER  73           H        SER  73   3.069 -25.067   1.763
 1440    HA   SER  73           HA       SER  73   5.319 -23.261   1.863
 1441    HB2  SER  73           HB3      SER  73   3.538 -23.385   3.646
 1442    HB3  SER  73           HB2      SER  73   4.191 -24.962   4.096
 1443    HG   SER  73           HG       SER  73   6.280 -23.650   4.197
 1444    H    LYS  74           H        LYS  74   5.258 -26.131   0.621
 1445    HA   LYS  74           HA       LYS  74   7.558 -27.243   2.032
 1446    HB2  LYS  74           HB3      LYS  74   5.714 -28.762   1.421
 1447    HB3  LYS  74           HB2      LYS  74   5.940 -28.353  -0.270
 1448    HG2  LYS  74           HG3      LYS  74   8.104 -29.392  -0.292
 1449    HG3  LYS  74           HG2      LYS  74   8.032 -29.668   1.450
 1450    HD2  LYS  74           HD3      LYS  74   7.510 -31.701   0.174
 1451    HD3  LYS  74           HD2      LYS  74   6.144 -31.167   1.151
 1452    HE2  LYS  74           HE3      LYS  74   5.086 -30.195  -0.778
 1453    HE3  LYS  74           HE2      LYS  74   6.484 -30.572  -1.781
 1454    HZ1  LYS  74           HZ1      LYS  74   4.738 -32.566  -0.449
 1455    HZ2  LYS  74           HZ2      LYS  74   6.054 -32.916  -1.449
 1456    HZ3  LYS  74           HZ3      LYS  74   4.683 -32.161  -2.088
 1457    H    HIS  75           H        HIS  75   6.571 -26.034  -1.139
 1458    HA   HIS  75           HA       HIS  75   9.359 -26.060  -2.046
 1459    HB2  HIS  75           HB3      HIS  75   6.794 -25.363  -3.501
 1460    HB3  HIS  75           HB2      HIS  75   8.396 -25.318  -4.230
 1461    HD1  HIS  75           HD1      HIS  75   9.390 -27.517  -5.013
 1462    HD2  HIS  75           HD2      HIS  75   5.810 -27.982  -2.953
 1463    HE1  HIS  75           HE1      HIS  75   8.709 -29.911  -5.374
 1464    HE2  HIS  75           HE2      HIS  75   6.497 -30.148  -4.188
 1465    H    TRP  76           H        TRP  76   7.069 -23.976  -0.648
 1466    HA   TRP  76           HA       TRP  76   8.695 -21.637  -1.379
 1467    HB2  TRP  76           HB3      TRP  76   5.698 -21.774  -0.958
 1468    HB3  TRP  76           HB2      TRP  76   6.609 -20.277  -1.150
 1469    HD1  TRP  76           HD1      TRP  76   4.937 -22.997  -3.099
 1470    HE1  TRP  76           HE1      TRP  76   5.228 -22.569  -5.620
 1471    HE3  TRP  76           HE3      TRP  76   8.446 -19.282  -2.890
 1472    HZ2  TRP  76           HZ2      TRP  76   6.744 -20.880  -7.294
 1473    HZ3  TRP  76           HZ3      TRP  76   9.261 -18.314  -4.997
 1474    HH2  TRP  76           HH2      TRP  76   8.429 -19.099  -7.154
 1475    H    ASN  77           H        ASN  77   9.245 -20.253   0.209
 1476    HA   ASN  77           HA       ASN  77   8.388 -20.867   2.947
 1477    HB2  ASN  77           HB3      ASN  77  10.806 -20.655   2.665
 1478    HB3  ASN  77           HB2      ASN  77  10.608 -19.088   1.895
 1479   HD21  ASN  77          HD21      ASN  77  11.877 -18.016   3.395
 1480   HD22  ASN  77          HD22      ASN  77  11.356 -17.733   5.020
 1481    H    SER  78           H        SER  78   7.134 -19.417   4.072
 1482    HA   SER  78           HA       SER  78   6.276 -17.041   2.570
 1483    HB2  SER  78           HB3      SER  78   4.389 -18.815   4.118
 1484    HB3  SER  78           HB2      SER  78   3.982 -17.522   2.989
 1485    HG   SER  78           HG       SER  78   5.382 -19.061   1.539
 1486    H    TYR  79           H        TYR  79   6.111 -15.225   3.725
 1487    HA   TYR  79           HA       TYR  79   5.537 -15.363   6.545
 1488    HB2  TYR  79           HB3      TYR  79   7.443 -13.790   7.110
 1489    HB3  TYR  79           HB2      TYR  79   7.895 -15.456   6.769
 1490    HD1  TYR  79           HD1      TYR  79   8.288 -11.987   5.809
 1491    HD2  TYR  79           HD2      TYR  79   8.987 -16.006   4.591
 1492    HE1  TYR  79           HE1      TYR  79   9.973 -11.202   4.194
 1493    HE2  TYR  79           HE2      TYR  79  10.666 -15.231   2.972
 1494    HH   TYR  79           HH       TYR  79  11.929 -12.080   3.005
 1495    H    CYS  80           H        CYS  80   4.751 -13.444   7.417
 1496    HA   CYS  80           HA       CYS  80   3.384 -11.892   5.379
 1497    HB2  CYS  80           HB3      CYS  80   3.001 -11.817   8.381
 1498    HB3  CYS  80           HB2      CYS  80   1.893 -11.205   7.151
 1499    H    THR  81           H        THR  81   3.932  -9.931   4.813
 1500    HA   THR  81           HA       THR  81   5.566  -8.300   6.628
 1501    HB   THR  81           HB       THR  81   6.043  -8.602   3.646
 1502    HG1  THR  81           HG1      THR  81   6.731 -10.453   4.788
 1503   HG21  THR  81          HG21      THR  81   8.075  -7.305   4.057
 1504   HG22  THR  81          HG22      THR  81   7.645  -7.146   5.759
 1505   HG23  THR  81          HG23      THR  81   6.644  -6.385   4.521
 1506    H    THR  82           H        THR  82   4.918  -6.192   6.730
 1507    HA   THR  82           HA       THR  82   2.465  -5.495   5.426
 1508    HB   THR  82           HB       THR  82   2.876  -3.263   6.604
 1509    HG1  THR  82           HG1      THR  82   4.819  -3.051   7.384
 1510   HG21  THR  82          HG21      THR  82   1.357  -4.943   7.493
 1511   HG22  THR  82          HG22      THR  82   2.259  -4.179   8.803
 1512   HG23  THR  82          HG23      THR  82   2.709  -5.790   8.245
 1513    H    THR  83           H        THR  83   2.140  -4.126   3.751
 1514    HA   THR  83           HA       THR  83   4.473  -3.281   2.253
 1515    HB   THR  83           HB       THR  83   2.715  -2.435   0.621
 1516    HG1  THR  83           HG1      THR  83   0.746  -2.413   1.360
 1517   HG21  THR  83          HG21      THR  83   3.844  -4.581   0.311
 1518   HG22  THR  83          HG22      THR  83   2.159  -4.676  -0.197
 1519   HG23  THR  83          HG23      THR  83   2.652  -5.365   1.349
 1520    H    HIS  84           H        HIS  84   5.340  -1.333   2.433
 1521    HA   HIS  84           HA       HIS  84   3.791   0.702   3.862
 1522    HB2  HIS  84           HB3      HIS  84   6.016   1.778   4.330
 1523    HB3  HIS  84           HB2      HIS  84   5.791   0.204   5.075
 1524    HD1  HIS  84           HD1      HIS  84   7.385  -1.655   4.408
 1525    HD2  HIS  84           HD2      HIS  84   7.955   1.845   2.235
 1526    HE1  HIS  84           HE1      HIS  84   9.554  -1.969   3.178
 1527    HE2  HIS  84           HE2      HIS  84   9.977   0.240   2.049
 1528    H    THR  85           H        THR  85   3.061   2.361   2.809
 1529    HA   THR  85           HA       THR  85   4.260   3.010   0.192
 1530    HB   THR  85           HB       THR  85   1.856   2.170   0.196
 1531    HG1  THR  85           HG1      THR  85   1.550   3.382  -1.529
 1532   HG21  THR  85          HG21      THR  85   0.109   3.769   0.850
 1533   HG22  THR  85          HG22      THR  85   1.344   4.850   1.495
 1534   HG23  THR  85          HG23      THR  85   1.082   3.268   2.231
 1535    H    PHE  86           H        PHE  86   4.069   5.386  -0.364
 1536    HA   PHE  86           HA       PHE  86   4.782   6.873   2.063
 1537    HB2  PHE  86           HB3      PHE  86   5.565   7.371  -0.820
 1538    HB3  PHE  86           HB2      PHE  86   5.994   8.427   0.527
 1539    HD1  PHE  86           HD1      PHE  86   7.466   7.554   2.340
 1540    HD2  PHE  86           HD2      PHE  86   6.797   5.413  -1.276
 1541    HE1  PHE  86           HE1      PHE  86   9.463   6.191   2.785
 1542    HE2  PHE  86           HE2      PHE  86   8.794   4.045  -0.841
 1543    HZ   PHE  86           HZ       PHE  86  10.129   4.431   1.192
 1544    H    VAL  87           H        VAL  87   3.398   8.274   2.792
 1545    HA   VAL  87           HA       VAL  87   1.382   9.365   0.953
 1546    HB   VAL  87           HB       VAL  87  -0.043   9.718   2.942
 1547   HG11  VAL  87          HG11      VAL  87  -0.580   7.357   3.359
 1548   HG12  VAL  87          HG12      VAL  87   0.931   6.891   2.578
 1549   HG13  VAL  87          HG13      VAL  87  -0.330   7.697   1.648
 1550   HG21  VAL  87          HG21      VAL  87   0.540   8.681   5.074
 1551   HG22  VAL  87          HG22      VAL  87   1.703   9.931   4.632
 1552   HG23  VAL  87          HG23      VAL  87   2.116   8.228   4.428
 1553    H    LYS  88           H        LYS  88   0.718  11.532   1.283
 1554    HA   LYS  88           HA       LYS  88   2.977  13.253   1.929
 1555    HB2  LYS  88           HB3      LYS  88   0.340  14.072   0.697
 1556    HB3  LYS  88           HB2      LYS  88   1.896  14.889   0.578
 1557    HG2  LYS  88           HG3      LYS  88   2.766  13.198  -0.850
 1558    HG3  LYS  88           HG2      LYS  88   1.374  12.159  -0.570
 1559    HD2  LYS  88           HD3      LYS  88  -0.043  13.933  -1.629
 1560    HD3  LYS  88           HD2      LYS  88   1.447  14.770  -2.067
 1561    HE2  LYS  88           HE3      LYS  88   0.650  11.983  -2.901
 1562    HE3  LYS  88           HE2      LYS  88   0.639  13.419  -3.922
 1563    HZ1  LYS  88           HZ1      LYS  88   2.611  12.142  -4.350
 1564    HZ2  LYS  88           HZ2      LYS  88   3.022  12.126  -2.711
 1565    HZ3  LYS  88           HZ3      LYS  88   3.061  13.582  -3.574
 1566    H    ALA  89           H        ALA  89   3.063  13.840   4.016
 1567    HA   ALA  89           HA       ALA  89   0.531  14.610   5.323
 1568    HB1  ALA  89           HB1      ALA  89   1.232  12.351   6.037
 1569    HB2  ALA  89           HB2      ALA  89   1.201  13.518   7.361
 1570    HB3  ALA  89           HB3      ALA  89   2.740  13.042   6.642
 1571    H    LEU  90           H        LEU  90   0.600  16.317   6.711
 1572    HA   LEU  90           HA       LEU  90   2.863  18.066   6.565
 1573    HB2  LEU  90           HB3      LEU  90   0.489  18.862   6.656
 1574    HB3  LEU  90           HB2      LEU  90   0.398  18.273   8.311
 1575    HG   LEU  90           HG       LEU  90   2.308  19.860   8.852
 1576   HD11  LEU  90          HD11      LEU  90   3.127  20.255   6.612
 1577   HD12  LEU  90          HD12      LEU  90   2.580  21.771   7.329
 1578   HD13  LEU  90          HD13      LEU  90   1.575  20.946   6.139
 1579   HD21  LEU  90          HD21      LEU  90  -0.323  21.003   7.921
 1580   HD22  LEU  90          HD22      LEU  90   0.824  21.813   8.987
 1581   HD23  LEU  90          HD23      LEU  90   0.025  20.332   9.515
 1582    H    THR  91           H        THR  91   4.617  17.459   7.635
 1583    HA   THR  91           HA       THR  91   4.328  16.577  10.438
 1584    HB   THR  91           HB       THR  91   6.365  15.240  10.147
 1585    HG1  THR  91           HG1      THR  91   6.599  16.737   7.932
 1586   HG21  THR  91          HG21      THR  91   5.499  13.505   8.654
 1587   HG22  THR  91          HG22      THR  91   4.343  14.650   7.976
 1588   HG23  THR  91          HG23      THR  91   4.208  14.156   9.662
 1589    H    THR  92           H        THR  92   6.082  17.279  11.868
 1590    HA   THR  92           HA       THR  92   7.188  19.803  10.898
 1591    HB   THR  92           HB       THR  92   5.934  19.961  12.997
 1592    HG1  THR  92           HG1      THR  92   7.398  21.266  13.957
 1593   HG21  THR  92          HG21      THR  92   6.368  17.734  13.909
 1594   HG22  THR  92          HG22      THR  92   6.804  18.992  15.066
 1595   HG23  THR  92          HG23      THR  92   8.064  18.160  14.152
 1596    H    ASP  93           H        ASP  93   9.158  19.948  10.284
 1597    HA   ASP  93           HA       ASP  93  10.935  17.747  10.238
 1598    HB2  ASP  93           HB3      ASP  93  10.878  19.624   8.569
 1599    HB3  ASP  93           HB2      ASP  93  11.591  20.672   9.790
 1600    H    GLU  94           H        GLU  94  10.400  20.331  12.427
 1601    HA   GLU  94           HA       GLU  94  11.827  19.206  14.548
 1602    HB2  GLU  94           HB3      GLU  94  13.699  20.142  12.977
 1603    HB3  GLU  94           HB2      GLU  94  13.186  21.711  13.573
 1604    HG2  GLU  94           HG3      GLU  94  14.123  19.441  15.307
 1605    HG3  GLU  94           HG2      GLU  94  15.134  20.768  14.758
 1606    H    LYS  95           H        LYS  95  11.442  22.544  13.362
 1607    HA   LYS  95           HA       LYS  95   9.151  22.860  15.159
 1608    HB2  LYS  95           HB3      LYS  95   9.901  25.124  15.786
 1609    HB3  LYS  95           HB2      LYS  95  11.026  23.893  16.334
 1610    HG2  LYS  95           HG3      LYS  95  12.529  24.418  14.512
 1611    HG3  LYS  95           HG2      LYS  95  11.386  25.604  13.883
 1612    HD2  LYS  95           HD3      LYS  95  11.614  26.920  15.913
 1613    HD3  LYS  95           HD2      LYS  95  12.701  25.707  16.591
 1614    HE2  LYS  95           HE3      LYS  95  14.298  26.134  14.795
 1615    HE3  LYS  95           HE2      LYS  95  13.215  27.346  14.116
 1616    HZ1  LYS  95           HZ1      LYS  95  13.472  28.679  16.078
 1617    HZ2  LYS  95           HZ2      LYS  95  15.008  28.298  15.480
 1618    HZ3  LYS  95           HZ3      LYS  95  14.401  27.486  16.831
 1619    H    GLN  96           H        GLN  96   9.344  22.300  12.384
 1620    HA   GLN  96           HA       GLN  96   7.973  24.613  11.263
 1621    HB2  GLN  96           HB3      GLN  96  10.336  24.898  10.622
 1622    HB3  GLN  96           HB2      GLN  96  10.352  23.278   9.945
 1623    HG2  GLN  96           HG3      GLN  96  10.160  24.927   8.197
 1624    HG3  GLN  96           HG2      GLN  96   8.692  23.955   8.285
 1625   HE21  GLN  96          HE21      GLN  96   7.428  25.492   7.296
 1626   HE22  GLN  96          HE22      GLN  96   6.983  26.976   8.066
 1627    H    ALA  97           H        ALA  97   6.123  23.859  10.494
 1628    HA   ALA  97           HA       ALA  97   5.769  21.053   9.947
 1629    HB1  ALA  97           HB1      ALA  97   3.841  23.351   9.653
 1630    HB2  ALA  97           HB2      ALA  97   3.996  22.290  11.055
 1631    HB3  ALA  97           HB3      ALA  97   3.431  21.641   9.516
 1632    H    ALA  98           H        ALA  98   5.976  20.090   8.060
 1633    HA   ALA  98           HA       ALA  98   5.578  21.577   5.582
 1634    HB1  ALA  98           HB1      ALA  98   8.068  19.972   6.164
 1635    HB2  ALA  98           HB2      ALA  98   7.982  21.731   6.042
 1636    HB3  ALA  98           HB3      ALA  98   7.666  20.731   4.623
 1637    H    TRP  99           H        TRP  99   5.039  20.249   3.808
 1638    HA   TRP  99           HA       TRP  99   3.785  17.765   4.562
 1639    HB2  TRP  99           HB3      TRP  99   3.974  19.222   1.916
 1640    HB3  TRP  99           HB2      TRP  99   3.112  17.704   2.130
 1641    HD1  TRP  99           HD1      TRP  99   2.882  21.422   2.967
 1642    HE1  TRP  99           HE1      TRP  99   0.494  21.947   3.774
 1643    HE3  TRP  99           HE3      TRP  99   1.060  16.657   3.256
 1644    HZ2  TRP  99           HZ2      TRP  99  -1.854  20.524   4.439
 1645    HZ3  TRP  99           HZ3      TRP  99  -1.268  16.323   3.989
 1646    HH2  TRP  99           HH2      TRP  99  -2.692  18.218   4.567
 1647    H    ARG 100           H        ARG 100   5.158  16.157   4.950
 1648    HA   ARG 100           HA       ARG 100   7.366  15.672   3.072
 1649    HB2  ARG 100           HB3      ARG 100   6.826  14.543   5.831
 1650    HB3  ARG 100           HB2      ARG 100   8.195  14.098   4.825
 1651    HG2  ARG 100           HG3      ARG 100   7.649  16.862   5.887
 1652    HG3  ARG 100           HG2      ARG 100   8.772  15.704   6.587
 1653    HD2  ARG 100           HD3      ARG 100   9.913  15.681   4.305
 1654    HD3  ARG 100           HD2      ARG 100   8.952  17.114   3.941
 1655    HE   ARG 100           HE       ARG 100  10.727  17.035   6.286
 1656   HH11  ARG 100          HH11      ARG 100   9.716  18.535   3.283
 1657   HH12  ARG 100          HH12      ARG 100  10.752  19.910   3.480
 1658   HH21  ARG 100          HH21      ARG 100  12.105  18.842   6.544
 1659   HH22  ARG 100          HH22      ARG 100  12.111  20.084   5.326
 1660    H    PHE 101           H        PHE 101   7.838  13.300   2.726
 1661    HA   PHE 101           HA       PHE 101   5.312  11.908   2.126
 1662    HB2  PHE 101           HB3      PHE 101   8.050  11.432   0.904
 1663    HB3  PHE 101           HB2      PHE 101   6.536  10.695   0.397
 1664    HD1  PHE 101           HD1      PHE 101   4.736  12.210  -0.552
 1665    HD2  PHE 101           HD2      PHE 101   8.768  13.450  -0.001
 1666    HE1  PHE 101           HE1      PHE 101   4.393  14.038  -2.161
 1667    HE2  PHE 101           HE2      PHE 101   8.430  15.282  -1.606
 1668    HZ   PHE 101           HZ       PHE 101   6.238  15.576  -2.689
 1669    H    ILE 102           H        ILE 102   4.899  10.586   3.816
 1670    HA   ILE 102           HA       ILE 102   7.215   9.230   5.039
 1671    HB   ILE 102           HB       ILE 102   5.850   9.055   7.108
 1672   HG12  ILE 102          HG13      ILE 102   3.983  11.001   5.747
 1673   HG13  ILE 102          HG12      ILE 102   3.632   9.293   5.968
 1674   HG21  ILE 102          HG21      ILE 102   6.316  11.851   6.083
 1675   HG22  ILE 102          HG22      ILE 102   7.497  10.815   6.888
 1676   HG23  ILE 102          HG23      ILE 102   6.093  11.405   7.776
 1677   HD11  ILE 102          HD11      ILE 102   3.750   9.600   8.395
 1678   HD12  ILE 102          HD12      ILE 102   2.519  10.620   7.650
 1679   HD13  ILE 102          HD13      ILE 102   4.061  11.319   8.152
 1680    H    ARG 103           H        ARG 103   7.112   7.086   5.501
 1681    HA   ARG 103           HA       ARG 103   5.249   5.636   3.842
 1682    HB2  ARG 103           HB3      ARG 103   6.607   3.653   4.389
 1683    HB3  ARG 103           HB2      ARG 103   7.584   4.976   3.782
 1684    HG2  ARG 103           HG3      ARG 103   8.888   4.253   5.498
 1685    HG3  ARG 103           HG2      ARG 103   7.933   5.472   6.335
 1686    HD2  ARG 103           HD3      ARG 103   6.408   3.701   7.125
 1687    HD3  ARG 103           HD2      ARG 103   7.421   2.496   6.326
 1688    HE   ARG 103           HE       ARG 103   9.051   3.992   8.030
 1689   HH11  ARG 103          HH11      ARG 103   6.381   1.727   8.263
 1690   HH12  ARG 103          HH12      ARG 103   6.864   1.133   9.817
 1691   HH21  ARG 103          HH21      ARG 103   9.676   3.213  10.065
 1692   HH22  ARG 103          HH22      ARG 103   8.743   1.973  10.841
 1693    H    ILE 104           H        ILE 104   3.518   4.601   4.446
 1694    HA   ILE 104           HA       ILE 104   3.182   3.930   7.293
 1695    HB   ILE 104           HB       ILE 104   0.764   4.147   7.043
 1696   HG12  ILE 104          HG13      ILE 104   1.288   5.227   4.268
 1697   HG13  ILE 104          HG12      ILE 104   0.707   3.599   4.596
 1698   HG21  ILE 104          HG21      ILE 104   1.955   6.104   7.800
 1699   HG22  ILE 104          HG22      ILE 104   0.610   6.592   6.770
 1700   HG23  ILE 104          HG23      ILE 104   2.255   6.603   6.135
 1701   HD11  ILE 104          HD11      ILE 104  -0.708   6.163   5.278
 1702   HD12  ILE 104          HD12      ILE 104  -1.292   4.539   5.646
 1703   HD13  ILE 104          HD13      ILE 104  -1.116   5.054   3.968
 1704    H    ASP 105           H        ASP 105   2.326   1.901   7.732
 1705    HA   ASP 105           HA       ASP 105   2.667  -0.037   5.593
 1706    HB2  ASP 105           HB3      ASP 105   2.076  -0.353   8.544
 1707    HB3  ASP 105           HB2      ASP 105   2.253  -1.708   7.432
 1708    H    THR 106           H        THR 106   0.991  -0.070   4.235
 1709    HA   THR 106           HA       THR 106  -1.634   0.661   5.277
 1710    HB   THR 106           HB       THR 106  -0.830   1.949   3.376
 1711    HG1  THR 106           HG1      THR 106  -3.132   0.442   3.294
 1712   HG21  THR 106          HG21      THR 106   0.609   0.289   2.325
 1713   HG22  THR 106          HG22      THR 106  -0.554   0.922   1.163
 1714   HG23  THR 106          HG23      THR 106  -0.800  -0.672   1.875
 1715    H    ALA 107           H        ALA 107   0.011  -2.172   4.386
 1716    HA   ALA 107           HA       ALA 107  -2.403  -3.713   4.667
 1717    HB1  ALA 107           HB1      ALA 107  -2.512  -3.146   2.289
 1718    HB2  ALA 107           HB2      ALA 107  -2.253  -4.874   2.529
 1719    HB3  ALA 107           HB3      ALA 107  -0.907  -3.839   2.052
 1720    H    CYS 108           H        CYS 108  -1.936  -6.071   4.621
 1721    HA   CYS 108           HA       CYS 108   0.868  -6.656   5.299
 1722    HB2  CYS 108           HB3      CYS 108  -0.462  -6.703   7.347
 1723    HB3  CYS 108           HB2      CYS 108  -1.647  -7.764   6.583
 1724    H    VAL 109           H        VAL 109   1.732  -8.007   3.858
 1725    HA   VAL 109           HA       VAL 109  -0.116  -9.768   2.377
 1726    HB   VAL 109           HB       VAL 109   1.283  -9.539   0.410
 1727   HG11  VAL 109          HG11      VAL 109  -0.483  -7.906   0.670
 1728   HG12  VAL 109          HG12      VAL 109   0.918  -7.160  -0.100
 1729   HG13  VAL 109          HG13      VAL 109   0.587  -6.861   1.607
 1730   HG21  VAL 109          HG21      VAL 109   3.456  -9.288   1.492
 1731   HG22  VAL 109          HG22      VAL 109   2.997  -7.682   2.064
 1732   HG23  VAL 109          HG23      VAL 109   3.179  -7.985   0.335
 1733    H    CYS 110           H        CYS 110   0.667 -11.818   1.755
 1734    HA   CYS 110           HA       CYS 110   2.908 -12.795   3.356
 1735    HB2  CYS 110           HB3      CYS 110   0.877 -14.162   3.414
 1736    HB3  CYS 110           HB2      CYS 110   0.898 -14.299   1.661
 1737    H    VAL 111           H        VAL 111   4.858 -12.720   2.465
 1738    HA   VAL 111           HA       VAL 111   5.022 -12.637  -0.460
 1739    HB   VAL 111           HB       VAL 111   7.348 -11.902  -0.159
 1740   HG11  VAL 111          HG11      VAL 111   5.634 -10.202  -0.277
 1741   HG12  VAL 111          HG12      VAL 111   6.885  -9.709   0.866
 1742   HG13  VAL 111          HG13      VAL 111   5.346 -10.333   1.458
 1743   HG21  VAL 111          HG21      VAL 111   6.762 -11.988   2.794
 1744   HG22  VAL 111          HG22      VAL 111   8.236 -11.388   2.034
 1745   HG23  VAL 111          HG23      VAL 111   7.820 -13.099   1.924
 1746    H    LEU 112           H        LEU 112   6.232 -14.106  -1.632
 1747    HA   LEU 112           HA       LEU 112   6.747 -16.602  -0.188
 1748    HB2  LEU 112           HB3      LEU 112   6.305 -16.108  -3.138
 1749    HB3  LEU 112           HB2      LEU 112   6.662 -17.672  -2.432
 1750    HG   LEU 112           HG       LEU 112   4.166 -16.022  -2.018
 1751   HD11  LEU 112          HD11      LEU 112   4.294 -17.252  -4.135
 1752   HD12  LEU 112          HD12      LEU 112   3.056 -17.912  -3.066
 1753   HD13  LEU 112          HD13      LEU 112   4.599 -18.744  -3.245
 1754   HD21  LEU 112          HD21      LEU 112   3.381 -17.919  -0.647
 1755   HD22  LEU 112          HD22      LEU 112   4.728 -17.051   0.086
 1756   HD23  LEU 112          HD23      LEU 112   5.005 -18.603  -0.707
 1757    H    SER 113           H        SER 113   8.675 -17.542  -0.177
 1758    HA   SER 113           HA       SER 113  10.774 -16.411  -1.895
 1759    HB2  SER 113           HB3      SER 113  10.998 -15.857   0.585
 1760    HB3  SER 113           HB2      SER 113  11.248 -17.582   0.853
 1761    HG   SER 113           HG       SER 113  12.838 -15.780  -0.645
 1762    H    ARG 114           H        ARG 114  12.196 -17.918  -2.797
 1763    HA   ARG 114           HA       ARG 114  10.959 -20.464  -3.282
 1764    HB2  ARG 114           HB3      ARG 114  12.129 -19.004  -5.005
 1765    HB3  ARG 114           HB2      ARG 114  13.646 -19.537  -4.296
 1766    HG2  ARG 114           HG3      ARG 114  13.066 -20.810  -6.301
 1767    HG3  ARG 114           HG2      ARG 114  13.144 -21.838  -4.868
 1768    HD2  ARG 114           HD3      ARG 114  10.737 -21.839  -4.688
 1769    HD3  ARG 114           HD2      ARG 114  10.602 -20.695  -6.022
 1770    HE   ARG 114           HE       ARG 114  11.869 -22.702  -7.212
 1771   HH11  ARG 114          HH11      ARG 114   9.130 -22.771  -5.037
 1772   HH12  ARG 114          HH12      ARG 114   8.409 -24.156  -5.787
 1773   HH21  ARG 114          HH21      ARG 114  10.937 -24.537  -8.189
 1774   HH22  ARG 114          HH22      ARG 114   9.450 -25.181  -7.565
 1775    H    LYS 115           H        LYS 115  12.538 -19.577  -0.705
 1776    HA   LYS 115           HA       LYS 115  13.496 -20.688   1.024
 1777    HB2  LYS 115           HB3      LYS 115  13.452 -23.115  -0.796
 1778    HB3  LYS 115           HB2      LYS 115  13.871 -23.141   0.910
 1779    HG2  LYS 115           HG3      LYS 115  11.619 -22.442   1.500
 1780    HG3  LYS 115           HG2      LYS 115  11.200 -22.316  -0.213
 1781    HD2  LYS 115           HD3      LYS 115  10.359 -24.399   0.682
 1782    HD3  LYS 115           HD2      LYS 115  11.641 -24.719  -0.484
 1783    HE2  LYS 115           HE3      LYS 115  13.227 -25.054   1.320
 1784    HE3  LYS 115           HE2      LYS 115  11.982 -24.679   2.510
 1785    HZ1  LYS 115           HZ1      LYS 115  12.214 -27.037   2.341
 1786    HZ2  LYS 115           HZ2      LYS 115  12.036 -27.001   0.663
 1787    HZ3  LYS 115           HZ3      LYS 115  10.727 -26.613   1.659
 1788    H    ALA 116           H        ALA 116  14.993 -22.007  -1.937
 1789    HA   ALA 116           HA       ALA 116  17.635 -21.429  -0.861
 1790    HB1  ALA 116           HB1      ALA 116  16.839 -22.615  -3.523
 1791    HB2  ALA 116           HB2      ALA 116  17.262 -23.527  -2.075
 1792    HB3  ALA 116           HB3      ALA 116  18.476 -22.527  -2.872
 1793    H    THR 117           H        THR 117  16.498 -19.091  -0.944
 1794    HA   THR 117           HA       THR 117  16.834 -17.834  -3.547
 1795    HB   THR 117           HB       THR 117  16.009 -15.786  -2.163
 1796    HG1  THR 117           HG1      THR 117  14.539 -16.966  -0.448
 1797   HG21  THR 117          HG21      THR 117  14.230 -18.161  -2.716
 1798   HG22  THR 117          HG22      THR 117  14.676 -16.903  -3.868
 1799   HG23  THR 117          HG23      THR 117  13.678 -16.506  -2.470
 1800    H    ARG 118           H        ARG 118  18.786 -18.483  -0.964
 1801    HA   ARG 118           HA       ARG 118  20.461 -16.141  -1.566
 1802    HB2  ARG 118           HB3      ARG 118  20.416 -17.666   1.050
 1803    HB3  ARG 118           HB2      ARG 118  21.387 -16.252   0.689
 1804    HG2  ARG 118           HG3      ARG 118  18.410 -16.406   1.057
 1805    HG3  ARG 118           HG2      ARG 118  19.586 -15.537   2.039
 1806    HD2  ARG 118           HD3      ARG 118  18.800 -14.900  -0.807
 1807    HD3  ARG 118           HD2      ARG 118  18.343 -13.994   0.630
 1808    HE   ARG 118           HE       ARG 118  20.779 -13.508   0.892
 1809   HH11  ARG 118          HH11      ARG 118  19.513 -14.396  -2.267
 1810   HH12  ARG 118          HH12      ARG 118  20.703 -13.473  -3.132
 1811   HH21  ARG 118          HH21      ARG 118  22.329 -12.295  -0.260
 1812   HH22  ARG 118          HH22      ARG 118  22.303 -12.286  -1.995
  Start of MODEL   10
    1    H1   SER   1           H1       SER   1  27.164  -0.356   4.147
    2    H2   SER   1           H2       SER   1  27.233   0.996   5.162
    3    H3   SER   1           H3       SER   1  26.337   1.058   3.734
    4    HA   SER   1           HA       SER   1  25.759  -0.717   6.019
    5    HB2  SER   1           HB3      SER   1  24.314   1.792   5.133
    6    HB3  SER   1           HB2      SER   1  23.899   0.774   6.511
    7    HG   SER   1           HG       SER   1  25.506   1.601   7.635
    8    H    SER   2           H        SER   2  25.429  -2.497   4.682
    9    HA   SER   2           HA       SER   2  22.892  -2.418   3.245
   10    HB2  SER   2           HB3      SER   2  23.953  -3.840   1.411
   11    HB3  SER   2           HB2      SER   2  24.405  -2.134   1.423
   12    HG   SER   2           HG       SER   2  26.322  -2.758   2.553
   13    H    THR   3           H        THR   3  21.696  -4.228   3.546
   14    HA   THR   3           HA       THR   3  22.876  -6.714   4.359
   15    HB   THR   3           HB       THR   3  22.852  -5.466   6.510
   16    HG1  THR   3           HG1      THR   3  21.635  -7.115   7.658
   17   HG21  THR   3          HG21      THR   3  19.863  -5.426   6.098
   18   HG22  THR   3          HG22      THR   3  20.933  -4.026   6.153
   19   HG23  THR   3          HG23      THR   3  20.687  -5.006   7.598
   20    H    HIS   4           H        HIS   4  21.228  -8.411   4.553
   21    HA   HIS   4           HA       HIS   4  18.616  -7.697   3.471
   22    HB2  HIS   4           HB3      HIS   4  18.797  -9.658   1.843
   23    HB3  HIS   4           HB2      HIS   4  19.681  -8.196   1.427
   24    HD1  HIS   4           HD1      HIS   4  22.233  -8.335   1.350
   25    HD2  HIS   4           HD2      HIS   4  20.412 -11.894   2.481
   26    HE1  HIS   4           HE1      HIS   4  24.033 -10.079   1.234
   27    HE2  HIS   4           HE2      HIS   4  22.949 -12.192   2.063
   28    HA   PRO   5           HA       PRO   5  18.226 -10.841   6.836
   29    HB2  PRO   5           HB3      PRO   5  15.975  -9.149   7.630
   30    HB3  PRO   5           HB2      PRO   5  17.374  -9.652   8.580
   31    HG2  PRO   5           HG3      PRO   5  17.018  -7.101   7.751
   32    HG3  PRO   5           HG2      PRO   5  18.626  -7.826   7.943
   33    HD2  PRO   5           HD3      PRO   5  17.036  -7.369   5.441
   34    HD3  PRO   5           HD2      PRO   5  18.777  -7.163   5.729
   35    H    VAL   6           H        VAL   6  17.564 -11.700   4.551
   36    HA   VAL   6           HA       VAL   6  16.149 -13.039   3.408
   37    HB   VAL   6           HB       VAL   6  14.099 -12.530   5.563
   38   HG11  VAL   6          HG11      VAL   6  13.144 -14.661   4.833
   39   HG12  VAL   6          HG12      VAL   6  14.356 -14.762   3.556
   40   HG13  VAL   6          HG13      VAL   6  13.153 -13.472   3.530
   41   HG21  VAL   6          HG21      VAL   6  16.165 -14.716   5.364
   42   HG22  VAL   6          HG22      VAL   6  14.872 -14.633   6.560
   43   HG23  VAL   6          HG23      VAL   6  16.140 -13.407   6.547
   44    H    PHE   7           H        PHE   7  15.519  -9.814   4.092
   45    HA   PHE   7           HA       PHE   7  13.112  -9.503   2.572
   46    HB2  PHE   7           HB3      PHE   7  15.079  -7.457   3.610
   47    HB3  PHE   7           HB2      PHE   7  13.565  -7.054   2.811
   48    HD1  PHE   7           HD1      PHE   7  11.486  -8.461   3.894
   49    HD2  PHE   7           HD2      PHE   7  15.058  -7.279   5.886
   50    HE1  PHE   7           HE1      PHE   7  10.313  -8.561   6.048
   51    HE2  PHE   7           HE2      PHE   7  13.889  -7.380   8.047
   52    HZ   PHE   7           HZ       PHE   7  11.516  -8.020   8.132
   53    H    HIS   8           H        HIS   8  15.686 -10.597   1.367
   54    HA   HIS   8           HA       HIS   8  15.076  -9.503  -1.232
   55    HB2  HIS   8           HB3      HIS   8  17.030  -8.133  -0.260
   56    HB3  HIS   8           HB2      HIS   8  17.983  -9.604  -0.403
   57    HD1  HIS   8           HD1      HIS   8  16.159  -7.072  -2.538
   58    HD2  HIS   8           HD2      HIS   8  18.918 -10.155  -2.944
   59    HE1  HIS   8           HE1      HIS   8  17.002  -6.919  -4.899
   60    HE2  HIS   8           HE2      HIS   8  18.583  -8.863  -5.155
   61    H    MET   9           H        MET   9  14.839 -11.914   0.434
   62    HA   MET   9           HA       MET   9  16.203 -13.860  -1.303
   63    HB2  MET   9           HB3      MET   9  15.913 -14.056   1.706
   64    HB3  MET   9           HB2      MET   9  16.604 -15.291   0.669
   65    HG2  MET   9           HG3      MET   9  18.517 -14.009   0.228
   66    HG3  MET   9           HG2      MET   9  17.762 -12.530   0.812
   67    HE1  MET   9           HE1      MET   9  17.401 -15.970   2.593
   68    HE2  MET   9           HE2      MET   9  18.792 -15.992   3.679
   69    HE3  MET   9           HE3      MET   9  19.031 -16.115   1.938
   70    H    GLY  10           H        GLY  10  13.622 -13.159   0.992
   71    HA2  GLY  10           HA3      GLY  10  11.975 -15.195  -0.363
   72    HA3  GLY  10           HA2      GLY  10  11.975 -15.023   1.385
   73    H    GLU  11           H        GLU  11  12.052 -12.438  -1.004
   74    HA   GLU  11           HA       GLU  11   9.504 -11.496   0.112
   75    HB2  GLU  11           HB3      GLU  11  10.369  -9.290  -1.101
   76    HB3  GLU  11           HB2      GLU  11  10.834  -9.705   0.543
   77    HG2  GLU  11           HG3      GLU  11  12.738  -8.927  -0.752
   78    HG3  GLU  11           HG2      GLU  11  12.947 -10.603  -0.255
   79    H    PHE  12           H        PHE  12   9.862 -13.472  -2.008
   80    HA   PHE  12           HA       PHE  12   9.107 -12.238  -4.471
   81    HB2  PHE  12           HB3      PHE  12   8.937 -15.111  -3.529
   82    HB3  PHE  12           HB2      PHE  12   8.512 -14.587  -5.157
   83    HD1  PHE  12           HD1      PHE  12  11.206 -15.387  -2.873
   84    HD2  PHE  12           HD2      PHE  12  10.252 -13.671  -6.649
   85    HE1  PHE  12           HE1      PHE  12  13.557 -15.607  -3.569
   86    HE2  PHE  12           HE2      PHE  12  12.597 -13.890  -7.346
   87    HZ   PHE  12           HZ       PHE  12  14.254 -14.859  -5.807
   88    H    SER  13           H        SER  13   7.204 -11.426  -4.944
   89    HA   SER  13           HA       SER  13   4.993 -11.723  -3.142
   90    HB2  SER  13           HB3      SER  13   3.859 -10.170  -4.773
   91    HB3  SER  13           HB2      SER  13   5.381  -9.555  -4.143
   92    HG   SER  13           HG       SER  13   4.668 -10.174  -6.704
   93    H    VAL  14           H        VAL  14   3.046 -12.730  -3.516
   94    HA   VAL  14           HA       VAL  14   3.029 -15.099  -5.013
   95    HB   VAL  14           HB       VAL  14   0.565 -15.145  -4.536
   96   HG11  VAL  14          HG11      VAL  14   0.814 -15.334  -2.103
   97   HG12  VAL  14          HG12      VAL  14   2.374 -14.518  -2.205
   98   HG13  VAL  14          HG13      VAL  14   2.152 -16.096  -2.962
   99   HG21  VAL  14          HG21      VAL  14   1.125 -12.509  -3.176
  100   HG22  VAL  14          HG22      VAL  14  -0.376 -13.427  -3.074
  101   HG23  VAL  14          HG23      VAL  14   0.137 -12.743  -4.616
  102    H    CYS  15           H        CYS  15   2.301 -11.884  -5.924
  103    HA   CYS  15           HA       CYS  15   1.690 -12.778  -8.635
  104    HB2  CYS  15           HB3      CYS  15  -0.469 -12.277  -7.414
  105    HB3  CYS  15           HB2      CYS  15   0.091 -10.614  -7.237
  106    H    ASP  16           H        ASP  16   2.298 -11.200 -10.232
  107    HA   ASP  16           HA       ASP  16   4.447  -9.497  -9.302
  108    HB2  ASP  16           HB3      ASP  16   3.473 -10.321 -12.022
  109    HB3  ASP  16           HB2      ASP  16   4.564  -8.950 -11.853
  110    H    SER  17           H        SER  17   4.542  -7.306  -9.360
  111    HA   SER  17           HA       SER  17   2.114  -5.851 -10.104
  112    HB2  SER  17           HB3      SER  17   2.290  -4.594  -7.916
  113    HB3  SER  17           HB2      SER  17   1.798  -6.286  -7.756
  114    HG   SER  17           HG       SER  17   4.180  -5.029  -7.010
  115    H    VAL  18           H        VAL  18   2.419  -3.657 -10.561
  116    HA   VAL  18           HA       VAL  18   5.218  -2.756 -10.628
  117    HB   VAL  18           HB       VAL  18   4.559  -3.204 -12.894
  118   HG11  VAL  18          HG11      VAL  18   2.646  -2.085 -13.958
  119   HG12  VAL  18          HG12      VAL  18   2.168  -1.443 -12.385
  120   HG13  VAL  18          HG13      VAL  18   2.157  -3.184 -12.667
  121   HG21  VAL  18          HG21      VAL  18   5.927  -1.232 -12.560
  122   HG22  VAL  18          HG22      VAL  18   4.484  -0.244 -12.342
  123   HG23  VAL  18          HG23      VAL  18   4.814  -0.985 -13.906
  124    H    SER  19           H        SER  19   5.536  -1.101  -9.319
  125    HA   SER  19           HA       SER  19   3.274   0.537  -8.479
  126    HB2  SER  19           HB3      SER  19   6.121   0.435  -7.446
  127    HB3  SER  19           HB2      SER  19   4.811   1.386  -6.744
  128    HG   SER  19           HG       SER  19   3.707  -0.549  -6.306
  129    H    VAL  20           H        VAL  20   2.911   2.488  -9.284
  130    HA   VAL  20           HA       VAL  20   5.073   3.797 -10.793
  131    HB   VAL  20           HB       VAL  20   2.105   3.869 -11.350
  132   HG11  VAL  20          HG11      VAL  20   4.393   5.129 -12.843
  133   HG12  VAL  20          HG12      VAL  20   3.135   5.972 -11.936
  134   HG13  VAL  20          HG13      VAL  20   2.721   5.074 -13.397
  135   HG21  VAL  20          HG21      VAL  20   3.086   1.726 -11.936
  136   HG22  VAL  20          HG22      VAL  20   4.340   2.541 -12.872
  137   HG23  VAL  20          HG23      VAL  20   2.656   2.631 -13.388
  138    H    TRP  21           H        TRP  21   5.492   5.877 -10.342
  139    HA   TRP  21           HA       TRP  21   3.837   7.224  -8.346
  140    HB2  TRP  21           HB3      TRP  21   6.592   7.816  -9.449
  141    HB3  TRP  21           HB2      TRP  21   5.719   8.943  -8.415
  142    HD1  TRP  21           HD1      TRP  21   7.755   5.751  -8.299
  143    HE1  TRP  21           HE1      TRP  21   8.133   5.073  -5.845
  144    HE3  TRP  21           HE3      TRP  21   4.549   9.046  -6.044
  145    HZ2  TRP  21           HZ2      TRP  21   7.189   5.831  -3.296
  146    HZ3  TRP  21           HZ3      TRP  21   4.347   8.997  -3.591
  147    HH2  TRP  21           HH2      TRP  21   5.639   7.424  -2.250
  148    H    VAL  22           H        VAL  22   2.101   7.963  -9.406
  149    HA   VAL  22           HA       VAL  22   2.259   9.106 -12.042
  150    HB   VAL  22           HB       VAL  22  -0.052   9.112 -10.089
  151   HG11  VAL  22          HG11      VAL  22  -1.435   9.435 -12.101
  152   HG12  VAL  22          HG12      VAL  22   0.035   9.581 -13.064
  153   HG13  VAL  22          HG13      VAL  22  -0.327  10.777 -11.821
  154   HG21  VAL  22          HG21      VAL  22  -0.883   7.178 -11.341
  155   HG22  VAL  22          HG22      VAL  22   0.668   6.839 -10.573
  156   HG23  VAL  22          HG23      VAL  22   0.596   7.170 -12.303
  157    H    GLY  23           H        GLY  23   2.789  11.150 -12.468
  158    HA2  GLY  23           HA3      GLY  23   2.645  13.087 -10.248
  159    HA3  GLY  23           HA2      GLY  23   3.795  13.171 -11.580
  160    H    ASP  24           H        ASP  24   0.774  12.251 -12.697
  161    HA   ASP  24           HA       ASP  24  -0.241  14.957 -13.024
  162    HB2  ASP  24           HB3      ASP  24   0.738  13.268 -15.319
  163    HB3  ASP  24           HB2      ASP  24  -0.519  14.481 -15.552
  164    H    LYS  25           H        LYS  25  -1.374  12.988 -11.519
  165    HA   LYS  25           HA       LYS  25  -3.355  11.519 -12.958
  166    HB2  LYS  25           HB3      LYS  25  -2.473  10.982 -10.640
  167    HB3  LYS  25           HB2      LYS  25  -3.435  12.327 -10.046
  168    HG2  LYS  25           HG3      LYS  25  -5.468  11.244 -10.766
  169    HG3  LYS  25           HG2      LYS  25  -4.541   9.921 -11.475
  170    HD2  LYS  25           HD3      LYS  25  -3.628   9.440  -9.203
  171    HD3  LYS  25           HD2      LYS  25  -4.727  10.660  -8.561
  172    HE2  LYS  25           HE3      LYS  25  -5.707   8.465  -8.276
  173    HE3  LYS  25           HE2      LYS  25  -6.635   9.375  -9.470
  174    HZ1  LYS  25           HZ1      LYS  25  -6.270   7.104 -10.185
  175    HZ2  LYS  25           HZ2      LYS  25  -4.588   7.299 -10.072
  176    HZ3  LYS  25           HZ3      LYS  25  -5.471   8.174 -11.222
  177    H    THR  26           H        THR  26  -5.409  12.143 -13.542
  178    HA   THR  26           HA       THR  26  -5.917  15.010 -13.203
  179    HB   THR  26           HB       THR  26  -5.606  14.241 -15.520
  180    HG1  THR  26           HG1      THR  26  -6.937  16.038 -15.200
  181   HG21  THR  26          HG21      THR  26  -6.509  11.993 -15.372
  182   HG22  THR  26          HG22      THR  26  -7.369  12.904 -16.611
  183   HG23  THR  26          HG23      THR  26  -8.116  12.634 -15.037
  184    H    THR  27           H        THR  27  -7.437  11.860 -12.791
  185    HA   THR  27           HA       THR  27  -9.589  13.179 -11.323
  186    HB   THR  27           HB       THR  27 -11.169  11.416 -12.373
  187    HG1  THR  27           HG1      THR  27  -9.825  11.638 -14.752
  188   HG21  THR  27          HG21      THR  27 -10.222  13.797 -13.969
  189   HG22  THR  27          HG22      THR  27 -11.434  13.816 -12.689
  190   HG23  THR  27          HG23      THR  27 -11.756  12.957 -14.195
  191    H    ALA  28           H        ALA  28 -10.504  11.992  -9.684
  192    HA   ALA  28           HA       ALA  28  -9.752   9.196  -9.354
  193    HB1  ALA  28           HB1      ALA  28  -9.172  11.230  -7.206
  194    HB2  ALA  28           HB2      ALA  28  -7.958  10.456  -8.222
  195    HB3  ALA  28           HB3      ALA  28  -8.917   9.488  -7.100
  196    H    THR  29           H        THR  29 -10.877   8.302  -7.363
  197    HA   THR  29           HA       THR  29 -13.536   9.529  -7.157
  198    HB   THR  29           HB       THR  29 -12.766   6.660  -6.604
  199    HG1  THR  29           HG1      THR  29 -12.798   7.688  -8.904
  200   HG21  THR  29          HG21      THR  29 -14.749   7.400  -5.377
  201   HG22  THR  29          HG22      THR  29 -15.187   6.261  -6.651
  202   HG23  THR  29          HG23      THR  29 -15.465   7.988  -6.878
  203    H    ASP  30           H        ASP  30 -13.945  10.521  -5.348
  204    HA   ASP  30           HA       ASP  30 -12.319  10.362  -3.016
  205    HB2  ASP  30           HB3      ASP  30 -13.580  12.397  -3.636
  206    HB3  ASP  30           HB2      ASP  30 -15.098  11.525  -3.413
  207    H    ILE  31           H        ILE  31 -13.124   9.727  -0.871
  208    HA   ILE  31           HA       ILE  31 -13.942   7.059  -0.809
  209    HB   ILE  31           HB       ILE  31 -12.624   8.114   0.970
  210   HG12  ILE  31          HG13      ILE  31 -15.251   7.051   2.040
  211   HG13  ILE  31          HG12      ILE  31 -13.925   6.049   1.453
  212   HG21  ILE  31          HG21      ILE  31 -15.172   9.551   1.691
  213   HG22  ILE  31          HG22      ILE  31 -13.713  10.281   1.028
  214   HG23  ILE  31          HG23      ILE  31 -13.683   9.560   2.635
  215   HD11  ILE  31          HD11      ILE  31 -13.822   7.919   3.810
  216   HD12  ILE  31          HD12      ILE  31 -12.490   6.923   3.223
  217   HD13  ILE  31          HD13      ILE  31 -13.939   6.160   3.875
  218    H    LYS  32           H        LYS  32 -15.823   9.947  -0.955
  219    HA   LYS  32           HA       LYS  32 -18.246   8.741   0.058
  220    HB2  LYS  32           HB3      LYS  32 -17.838  11.337  -1.427
  221    HB3  LYS  32           HB2      LYS  32 -19.289  10.866  -0.548
  222    HG2  LYS  32           HG3      LYS  32 -16.572  11.293   0.681
  223    HG3  LYS  32           HG2      LYS  32 -17.892  12.460   0.694
  224    HD2  LYS  32           HD3      LYS  32 -19.269  10.864   1.950
  225    HD3  LYS  32           HD2      LYS  32 -17.924   9.724   1.943
  226    HE2  LYS  32           HE3      LYS  32 -16.557  11.284   3.190
  227    HE3  LYS  32           HE2      LYS  32 -17.851  12.476   3.157
  228    HZ1  LYS  32           HZ1      LYS  32 -19.221  11.009   4.464
  229    HZ2  LYS  32           HZ2      LYS  32 -17.758  11.284   5.265
  230    HZ3  LYS  32           HZ3      LYS  32 -18.020   9.821   4.464
  231    H    GLY  33           H        GLY  33 -16.570   8.604  -2.838
  232    HA2  GLY  33           HA3      GLY  33 -17.256   7.221  -4.633
  233    HA3  GLY  33           HA2      GLY  33 -18.932   7.492  -4.169
  234    H    LYS  34           H        LYS  34 -16.984  10.288  -4.255
  235    HA   LYS  34           HA       LYS  34 -18.388  11.198  -6.645
  236    HB2  LYS  34           HB3      LYS  34 -16.697  12.663  -4.619
  237    HB3  LYS  34           HB2      LYS  34 -17.442  13.428  -6.011
  238    HG2  LYS  34           HG3      LYS  34 -18.907  12.065  -3.766
  239    HG3  LYS  34           HG2      LYS  34 -18.713  13.802  -3.970
  240    HD2  LYS  34           HD3      LYS  34 -19.836  13.526  -6.219
  241    HD3  LYS  34           HD2      LYS  34 -20.259  11.895  -5.697
  242    HE2  LYS  34           HE3      LYS  34 -22.117  13.317  -5.212
  243    HE3  LYS  34           HE2      LYS  34 -21.339  12.905  -3.688
  244    HZ1  LYS  34           HZ1      LYS  34 -20.941  15.445  -5.176
  245    HZ2  LYS  34           HZ2      LYS  34 -20.244  15.048  -3.690
  246    HZ3  LYS  34           HZ3      LYS  34 -21.916  15.256  -3.809
  247    H    GLU  35           H        GLU  35 -17.394  11.731  -8.533
  248    HA   GLU  35           HA       GLU  35 -14.596  11.032  -8.847
  249    HB2  GLU  35           HB3      GLU  35 -16.186  10.409 -10.616
  250    HB3  GLU  35           HB2      GLU  35 -16.604  12.101 -10.841
  251    HG2  GLU  35           HG3      GLU  35 -14.329  12.579 -11.568
  252    HG3  GLU  35           HG2      GLU  35 -13.895  10.889 -11.329
  253    H    VAL  36           H        VAL  36 -13.070  12.454  -8.420
  254    HA   VAL  36           HA       VAL  36 -13.734  15.312  -8.622
  255    HB   VAL  36           HB       VAL  36 -12.092  15.701  -6.802
  256   HG11  VAL  36          HG11      VAL  36 -14.454  15.588  -6.274
  257   HG12  VAL  36          HG12      VAL  36 -13.506  14.862  -4.975
  258   HG13  VAL  36          HG13      VAL  36 -14.356  13.834  -6.129
  259   HG21  VAL  36          HG21      VAL  36 -11.332  13.836  -5.437
  260   HG22  VAL  36          HG22      VAL  36 -10.759  13.665  -7.096
  261   HG23  VAL  36          HG23      VAL  36 -12.120  12.699  -6.528
  262    H    THR  37           H        THR  37 -12.110  16.733  -9.278
  263    HA   THR  37           HA       THR  37 -10.230  15.587 -11.149
  264    HB   THR  37           HB       THR  37 -10.605  18.495 -10.436
  265    HG1  THR  37           HG1      THR  37 -12.366  16.851 -11.565
  266   HG21  THR  37          HG21      THR  37  -8.574  17.988 -11.705
  267   HG22  THR  37          HG22      THR  37  -9.726  18.890 -12.690
  268   HG23  THR  37          HG23      THR  37  -9.538  17.151 -12.922
  269    H    VAL  38           H        VAL  38  -8.237  15.065 -10.601
  270    HA   VAL  38           HA       VAL  38  -7.257  15.744  -7.974
  271    HB   VAL  38           HB       VAL  38  -6.075  14.000 -10.142
  272   HG11  VAL  38          HG11      VAL  38  -4.545  13.193  -8.418
  273   HG12  VAL  38          HG12      VAL  38  -5.193  14.379  -7.286
  274   HG13  VAL  38          HG13      VAL  38  -4.321  14.916  -8.723
  275   HG21  VAL  38          HG21      VAL  38  -6.764  12.152  -8.722
  276   HG22  VAL  38          HG22      VAL  38  -8.151  13.147  -9.161
  277   HG23  VAL  38          HG23      VAL  38  -7.441  13.282  -7.552
  278    H    LEU  39           H        LEU  39  -5.652  17.125  -7.499
  279    HA   LEU  39           HA       LEU  39  -4.474  18.608  -9.737
  280    HB2  LEU  39           HB3      LEU  39  -4.582  19.362  -6.810
  281    HB3  LEU  39           HB2      LEU  39  -4.036  20.380  -8.131
  282    HG   LEU  39           HG       LEU  39  -6.861  19.397  -7.728
  283   HD11  LEU  39          HD11      LEU  39  -6.197  21.074  -6.088
  284   HD12  LEU  39          HD12      LEU  39  -7.377  21.718  -7.226
  285   HD13  LEU  39          HD13      LEU  39  -5.672  22.140  -7.389
  286   HD21  LEU  39          HD21      LEU  39  -5.693  21.249  -9.796
  287   HD22  LEU  39          HD22      LEU  39  -7.414  20.953  -9.546
  288   HD23  LEU  39          HD23      LEU  39  -6.362  19.642 -10.080
  289    H    ALA  40           H        ALA  40  -2.633  17.656 -10.311
  290    HA   ALA  40           HA       ALA  40  -0.969  16.138  -8.612
  291    HB1  ALA  40           HB1      ALA  40   0.633  16.180 -10.446
  292    HB2  ALA  40           HB2      ALA  40  -0.275  17.475 -11.227
  293    HB3  ALA  40           HB3      ALA  40  -0.996  15.874 -11.054
  294    H    GLU  41           H        GLU  41  -1.161  19.481  -9.435
  295    HA   GLU  41           HA       GLU  41   1.128  20.084  -7.697
  296    HB2  GLU  41           HB3      GLU  41  -0.346  21.853  -9.665
  297    HB3  GLU  41           HB2      GLU  41   1.039  22.337  -8.697
  298    HG2  GLU  41           HG3      GLU  41   2.473  20.837  -9.863
  299    HG3  GLU  41           HG2      GLU  41   1.108  20.102 -10.705
  300    H    VAL  42           H        VAL  42   0.701  20.899  -5.726
  301    HA   VAL  42           HA       VAL  42  -2.095  21.290  -5.059
  302    HB   VAL  42           HB       VAL  42  -1.344  21.362  -2.700
  303   HG11  VAL  42          HG11      VAL  42  -0.370  18.997  -4.295
  304   HG12  VAL  42          HG12      VAL  42  -2.005  19.252  -3.683
  305   HG13  VAL  42          HG13      VAL  42  -0.670  19.002  -2.557
  306   HG21  VAL  42          HG21      VAL  42   0.897  22.290  -3.054
  307   HG22  VAL  42          HG22      VAL  42   1.395  20.782  -3.823
  308   HG23  VAL  42          HG23      VAL  42   0.947  20.796  -2.117
  309    H    ASN  43           H        ASN  43  -3.008  23.171  -4.935
  310    HA   ASN  43           HA       ASN  43  -1.402  25.570  -5.187
  311    HB2  ASN  43           HB3      ASN  43  -4.388  25.082  -5.290
  312    HB3  ASN  43           HB2      ASN  43  -3.675  26.691  -5.370
  313   HD21  ASN  43          HD21      ASN  43  -4.084  23.651  -7.028
  314   HD22  ASN  43          HD22      ASN  43  -3.569  24.204  -8.580
  315    H    ILE  44           H        ILE  44  -0.471  25.975  -3.293
  316    HA   ILE  44           HA       ILE  44  -2.242  26.510  -0.996
  317    HB   ILE  44           HB       ILE  44   0.711  25.818  -1.006
  318   HG12  ILE  44          HG13      ILE  44  -1.635  24.191   0.002
  319   HG13  ILE  44          HG12      ILE  44  -0.798  23.905  -1.522
  320   HG21  ILE  44          HG21      ILE  44   0.544  25.761   1.422
  321   HG22  ILE  44          HG22      ILE  44  -1.151  26.237   1.328
  322   HG23  ILE  44          HG23      ILE  44   0.108  27.355   0.802
  323   HD11  ILE  44          HD11      ILE  44   1.262  23.431  -0.291
  324   HD12  ILE  44          HD12      ILE  44  -0.052  22.356   0.190
  325   HD13  ILE  44          HD13      ILE  44   0.412  23.703   1.230
  326    H    ASN  45           H        ASN  45  -1.876  28.501   0.103
  327    HA   ASN  45           HA       ASN  45  -1.221  30.672  -1.531
  328    HB2  ASN  45           HB3      ASN  45  -1.621  30.377   1.432
  329    HB3  ASN  45           HB2      ASN  45  -1.061  31.908   0.766
  330   HD21  ASN  45          HD21      ASN  45  -3.723  29.693   1.020
  331   HD22  ASN  45          HD22      ASN  45  -4.917  30.738   0.336
  332    H    ASN  46           H        ASN  46   0.670  31.017  -2.372
  333    HA   ASN  46           HA       ASN  46   2.857  31.557  -2.603
  334    HB2  ASN  46           HB3      ASN  46   2.363  32.661  -0.269
  335    HB3  ASN  46           HB2      ASN  46   3.356  31.349   0.347
  336   HD21  ASN  46          HD21      ASN  46   5.080  31.349  -2.070
  337   HD22  ASN  46          HD22      ASN  46   6.078  32.753  -1.911
  338    H    SER  47           H        SER  47   1.842  28.755  -2.427
  339    HA   SER  47           HA       SER  47   4.454  27.546  -2.613
  340    HB2  SER  47           HB3      SER  47   2.451  26.546  -0.572
  341    HB3  SER  47           HB2      SER  47   3.881  25.651  -1.079
  342    HG   SER  47           HG       SER  47   4.485  28.199  -0.349
  343    H    VAL  48           H        VAL  48   4.323  26.613  -4.547
  344    HA   VAL  48           HA       VAL  48   2.019  24.868  -5.099
  345    HB   VAL  48           HB       VAL  48   3.378  26.625  -7.154
  346   HG11  VAL  48          HG11      VAL  48   1.005  24.782  -7.400
  347   HG12  VAL  48          HG12      VAL  48   2.610  24.516  -8.082
  348   HG13  VAL  48          HG13      VAL  48   1.614  25.848  -8.665
  349   HG21  VAL  48          HG21      VAL  48   0.609  26.865  -5.988
  350   HG22  VAL  48          HG22      VAL  48   1.291  27.868  -7.268
  351   HG23  VAL  48          HG23      VAL  48   1.967  27.934  -5.640
  352    H    PHE  49           H        PHE  49   2.752  22.838  -5.262
  353    HA   PHE  49           HA       PHE  49   5.147  22.297  -6.798
  354    HB2  PHE  49           HB3      PHE  49   6.081  20.848  -4.936
  355    HB3  PHE  49           HB2      PHE  49   6.205  22.584  -4.698
  356    HD1  PHE  49           HD1      PHE  49   4.773  23.718  -3.047
  357    HD2  PHE  49           HD2      PHE  49   4.766  19.485  -3.494
  358    HE1  PHE  49           HE1      PHE  49   3.696  23.487  -0.846
  359    HE2  PHE  49           HE2      PHE  49   3.685  19.253  -1.298
  360    HZ   PHE  49           HZ       PHE  49   3.150  21.254   0.027
  361    H    ARG  50           H        ARG  50   5.463  20.009  -7.228
  362    HA   ARG  50           HA       ARG  50   2.886  18.786  -7.756
  363    HB2  ARG  50           HB3      ARG  50   5.674  17.936  -8.574
  364    HB3  ARG  50           HB2      ARG  50   4.185  17.182  -9.120
  365    HG2  ARG  50           HG3      ARG  50   3.528  19.224 -10.235
  366    HG3  ARG  50           HG2      ARG  50   4.971  20.044  -9.637
  367    HD2  ARG  50           HD3      ARG  50   5.421  19.405 -11.877
  368    HD3  ARG  50           HD2      ARG  50   6.321  18.304 -10.839
  369    HE   ARG  50           HE       ARG  50   3.709  17.478 -11.887
  370   HH11  ARG  50          HH11      ARG  50   7.183  17.083 -11.751
  371   HH12  ARG  50          HH12      ARG  50   7.181  15.592 -12.635
  372   HH21  ARG  50          HH21      ARG  50   3.693  15.511 -13.047
  373   HH22  ARG  50          HH22      ARG  50   5.192  14.698 -13.372
  374    H    GLN  51           H        GLN  51   2.015  17.245  -6.615
  375    HA   GLN  51           HA       GLN  51   3.700  15.726  -4.731
  376    HB2  GLN  51           HB3      GLN  51   0.788  16.534  -4.590
  377    HB3  GLN  51           HB2      GLN  51   1.519  15.372  -3.496
  378    HG2  GLN  51           HG3      GLN  51   2.485  18.201  -3.824
  379    HG3  GLN  51           HG2      GLN  51   1.332  17.685  -2.593
  380   HE21  GLN  51          HE21      GLN  51   2.041  16.520  -0.843
  381   HE22  GLN  51          HE22      GLN  51   3.717  16.290  -0.480
  382    H    TYR  52           H        TYR  52   4.188  13.873  -5.765
  383    HA   TYR  52           HA       TYR  52   2.602  12.763  -7.835
  384    HB2  TYR  52           HB3      TYR  52   4.772  11.289  -6.343
  385    HB3  TYR  52           HB2      TYR  52   4.290  11.103  -8.026
  386    HD1  TYR  52           HD1      TYR  52   4.629  13.261  -9.527
  387    HD2  TYR  52           HD2      TYR  52   6.631  12.546  -5.840
  388    HE1  TYR  52           HE1      TYR  52   6.391  14.847 -10.180
  389    HE2  TYR  52           HE2      TYR  52   8.394  14.129  -6.484
  390    HH   TYR  52           HH       TYR  52   9.353  15.081  -8.526
  391    H    PHE  53           H        PHE  53   1.968  10.412  -7.848
  392    HA   PHE  53           HA       PHE  53   0.726   9.647  -5.283
  393    HB2  PHE  53           HB3      PHE  53  -0.451   9.341  -8.060
  394    HB3  PHE  53           HB2      PHE  53  -1.208   8.806  -6.562
  395    HD1  PHE  53           HD1      PHE  53  -2.226  10.375  -5.060
  396    HD2  PHE  53           HD2      PHE  53  -0.310  11.697  -8.619
  397    HE1  PHE  53           HE1      PHE  53  -3.264  12.586  -4.793
  398    HE2  PHE  53           HE2      PHE  53  -1.344  13.913  -8.357
  399    HZ   PHE  53           HZ       PHE  53  -2.818  14.360  -6.441
  400    H    PHE  54           H        PHE  54   0.905   7.553  -4.689
  401    HA   PHE  54           HA       PHE  54   2.619   5.842  -6.325
  402    HB2  PHE  54           HB3      PHE  54   3.216   6.193  -3.953
  403    HB3  PHE  54           HB2      PHE  54   1.654   5.557  -3.460
  404    HD1  PHE  54           HD1      PHE  54   4.911   4.689  -4.949
  405    HD2  PHE  54           HD2      PHE  54   1.262   3.222  -3.321
  406    HE1  PHE  54           HE1      PHE  54   5.878   2.430  -4.818
  407    HE2  PHE  54           HE2      PHE  54   2.220   0.963  -3.190
  408    HZ   PHE  54           HZ       PHE  54   4.531   0.565  -3.937
  409    H    GLU  55           H        GLU  55   1.395   4.816  -7.846
  410    HA   GLU  55           HA       GLU  55  -0.926   3.301  -6.837
  411    HB2  GLU  55           HB3      GLU  55  -0.602   4.446  -9.624
  412    HB3  GLU  55           HB2      GLU  55  -1.975   3.517  -9.041
  413    HG2  GLU  55           HG3      GLU  55  -2.193   5.396  -7.268
  414    HG3  GLU  55           HG2      GLU  55  -1.173   6.323  -8.372
  415    H    THR  56           H        THR  56  -0.719   1.199  -6.950
  416    HA   THR  56           HA       THR  56   1.364   0.072  -8.697
  417    HB   THR  56           HB       THR  56   0.111  -1.142  -6.220
  418    HG1  THR  56           HG1      THR  56   1.537   0.033  -5.212
  419   HG21  THR  56          HG21      THR  56   2.453  -2.060  -7.894
  420   HG22  THR  56          HG22      THR  56   0.870  -2.834  -7.813
  421   HG23  THR  56          HG23      THR  56   1.911  -2.801  -6.389
  422    H    LYS  57           H        LYS  57   0.778  -1.202 -10.324
  423    HA   LYS  57           HA       LYS  57  -2.002  -2.186 -10.388
  424    HB2  LYS  57           HB3      LYS  57  -0.130  -1.486 -12.664
  425    HB3  LYS  57           HB2      LYS  57  -1.709  -2.235 -12.875
  426    HG2  LYS  57           HG3      LYS  57  -2.739  -0.261 -11.794
  427    HG3  LYS  57           HG2      LYS  57  -1.148   0.493 -11.726
  428    HD2  LYS  57           HD3      LYS  57  -2.359   1.320 -13.645
  429    HD3  LYS  57           HD2      LYS  57  -1.008   0.324 -14.186
  430    HE2  LYS  57           HE3      LYS  57  -2.506  -1.542 -14.561
  431    HE3  LYS  57           HE2      LYS  57  -3.861  -0.604 -13.947
  432    HZ1  LYS  57           HZ1      LYS  57  -3.806  -0.654 -16.369
  433    HZ2  LYS  57           HZ2      LYS  57  -2.274   0.061 -16.366
  434    HZ3  LYS  57           HZ3      LYS  57  -3.613   0.922 -15.786
  435    H    CYS  58           H        CYS  58  -2.343  -4.257 -11.411
  436    HA   CYS  58           HA       CYS  58  -0.348  -6.171 -10.609
  437    HB2  CYS  58           HB3      CYS  58  -2.983  -6.601 -12.042
  438    HB3  CYS  58           HB2      CYS  58  -1.984  -7.865 -11.339
  439    H    ARG  59           H        ARG  59   1.217  -6.963 -11.847
  440    HA   ARG  59           HA       ARG  59   1.317  -6.336 -14.670
  441    HB2  ARG  59           HB3      ARG  59   3.176  -7.716 -12.752
  442    HB3  ARG  59           HB2      ARG  59   3.459  -7.786 -14.484
  443    HG2  ARG  59           HG3      ARG  59   3.630  -5.372 -14.575
  444    HG3  ARG  59           HG2      ARG  59   3.273  -5.266 -12.854
  445    HD2  ARG  59           HD3      ARG  59   5.298  -6.369 -12.282
  446    HD3  ARG  59           HD2      ARG  59   5.614  -6.798 -13.960
  447    HE   ARG  59           HE       ARG  59   5.603  -4.145 -14.116
  448   HH11  ARG  59          HH11      ARG  59   7.105  -6.246 -11.748
  449   HH12  ARG  59          HH12      ARG  59   8.467  -5.204 -11.502
  450   HH21  ARG  59          HH21      ARG  59   7.399  -2.768 -13.787
  451   HH22  ARG  59          HH22      ARG  59   8.627  -3.218 -12.646
  452    H    ALA  60           H        ALA  60  -0.397  -7.475 -15.549
  453    HA   ALA  60           HA       ALA  60  -1.540  -9.220 -16.448
  454    HB1  ALA  60           HB1      ALA  60   1.060 -10.721 -16.109
  455    HB2  ALA  60           HB2      ALA  60   0.612  -9.742 -17.507
  456    HB3  ALA  60           HB3      ALA  60  -0.296 -11.206 -17.130
  457    H    SER  61           H        SER  61  -2.979  -9.372 -14.751
  458    HA   SER  61           HA       SER  61  -2.580 -10.496 -12.265
  459    HB2  SER  61           HB3      SER  61  -5.130 -10.503 -13.891
  460    HB3  SER  61           HB2      SER  61  -5.022 -10.705 -12.144
  461    HG   SER  61           HG       SER  61  -4.437  -8.414 -13.695
  462    H    ASN  62           H        ASN  62  -2.573 -12.466 -11.419
  463    HA   ASN  62           HA       ASN  62  -2.597 -14.717 -11.180
  464    HB2  ASN  62           HB3      ASN  62  -4.229 -14.681 -13.729
  465    HB3  ASN  62           HB2      ASN  62  -3.923 -16.122 -12.761
  466   HD21  ASN  62          HD21      ASN  62  -6.092 -16.451 -12.298
  467   HD22  ASN  62          HD22      ASN  62  -6.982 -15.426 -11.231
  468    HA   PRO  63           HA       PRO  63   1.123 -14.648 -13.920
  469    HB2  PRO  63           HB3      PRO  63   2.695 -15.924 -12.047
  470    HB3  PRO  63           HB2      PRO  63   2.522 -14.168 -12.180
  471    HG2  PRO  63           HG3      PRO  63   1.164 -16.080 -10.327
  472    HG3  PRO  63           HG2      PRO  63   1.792 -14.456  -9.999
  473    HD2  PRO  63           HD3      PRO  63  -0.841 -14.907 -10.345
  474    HD3  PRO  63           HD2      PRO  63  -0.068 -13.409 -10.924
  475    H    VAL  64           H        VAL  64  -0.400 -17.238 -12.125
  476    HA   VAL  64           HA       VAL  64   0.693 -19.157 -14.075
  477    HB   VAL  64           HB       VAL  64   0.382 -20.928 -12.387
  478   HG11  VAL  64          HG11      VAL  64   2.563 -19.912 -12.583
  479   HG12  VAL  64          HG12      VAL  64   2.231 -20.281 -10.891
  480   HG13  VAL  64          HG13      VAL  64   2.094 -18.622 -11.477
  481   HG21  VAL  64          HG21      VAL  64  -0.084 -20.393 -10.071
  482   HG22  VAL  64          HG22      VAL  64  -1.413 -19.847 -11.094
  483   HG23  VAL  64          HG23      VAL  64  -0.242 -18.684 -10.474
  484    H    GLU  65           H        GLU  65  -0.765 -20.999 -14.534
  485    HA   GLU  65           HA       GLU  65  -3.242 -19.918 -15.422
  486    HB2  GLU  65           HB3      GLU  65  -2.132 -22.723 -15.548
  487    HB3  GLU  65           HB2      GLU  65  -3.648 -22.243 -16.292
  488    HG2  GLU  65           HG3      GLU  65  -1.930 -22.288 -17.955
  489    HG3  GLU  65           HG2      GLU  65  -2.416 -20.617 -17.675
  490    H    SER  66           H        SER  66  -2.368 -21.297 -12.498
  491    HA   SER  66           HA       SER  66  -5.122 -22.136 -11.932
  492    HB2  SER  66           HB3      SER  66  -2.623 -22.616 -10.285
  493    HB3  SER  66           HB2      SER  66  -4.220 -23.306  -9.996
  494    HG   SER  66           HG       SER  66  -2.610 -23.735 -12.299
  495    H    GLY  67           H        GLY  67  -3.764 -19.348 -12.017
  496    HA2  GLY  67           HA3      GLY  67  -4.865 -17.478 -10.962
  497    HA3  GLY  67           HA2      GLY  67  -4.993 -18.444  -9.494
  498    H    CYS  68           H        CYS  68  -3.454 -18.246  -7.988
  499    HA   CYS  68           HA       CYS  68  -1.102 -16.636  -8.699
  500    HB2  CYS  68           HB3      CYS  68  -2.590 -16.887  -6.076
  501    HB3  CYS  68           HB2      CYS  68  -1.028 -16.074  -6.238
  502    H    ARG  69           H        ARG  69   0.912 -17.211  -7.861
  503    HA   ARG  69           HA       ARG  69   1.366 -20.000  -8.048
  504    HB2  ARG  69           HB3      ARG  69   2.972 -18.418  -8.935
  505    HB3  ARG  69           HB2      ARG  69   3.205 -17.703  -7.346
  506    HG2  ARG  69           HG3      ARG  69   4.288 -19.687  -6.547
  507    HG3  ARG  69           HG2      ARG  69   3.932 -20.539  -8.054
  508    HD2  ARG  69           HD3      ARG  69   5.644 -18.064  -7.813
  509    HD3  ARG  69           HD2      ARG  69   6.261 -19.712  -7.946
  510    HE   ARG  69           HE       ARG  69   5.142 -19.783 -10.160
  511   HH11  ARG  69          HH11      ARG  69   5.981 -16.685  -8.759
  512   HH12  ARG  69          HH12      ARG  69   6.080 -15.879 -10.291
  513   HH21  ARG  69          HH21      ARG  69   5.285 -18.716 -12.183
  514   HH22  ARG  69          HH22      ARG  69   5.699 -17.028 -12.228
  515    H    GLY  70           H        GLY  70   1.147 -21.453  -6.493
  516    HA2  GLY  70           HA3      GLY  70   2.114 -22.283  -4.410
  517    HA3  GLY  70           HA2      GLY  70   1.911 -20.667  -3.749
  518    H    ILE  71           H        ILE  71  -0.783 -20.480  -5.052
  519    HA   ILE  71           HA       ILE  71  -2.250 -21.421  -2.781
  520    HB   ILE  71           HB       ILE  71  -3.223 -20.169  -5.355
  521   HG12  ILE  71          HG13      ILE  71  -1.748 -18.687  -4.083
  522   HG13  ILE  71          HG12      ILE  71  -3.410 -18.110  -4.024
  523   HG21  ILE  71          HG21      ILE  71  -4.682 -20.615  -2.756
  524   HG22  ILE  71          HG22      ILE  71  -5.004 -21.423  -4.292
  525   HG23  ILE  71          HG23      ILE  71  -5.292 -19.691  -4.128
  526   HD11  ILE  71          HD11      ILE  71  -3.638 -19.112  -1.781
  527   HD12  ILE  71          HD12      ILE  71  -2.385 -17.873  -1.864
  528   HD13  ILE  71          HD13      ILE  71  -1.939 -19.577  -1.847
  529    H    ASP  72           H        ASP  72  -3.459 -23.211  -2.563
  530    HA   ASP  72           HA       ASP  72  -3.440 -25.274  -4.524
  531    HB2  ASP  72           HB3      ASP  72  -3.589 -25.798  -2.131
  532    HB3  ASP  72           HB2      ASP  72  -5.141 -24.972  -2.034
  533    H    SER  73           H        SER  73  -4.629 -25.313  -6.299
  534    HA   SER  73           HA       SER  73  -6.806 -23.441  -6.593
  535    HB2  SER  73           HB3      SER  73  -6.713 -24.395  -9.003
  536    HB3  SER  73           HB2      SER  73  -5.354 -23.424  -8.427
  537    HG   SER  73           HG       SER  73  -5.486 -26.121  -9.043
  538    H    LYS  74           H        LYS  74  -6.788 -26.354  -5.252
  539    HA   LYS  74           HA       LYS  74  -9.156 -27.363  -6.637
  540    HB2  LYS  74           HB3      LYS  74  -7.525 -28.607  -4.416
  541    HB3  LYS  74           HB2      LYS  74  -8.872 -29.374  -5.244
  542    HG2  LYS  74           HG3      LYS  74  -7.586 -29.194  -7.368
  543    HG3  LYS  74           HG2      LYS  74  -6.216 -28.601  -6.428
  544    HD2  LYS  74           HD3      LYS  74  -7.577 -31.265  -6.080
  545    HD3  LYS  74           HD2      LYS  74  -6.027 -30.996  -6.872
  546    HE2  LYS  74           HE3      LYS  74  -5.156 -30.085  -4.740
  547    HE3  LYS  74           HE2      LYS  74  -6.692 -30.497  -3.979
  548    HZ1  LYS  74           HZ1      LYS  74  -6.299 -32.816  -4.509
  549    HZ2  LYS  74           HZ2      LYS  74  -5.021 -32.199  -3.593
  550    HZ3  LYS  74           HZ3      LYS  74  -4.833 -32.427  -5.256
  551    H    HIS  75           H        HIS  75  -8.064 -26.333  -3.440
  552    HA   HIS  75           HA       HIS  75 -10.800 -26.407  -2.431
  553    HB2  HIS  75           HB3      HIS  75  -8.177 -25.701  -1.100
  554    HB3  HIS  75           HB2      HIS  75  -9.732 -25.651  -0.281
  555    HD1  HIS  75           HD1      HIS  75 -10.568 -27.795   0.704
  556    HD2  HIS  75           HD2      HIS  75  -7.398 -28.379  -1.920
  557    HE1  HIS  75           HE1      HIS  75  -9.923 -30.210   0.954
  558    HE2  HIS  75           HE2      HIS  75  -7.909 -30.500  -0.529
  559    H    TRP  76           H        TRP  76  -8.424 -24.140  -3.552
  560    HA   TRP  76           HA       TRP  76 -10.292 -21.936  -3.006
  561    HB2  TRP  76           HB3      TRP  76  -7.272 -21.913  -2.746
  562    HB3  TRP  76           HB2      TRP  76  -8.275 -20.466  -2.715
  563    HD1  TRP  76           HD1      TRP  76  -6.982 -23.228  -0.528
  564    HE1  TRP  76           HE1      TRP  76  -7.824 -22.885   1.880
  565    HE3  TRP  76           HE3      TRP  76 -10.445 -19.562  -1.385
  566    HZ2  TRP  76           HZ2      TRP  76  -9.697 -21.273   3.234
  567    HZ3  TRP  76           HZ3      TRP  76 -11.715 -18.673   0.523
  568    HH2  TRP  76           HH2      TRP  76 -11.347 -19.513   2.785
  569    H    ASN  77           H        ASN  77 -10.311 -20.260  -4.540
  570    HA   ASN  77           HA       ASN  77  -8.459 -20.572  -6.801
  571    HB2  ASN  77           HB3      ASN  77 -10.070 -19.704  -8.350
  572    HB3  ASN  77           HB2      ASN  77 -10.862 -21.000  -7.475
  573   HD21  ASN  77          HD21      ASN  77 -10.764 -17.597  -8.103
  574   HD22  ASN  77          HD22      ASN  77 -12.237 -17.196  -7.288
  575    H    SER  78           H        SER  78  -7.453 -18.680  -7.483
  576    HA   SER  78           HA       SER  78  -7.916 -16.354  -5.764
  577    HB2  SER  78           HB3      SER  78  -6.046 -17.835  -4.880
  578    HB3  SER  78           HB2      SER  78  -5.143 -17.412  -6.335
  579    HG   SER  78           HG       SER  78  -6.237 -15.463  -4.593
  580    H    TYR  79           H        TYR  79  -7.488 -14.401  -6.679
  581    HA   TYR  79           HA       TYR  79  -6.104 -14.332  -9.219
  582    HB2  TYR  79           HB3      TYR  79  -7.858 -12.923 -10.282
  583    HB3  TYR  79           HB2      TYR  79  -8.378 -14.575  -9.973
  584    HD1  TYR  79           HD1      TYR  79  -8.877 -11.054  -9.131
  585    HD2  TYR  79           HD2      TYR  79 -10.105 -15.044  -8.307
  586    HE1  TYR  79           HE1      TYR  79 -10.910 -10.200  -8.040
  587    HE2  TYR  79           HE2      TYR  79 -12.137 -14.198  -7.210
  588    HH   TYR  79           HH       TYR  79 -13.176 -10.985  -7.511
  589    H    CYS  80           H        CYS  80  -5.306 -12.294  -9.786
  590    HA   CYS  80           HA       CYS  80  -4.493 -10.805  -7.462
  591    HB2  CYS  80           HB3      CYS  80  -3.848 -10.279 -10.374
  592    HB3  CYS  80           HB2      CYS  80  -2.985  -9.646  -8.971
  593    H    THR  81           H        THR  81  -5.487  -9.099  -6.684
  594    HA   THR  81           HA       THR  81  -6.965  -7.341  -8.519
  595    HB   THR  81           HB       THR  81  -7.888  -8.167  -5.751
  596    HG1  THR  81           HG1      THR  81  -8.165  -9.830  -7.290
  597   HG21  THR  81          HG21      THR  81  -9.262  -6.493  -7.863
  598   HG22  THR  81          HG22      THR  81  -8.549  -5.881  -6.371
  599   HG23  THR  81          HG23      THR  81  -9.940  -6.962  -6.303
  600    H    THR  82           H        THR  82  -6.426  -5.242  -8.292
  601    HA   THR  82           HA       THR  82  -4.442  -4.485  -6.399
  602    HB   THR  82           HB       THR  82  -4.995  -2.146  -7.333
  603    HG1  THR  82           HG1      THR  82  -6.563  -2.031  -8.729
  604   HG21  THR  82          HG21      THR  82  -3.035  -3.421  -8.002
  605   HG22  THR  82          HG22      THR  82  -3.746  -2.614  -9.399
  606   HG23  THR  82          HG23      THR  82  -4.007  -4.341  -9.152
  607    H    THR  83           H        THR  83  -4.750  -3.868  -4.385
  608    HA   THR  83           HA       THR  83  -7.415  -3.431  -3.395
  609    HB   THR  83           HB       THR  83  -5.848  -4.699  -2.020
  610    HG1  THR  83           HG1      THR  83  -6.065  -3.314  -0.069
  611   HG21  THR  83          HG21      THR  83  -4.250  -2.142  -1.892
  612   HG22  THR  83          HG22      THR  83  -3.745  -3.668  -2.616
  613   HG23  THR  83          HG23      THR  83  -3.977  -3.554  -0.874
  614    H    HIS  84           H        HIS  84  -8.267  -1.561  -2.610
  615    HA   HIS  84           HA       HIS  84  -6.991   0.849  -3.701
  616    HB2  HIS  84           HB3      HIS  84  -9.891   0.653  -2.904
  617    HB3  HIS  84           HB2      HIS  84  -9.135   1.768  -4.035
  618    HD1  HIS  84           HD1      HIS  84  -8.228   0.534  -6.343
  619    HD2  HIS  84           HD2      HIS  84 -11.096  -1.466  -4.077
  620    HE1  HIS  84           HE1      HIS  84  -9.248  -1.174  -7.877
  621    HE2  HIS  84           HE2      HIS  84 -11.045  -2.299  -6.525
  622    H    THR  85           H        THR  85  -6.278   2.349  -2.339
  623    HA   THR  85           HA       THR  85  -7.343   2.357   0.407
  624    HB   THR  85           HB       THR  85  -4.937   1.697   0.294
  625    HG1  THR  85           HG1      THR  85  -4.363   3.026   1.974
  626   HG21  THR  85          HG21      THR  85  -3.259   3.387  -0.308
  627   HG22  THR  85          HG22      THR  85  -4.548   4.484  -0.807
  628   HG23  THR  85          HG23      THR  85  -4.284   2.975  -1.683
  629    H    PHE  86           H        PHE  86  -7.390   4.535   1.406
  630    HA   PHE  86           HA       PHE  86  -8.088   6.509  -0.654
  631    HB2  PHE  86           HB3      PHE  86  -9.000   6.366   2.236
  632    HB3  PHE  86           HB2      PHE  86  -9.515   7.567   1.051
  633    HD1  PHE  86           HD1      PHE  86 -10.777   6.773  -0.993
  634    HD2  PHE  86           HD2      PHE  86 -10.098   4.316   2.416
  635    HE1  PHE  86           HE1      PHE  86 -12.617   5.298  -1.696
  636    HE2  PHE  86           HE2      PHE  86 -11.934   2.835   1.719
  637    HZ   PHE  86           HZ       PHE  86 -13.196   3.322  -0.338
  638    H    VAL  87           H        VAL  87  -6.675   8.072  -0.953
  639    HA   VAL  87           HA       VAL  87  -4.855   8.717   1.266
  640    HB   VAL  87           HB       VAL  87  -3.279   9.550  -0.489
  641   HG11  VAL  87          HG11      VAL  87  -4.068   6.648  -0.663
  642   HG12  VAL  87          HG12      VAL  87  -2.995   7.365   0.540
  643   HG13  VAL  87          HG13      VAL  87  -2.518   7.326  -1.158
  644   HG21  VAL  87          HG21      VAL  87  -3.600   8.835  -2.796
  645   HG22  VAL  87          HG22      VAL  87  -4.903   9.907  -2.283
  646   HG23  VAL  87          HG23      VAL  87  -5.178   8.169  -2.379
  647    H    LYS  88           H        LYS  88  -4.318  10.793   1.687
  648    HA   LYS  88           HA       LYS  88  -6.368  12.737   1.179
  649    HB2  LYS  88           HB3      LYS  88  -4.871  14.152   2.704
  650    HB3  LYS  88           HB2      LYS  88  -5.583  12.701   3.400
  651    HG2  LYS  88           HG3      LYS  88  -3.418  11.526   2.938
  652    HG3  LYS  88           HG2      LYS  88  -2.745  13.087   2.476
  653    HD2  LYS  88           HD3      LYS  88  -3.156  13.964   4.663
  654    HD3  LYS  88           HD2      LYS  88  -3.993  12.489   5.149
  655    HE2  LYS  88           HE3      LYS  88  -1.822  11.274   4.647
  656    HE3  LYS  88           HE2      LYS  88  -1.073  12.867   4.542
  657    HZ1  LYS  88           HZ1      LYS  88  -0.795  11.954   6.741
  658    HZ2  LYS  88           HZ2      LYS  88  -2.465  11.738   6.913
  659    HZ3  LYS  88           HZ3      LYS  88  -1.816  13.298   6.823
  660    H    ALA  89           H        ALA  89  -6.327  13.565  -0.809
  661    HA   ALA  89           HA       ALA  89  -3.841  14.885  -1.683
  662    HB1  ALA  89           HB1      ALA  89  -4.196  12.829  -2.979
  663    HB2  ALA  89           HB2      ALA  89  -4.331  14.274  -3.983
  664    HB3  ALA  89           HB3      ALA  89  -5.785  13.421  -3.466
  665    H    LEU  90           H        LEU  90  -4.103  16.844  -2.771
  666    HA   LEU  90           HA       LEU  90  -6.521  18.265  -2.214
  667    HB2  LEU  90           HB3      LEU  90  -4.239  19.309  -2.205
  668    HB3  LEU  90           HB2      LEU  90  -4.200  19.117  -3.953
  669    HG   LEU  90           HG       LEU  90  -6.320  20.542  -4.007
  670   HD11  LEU  90          HD11      LEU  90  -6.946  20.373  -1.684
  671   HD12  LEU  90          HD12      LEU  90  -6.613  22.055  -2.092
  672   HD13  LEU  90          HD13      LEU  90  -5.426  21.115  -1.190
  673   HD21  LEU  90          HD21      LEU  90  -4.177  21.396  -4.731
  674   HD22  LEU  90          HD22      LEU  90  -3.725  21.750  -3.064
  675   HD23  LEU  90          HD23      LEU  90  -5.045  22.636  -3.827
  676    H    THR  91           H        THR  91  -8.284  17.984  -3.378
  677    HA   THR  91           HA       THR  91  -8.022  17.657  -6.292
  678    HB   THR  91           HB       THR  91  -9.946  16.099  -6.242
  679    HG1  THR  91           HG1      THR  91  -9.602  16.303  -3.419
  680   HG21  THR  91          HG21      THR  91  -8.780  14.151  -5.305
  681   HG22  THR  91          HG22      THR  91  -7.645  15.225  -4.490
  682   HG23  THR  91          HG23      THR  91  -7.688  15.158  -6.249
  683    H    THR  92           H        THR  92  -9.954  18.353  -7.482
  684    HA   THR  92           HA       THR  92 -11.614  20.193  -5.905
  685    HB   THR  92           HB       THR  92 -10.123  21.503  -7.319
  686    HG1  THR  92           HG1      THR  92 -12.232  22.302  -7.026
  687   HG21  THR  92          HG21      THR  92  -9.729  19.825  -9.080
  688   HG22  THR  92          HG22      THR  92 -10.185  21.394  -9.739
  689   HG23  THR  92          HG23      THR  92 -11.369  20.090  -9.675
  690    H    ASP  93           H        ASP  93 -13.674  19.692  -5.865
  691    HA   ASP  93           HA       ASP  93 -14.673  17.539  -7.498
  692    HB2  ASP  93           HB3      ASP  93 -16.666  17.665  -6.139
  693    HB3  ASP  93           HB2      ASP  93 -15.270  17.825  -5.079
  694    H    GLU  94           H        GLU  94 -14.676  20.958  -7.600
  695    HA   GLU  94           HA       GLU  94 -16.045  21.006 -10.105
  696    HB2  GLU  94           HB3      GLU  94 -17.948  20.880  -8.486
  697    HB3  GLU  94           HB2      GLU  94 -17.390  22.382  -7.770
  698    HG2  GLU  94           HG3      GLU  94 -17.724  23.501  -9.938
  699    HG3  GLU  94           HG2      GLU  94 -18.382  22.001 -10.580
  700    H    LYS  95           H        LYS  95 -15.610  23.292  -7.387
  701    HA   LYS  95           HA       LYS  95 -14.016  24.971  -9.211
  702    HB2  LYS  95           HB3      LYS  95 -15.888  25.882  -7.016
  703    HB3  LYS  95           HB2      LYS  95 -14.897  26.935  -8.012
  704    HG2  LYS  95           HG3      LYS  95 -16.133  26.203  -9.995
  705    HG3  LYS  95           HG2      LYS  95 -17.138  25.174  -8.976
  706    HD2  LYS  95           HD3      LYS  95 -17.870  27.171  -7.732
  707    HD3  LYS  95           HD2      LYS  95 -16.912  28.174  -8.823
  708    HE2  LYS  95           HE3      LYS  95 -18.238  27.357 -10.714
  709    HE3  LYS  95           HE2      LYS  95 -19.212  26.397  -9.603
  710    HZ1  LYS  95           HZ1      LYS  95 -19.881  28.457  -8.501
  711    HZ2  LYS  95           HZ2      LYS  95 -20.326  28.448 -10.132
  712    HZ3  LYS  95           HZ3      LYS  95 -18.994  29.356  -9.626
  713    H    GLN  96           H        GLN  96 -14.647  24.336  -5.766
  714    HA   GLN  96           HA       GLN  96 -12.202  25.614  -4.979
  715    HB2  GLN  96           HB3      GLN  96 -14.231  24.025  -3.404
  716    HB3  GLN  96           HB2      GLN  96 -12.854  24.855  -2.691
  717    HG2  GLN  96           HG3      GLN  96 -15.083  26.160  -4.234
  718    HG3  GLN  96           HG2      GLN  96 -14.909  26.145  -2.481
  719   HE21  GLN  96          HE21      GLN  96 -14.987  28.370  -4.393
  720   HE22  GLN  96          HE22      GLN  96 -13.536  29.267  -4.123
  721    H    ALA  97           H        ALA  97 -10.437  24.651  -3.965
  722    HA   ALA  97           HA       ALA  97 -10.031  21.825  -4.647
  723    HB1  ALA  97           HB1      ALA  97  -7.646  22.273  -4.392
  724    HB2  ALA  97           HB2      ALA  97  -7.998  23.930  -3.900
  725    HB3  ALA  97           HB3      ALA  97  -8.372  23.399  -5.540
  726    H    ALA  98           H        ALA  98  -9.932  20.337  -3.075
  727    HA   ALA  98           HA       ALA  98  -9.517  21.228  -0.309
  728    HB1  ALA  98           HB1      ALA  98 -11.389  19.827   0.436
  729    HB2  ALA  98           HB2      ALA  98 -11.766  19.446  -1.244
  730    HB3  ALA  98           HB3      ALA  98 -11.928  21.100  -0.658
  731    H    TRP  99           H        TRP  99  -8.596  19.705   1.051
  732    HA   TRP  99           HA       TRP  99  -7.136  17.580  -0.232
  733    HB2  TRP  99           HB3      TRP  99  -7.345  18.365   2.689
  734    HB3  TRP  99           HB2      TRP  99  -6.239  17.158   2.048
  735    HD1  TRP  99           HD1      TRP  99  -6.821  20.943   2.106
  736    HE1  TRP  99           HE1      TRP  99  -4.637  22.127   1.421
  737    HE3  TRP  99           HE3      TRP  99  -4.082  16.850   0.739
  738    HZ2  TRP  99           HZ2      TRP  99  -2.095  21.414   0.433
  739    HZ3  TRP  99           HZ3      TRP  99  -1.777  17.191  -0.065
  740    HH2  TRP  99           HH2      TRP  99  -0.809  19.425  -0.213
  741    H    ARG 100           H        ARG 100  -8.467  16.029  -0.926
  742    HA   ARG 100           HA       ARG 100 -10.495  14.948   0.913
  743    HB2  ARG 100           HB3      ARG 100 -10.245  14.718  -2.098
  744    HB3  ARG 100           HB2      ARG 100 -11.540  14.023  -1.135
  745    HG2  ARG 100           HG3      ARG 100 -10.961  16.973  -1.295
  746    HG3  ARG 100           HG2      ARG 100 -12.122  16.132  -2.323
  747    HD2  ARG 100           HD3      ARG 100 -12.215  16.324   0.688
  748    HD3  ARG 100           HD2      ARG 100 -13.246  17.193  -0.443
  749    HE   ARG 100           HE       ARG 100 -13.315  14.291  -0.644
  750   HH11  ARG 100          HH11      ARG 100 -14.793  17.196   0.664
  751   HH12  ARG 100          HH12      ARG 100 -16.316  16.429   0.974
  752   HH21  ARG 100          HH21      ARG 100 -15.317  13.277  -0.211
  753   HH22  ARG 100          HH22      ARG 100 -16.611  14.207   0.496
  754    H    PHE 101           H        PHE 101 -10.836  12.616   0.840
  755    HA   PHE 101           HA       PHE 101  -8.311  11.178   0.489
  756    HB2  PHE 101           HB3      PHE 101 -10.841  10.445   1.990
  757    HB3  PHE 101           HB2      PHE 101  -9.477   9.355   1.788
  758    HD1  PHE 101           HD1      PHE 101 -10.585  12.505   3.360
  759    HD2  PHE 101           HD2      PHE 101  -7.497   9.588   3.066
  760    HE1  PHE 101           HE1      PHE 101  -9.502  13.452   5.353
  761    HE2  PHE 101           HE2      PHE 101  -6.411  10.532   5.058
  762    HZ   PHE 101           HZ       PHE 101  -7.412  12.467   6.204
  763    H    ILE 102           H        ILE 102  -8.047  10.258  -1.416
  764    HA   ILE 102           HA       ILE 102 -10.440   9.348  -2.887
  765    HB   ILE 102           HB       ILE 102  -9.059   9.654  -4.957
  766   HG12  ILE 102          HG13      ILE 102  -7.196  11.161  -3.112
  767   HG13  ILE 102          HG12      ILE 102  -6.845   9.588  -3.817
  768   HG21  ILE 102          HG21      ILE 102  -9.544  12.105  -3.274
  769   HG22  ILE 102          HG22      ILE 102 -10.708  11.305  -4.331
  770   HG23  ILE 102          HG23      ILE 102  -9.293  12.099  -5.019
  771   HD11  ILE 102          HD11      ILE 102  -7.275  12.156  -5.328
  772   HD12  ILE 102          HD12      ILE 102  -6.948  10.581  -6.050
  773   HD13  ILE 102          HD13      ILE 102  -5.730  11.355  -5.035
  774    H    ARG 103           H        ARG 103 -10.358   7.407  -4.023
  775    HA   ARG 103           HA       ARG 103  -8.673   5.434  -2.776
  776    HB2  ARG 103           HB3      ARG 103  -9.897   3.799  -4.208
  777    HB3  ARG 103           HB2      ARG 103 -10.955   4.797  -3.219
  778    HG2  ARG 103           HG3      ARG 103 -11.909   5.785  -5.007
  779    HG3  ARG 103           HG2      ARG 103 -10.413   5.793  -5.937
  780    HD2  ARG 103           HD3      ARG 103 -12.013   3.294  -5.404
  781    HD3  ARG 103           HD2      ARG 103 -12.244   4.306  -6.834
  782    HE   ARG 103           HE       ARG 103  -9.539   3.337  -6.330
  783   HH11  ARG 103          HH11      ARG 103 -12.538   2.958  -8.097
  784   HH12  ARG 103          HH12      ARG 103 -11.824   2.004  -9.356
  785   HH21  ARG 103          HH21      ARG 103  -8.584   2.070  -8.014
  786   HH22  ARG 103          HH22      ARG 103  -9.591   1.520  -9.321
  787    H    ILE 104           H        ILE 104  -6.669   5.126  -3.388
  788    HA   ILE 104           HA       ILE 104  -6.145   4.925  -6.279
  789    HB   ILE 104           HB       ILE 104  -3.765   5.271  -5.810
  790   HG12  ILE 104          HG13      ILE 104  -4.563   5.941  -2.979
  791   HG13  ILE 104          HG12      ILE 104  -3.887   4.387  -3.447
  792   HG21  ILE 104          HG21      ILE 104  -5.104   7.200  -6.395
  793   HG22  ILE 104          HG22      ILE 104  -3.855   7.654  -5.236
  794   HG23  ILE 104          HG23      ILE 104  -5.523   7.449  -4.700
  795   HD11  ILE 104          HD11      ILE 104  -1.853   5.491  -4.193
  796   HD12  ILE 104          HD12      ILE 104  -2.198   5.848  -2.502
  797   HD13  ILE 104          HD13      ILE 104  -2.535   7.054  -3.744
  798    H    ASP 105           H        ASP 105  -4.927   3.144  -6.976
  799    HA   ASP 105           HA       ASP 105  -5.333   0.780  -5.354
  800    HB2  ASP 105           HB3      ASP 105  -4.323   1.208  -8.179
  801    HB3  ASP 105           HB2      ASP 105  -4.412  -0.381  -7.419
  802    H    THR 106           H        THR 106  -3.851   0.285  -3.854
  803    HA   THR 106           HA       THR 106  -1.233   1.563  -4.157
  804    HB   THR 106           HB       THR 106  -2.389   2.088  -2.091
  805    HG1  THR 106           HG1      THR 106   0.035   0.761  -2.138
  806   HG21  THR 106          HG21      THR 106  -2.322  -0.883  -1.557
  807   HG22  THR 106          HG22      THR 106  -3.757   0.112  -1.807
  808   HG23  THR 106          HG23      THR 106  -2.761   0.347  -0.373
  809    H    ALA 107           H        ALA 107  -2.615  -1.618  -4.137
  810    HA   ALA 107           HA       ALA 107  -0.036  -2.771  -4.681
  811    HB1  ALA 107           HB1      ALA 107  -0.053  -4.365  -2.830
  812    HB2  ALA 107           HB2      ALA 107  -1.497  -3.597  -2.175
  813    HB3  ALA 107           HB3      ALA 107   0.023  -2.706  -2.238
  814    H    CYS 108           H        CYS 108  -0.194  -5.056  -5.242
  815    HA   CYS 108           HA       CYS 108  -2.885  -5.749  -6.211
  816    HB2  CYS 108           HB3      CYS 108  -1.178  -5.484  -7.988
  817    HB3  CYS 108           HB2      CYS 108  -0.179  -6.705  -7.198
  818    H    VAL 109           H        VAL 109  -3.879  -7.271  -5.059
  819    HA   VAL 109           HA       VAL 109  -2.190  -9.106  -3.487
  820    HB   VAL 109           HB       VAL 109  -3.933  -9.167  -1.786
  821   HG11  VAL 109          HG11      VAL 109  -2.214  -7.476  -1.551
  822   HG12  VAL 109          HG12      VAL 109  -3.757  -6.863  -0.955
  823   HG13  VAL 109          HG13      VAL 109  -3.155  -6.352  -2.532
  824   HG21  VAL 109          HG21      VAL 109  -5.873  -7.679  -1.875
  825   HG22  VAL 109          HG22      VAL 109  -5.887  -8.826  -3.216
  826   HG23  VAL 109          HG23      VAL 109  -5.402  -7.154  -3.492
  827    H    CYS 110           H        CYS 110  -2.776 -11.256  -3.370
  828    HA   CYS 110           HA       CYS 110  -4.628 -12.187  -5.403
  829    HB2  CYS 110           HB3      CYS 110  -2.675 -13.621  -3.603
  830    HB3  CYS 110           HB2      CYS 110  -3.811 -14.472  -4.637
  831    H    VAL 111           H        VAL 111  -6.691 -12.317  -4.914
  832    HA   VAL 111           HA       VAL 111  -7.498 -12.638  -2.126
  833    HB   VAL 111           HB       VAL 111  -9.793 -12.236  -2.961
  834   HG11  VAL 111          HG11      VAL 111  -9.468  -9.894  -3.624
  835   HG12  VAL 111          HG12      VAL 111  -7.753 -10.215  -3.883
  836   HG13  VAL 111          HG13      VAL 111  -8.441 -10.341  -2.262
  837   HG21  VAL 111          HG21      VAL 111  -8.486 -11.864  -5.649
  838   HG22  VAL 111          HG22      VAL 111 -10.188 -11.612  -5.263
  839   HG23  VAL 111          HG23      VAL 111  -9.497 -13.234  -5.189
  840    H    LEU 112           H        LEU 112  -8.751 -14.360  -1.354
  841    HA   LEU 112           HA       LEU 112  -8.605 -16.766  -3.044
  842    HB2  LEU 112           HB3      LEU 112  -8.791 -16.490  -0.040
  843    HB3  LEU 112           HB2      LEU 112  -8.817 -18.018  -0.897
  844    HG   LEU 112           HG       LEU 112  -6.500 -16.076  -0.792
  845   HD11  LEU 112          HD11      LEU 112  -6.844 -17.283   1.293
  846   HD12  LEU 112          HD12      LEU 112  -5.402 -17.869   0.465
  847   HD13  LEU 112          HD13      LEU 112  -6.889 -18.814   0.417
  848   HD21  LEU 112          HD21      LEU 112  -6.579 -17.200  -2.947
  849   HD22  LEU 112          HD22      LEU 112  -6.741 -18.761  -2.146
  850   HD23  LEU 112          HD23      LEU 112  -5.255 -17.830  -1.970
  851    H    SER 113           H        SER 113 -10.374 -17.920  -3.525
  852    HA   SER 113           HA       SER 113 -12.862 -17.347  -2.064
  853    HB2  SER 113           HB3      SER 113 -12.855 -16.249  -4.326
  854    HB3  SER 113           HB2      SER 113 -12.695 -17.849  -5.048
  855    HG   SER 113           HG       SER 113 -14.833 -16.981  -3.383
  856    H    ARG 114           H        ARG 114 -14.251 -19.120  -1.820
  857    HA   ARG 114           HA       ARG 114 -12.842 -21.603  -1.532
  858    HB2  ARG 114           HB3      ARG 114 -14.402 -20.796   0.180
  859    HB3  ARG 114           HB2      ARG 114 -15.726 -20.873  -0.968
  860    HG2  ARG 114           HG3      ARG 114 -15.798 -22.745   0.570
  861    HG3  ARG 114           HG2      ARG 114 -15.499 -23.303  -1.076
  862    HD2  ARG 114           HD3      ARG 114 -14.055 -24.530   0.358
  863    HD3  ARG 114           HD2      ARG 114 -13.059 -23.367  -0.511
  864    HE   ARG 114           HE       ARG 114 -13.794 -22.161   1.871
  865   HH11  ARG 114          HH11      ARG 114 -11.972 -24.970   0.858
  866   HH12  ARG 114          HH12      ARG 114 -10.942 -24.963   2.251
  867   HH21  ARG 114          HH21      ARG 114 -12.447 -22.161   3.721
  868   HH22  ARG 114          HH22      ARG 114 -11.203 -23.359   3.873
  869    H    LYS 115           H        LYS 115 -13.972 -20.351  -4.225
  870    HA   LYS 115           HA       LYS 115 -14.616 -21.132  -6.262
  871    HB2  LYS 115           HB3      LYS 115 -14.104 -23.887  -5.110
  872    HB3  LYS 115           HB2      LYS 115 -14.193 -23.469  -6.814
  873    HG2  LYS 115           HG3      LYS 115 -12.184 -22.066  -6.542
  874    HG3  LYS 115           HG2      LYS 115 -12.092 -22.576  -4.854
  875    HD2  LYS 115           HD3      LYS 115 -10.578 -23.918  -6.152
  876    HD3  LYS 115           HD2      LYS 115 -11.920 -24.924  -5.613
  877    HE2  LYS 115           HE3      LYS 115 -12.985 -24.650  -7.803
  878    HE3  LYS 115           HE2      LYS 115 -11.616 -23.682  -8.340
  879    HZ1  LYS 115           HZ1      LYS 115 -11.537 -26.535  -7.524
  880    HZ2  LYS 115           HZ2      LYS 115 -10.184 -25.613  -7.960
  881    HZ3  LYS 115           HZ3      LYS 115 -11.391 -25.937  -9.100
  882    H    ALA 116           H        ALA 116 -16.541 -20.677  -4.211
  883    HA   ALA 116           HA       ALA 116 -18.760 -22.223  -5.278
  884    HB1  ALA 116           HB1      ALA 116 -18.182 -22.101  -2.319
  885    HB2  ALA 116           HB2      ALA 116 -18.026 -23.528  -3.342
  886    HB3  ALA 116           HB3      ALA 116 -19.612 -22.809  -3.068
  887    H    THR 117           H        THR 117 -20.579 -21.036  -5.415
  888    HA   THR 117           HA       THR 117 -20.409 -18.250  -4.629
  889    HB   THR 117           HB       THR 117 -22.669 -18.174  -5.864
  890    HG1  THR 117           HG1      THR 117 -23.385 -20.121  -6.316
  891   HG21  THR 117          HG21      THR 117 -21.564 -18.185  -8.067
  892   HG22  THR 117          HG22      THR 117 -20.163 -18.979  -7.350
  893   HG23  THR 117          HG23      THR 117 -20.599 -17.344  -6.856
  894    H    ARG 118           H        ARG 118 -22.086 -17.191  -3.448
  895    HA   ARG 118           HA       ARG 118 -23.192 -18.866  -1.341
  896    HB2  ARG 118           HB3      ARG 118 -22.003 -16.471  -1.186
  897    HB3  ARG 118           HB2      ARG 118 -23.640 -15.911  -1.458
  898    HG2  ARG 118           HG3      ARG 118 -22.816 -17.739   0.788
  899    HG3  ARG 118           HG2      ARG 118 -22.961 -15.990   0.921
  900    HD2  ARG 118           HD3      ARG 118 -24.986 -16.747   1.765
  901    HD3  ARG 118           HD2      ARG 118 -25.382 -16.351   0.095
  902    HE   ARG 118           HE       ARG 118 -24.650 -19.057   0.238
  903   HH11  ARG 118          HH11      ARG 118 -27.214 -16.915   1.266
  904   HH12  ARG 118          HH12      ARG 118 -28.435 -18.146   1.225
  905   HH21  ARG 118          HH21      ARG 118 -26.254 -20.693   0.192
  906   HH22  ARG 118          HH22      ARG 118 -27.885 -20.301   0.629
  907    H1   SER   1           H1       SER   1 -28.981   0.390  -3.907
  908    H2   SER   1           H2       SER   1 -29.052   1.896  -4.670
  909    H3   SER   1           H3       SER   1 -28.147   1.704  -3.255
  910    HA   SER   1           HA       SER   1 -27.588   0.365  -5.824
  911    HB2  SER   1           HB3      SER   1 -26.133   2.669  -4.503
  912    HB3  SER   1           HB2      SER   1 -25.718   1.915  -6.042
  913    HG   SER   1           HG       SER   1 -27.339   2.917  -6.998
  914    H    SER   2           H        SER   2 -27.247  -1.628  -4.848
  915    HA   SER   2           HA       SER   2 -24.709  -1.810  -3.423
  916    HB2  SER   2           HB3      SER   2 -25.770  -3.557  -1.885
  917    HB3  SER   2           HB2      SER   2 -26.202  -1.876  -1.569
  918    HG   SER   2           HG       SER   2 -28.127  -2.258  -2.806
  919    H    THR   3           H        THR   3 -23.512  -3.535  -4.039
  920    HA   THR   3           HA       THR   3 -24.687  -5.832  -5.296
  921    HB   THR   3           HB       THR   3 -24.676  -4.215  -7.183
  922    HG1  THR   3           HG1      THR   3 -23.466  -5.629  -8.615
  923   HG21  THR   3          HG21      THR   3 -21.684  -4.244  -6.778
  924   HG22  THR   3          HG22      THR   3 -22.757  -2.860  -6.576
  925   HG23  THR   3          HG23      THR   3 -22.512  -3.559  -8.176
  926    H    HIS   4           H        HIS   4 -23.047  -7.469  -5.795
  927    HA   HIS   4           HA       HIS   4 -20.431  -6.961  -4.611
  928    HB2  HIS   4           HB3      HIS   4 -20.610  -9.190  -3.372
  929    HB3  HIS   4           HB2      HIS   4 -21.487  -7.828  -2.692
  930    HD1  HIS   4           HD1      HIS   4 -24.037  -7.972  -2.629
  931    HD2  HIS   4           HD2      HIS   4 -22.234 -11.266  -4.414
  932    HE1  HIS   4           HE1      HIS   4 -25.842  -9.708  -2.823
  933    HE2  HIS   4           HE2      HIS   4 -24.766 -11.637  -4.027
  934    HA   PRO   5           HA       PRO   5 -20.043  -9.432  -8.497
  935    HB2  PRO   5           HB3      PRO   5 -17.792  -7.623  -8.969
  936    HB3  PRO   5           HB2      PRO   5 -19.192  -7.944  -9.995
  937    HG2  PRO   5           HG3      PRO   5 -18.837  -5.587  -8.713
  938    HG3  PRO   5           HG2      PRO   5 -20.444  -6.265  -9.033
  939    HD2  PRO   5           HD3      PRO   5 -18.852  -6.275  -6.491
  940    HD3  PRO   5           HD2      PRO   5 -20.594  -6.020  -6.732
  941    H    VAL   6           H        VAL   6 -19.377 -10.697  -6.413
  942    HA   VAL   6           HA       VAL   6 -17.963 -12.222  -5.534
  943    HB   VAL   6           HB       VAL   6 -15.913 -11.324  -7.563
  944   HG11  VAL   6          HG11      VAL   6 -14.955 -13.553  -7.235
  945   HG12  VAL   6          HG12      VAL   6 -16.169 -13.888  -5.999
  946   HG13  VAL   6          HG13      VAL   6 -14.967 -12.625  -5.735
  947   HG21  VAL   6          HG21      VAL   6 -17.983 -13.508  -7.764
  948   HG22  VAL   6          HG22      VAL   6 -16.691 -13.208  -8.929
  949   HG23  VAL   6          HG23      VAL   6 -17.959 -12.003  -8.685
  950    H    PHE   7           H        PHE   7 -17.335  -8.927  -5.614
  951    HA   PHE   7           HA       PHE   7 -14.925  -8.899  -4.066
  952    HB2  PHE   7           HB3      PHE   7 -16.893  -6.699  -4.706
  953    HB3  PHE   7           HB2      PHE   7 -15.382  -6.449  -3.847
  954    HD1  PHE   7           HD1      PHE   7 -13.301  -7.626  -5.172
  955    HD2  PHE   7           HD2      PHE   7 -16.876  -6.102  -6.907
  956    HE1  PHE   7           HE1      PHE   7 -12.129  -7.323  -7.307
  957    HE2  PHE   7           HE2      PHE   7 -15.711  -5.798  -9.050
  958    HZ   PHE   7           HZ       PHE   7 -13.335  -6.408  -9.255
  959    H    HIS   8           H        HIS   8 -17.503 -10.192  -3.080
  960    HA   HIS   8           HA       HIS   8 -16.887  -9.596  -0.323
  961    HB2  HIS   8           HB3      HIS   8 -18.845  -8.072  -1.026
  962    HB3  HIS   8           HB2      HIS   8 -19.796  -9.547  -1.154
  963    HD1  HIS   8           HD1      HIS   8 -17.964  -7.452   1.404
  964    HD2  HIS   8           HD2      HIS   8 -20.728 -10.555   1.244
  965    HE1  HIS   8           HE1      HIS   8 -18.813  -7.724   3.753
  966    HE2  HIS   8           HE2      HIS   8 -20.354  -9.712   3.658
  967    H    MET   9           H        MET   9 -16.652 -11.658  -2.411
  968    HA   MET   9           HA       MET   9 -18.015 -13.886  -1.054
  969    HB2  MET   9           HB3      MET   9 -17.722 -13.534  -4.049
  970    HB3  MET   9           HB2      MET   9 -18.412 -14.938  -3.253
  971    HG2  MET   9           HG3      MET   9 -20.326 -13.762  -2.590
  972    HG3  MET   9           HG2      MET   9 -19.573 -12.199  -2.892
  973    HE1  MET   9           HE1      MET   9 -19.206 -15.250  -5.271
  974    HE2  MET   9           HE2      MET   9 -20.599 -15.081  -6.341
  975    HE3  MET   9           HE3      MET   9 -20.835 -15.519  -4.650
  976    H    GLY  10           H        GLY  10 -15.435 -12.782  -3.184
  977    HA2  GLY  10           HA3      GLY  10 -13.789 -15.034  -2.223
  978    HA3  GLY  10           HA2      GLY  10 -13.787 -14.543  -3.910
  979    H    GLU  11           H        GLU  11 -13.865 -12.437  -1.088
  980    HA   GLU  11           HA       GLU  11 -11.314 -11.308  -2.006
  981    HB2  GLU  11           HB3      GLU  11 -12.178  -9.357  -0.416
  982    HB3  GLU  11           HB2      GLU  11 -12.650  -9.472  -2.107
  983    HG2  GLU  11           HG3      GLU  11 -14.549  -8.943  -0.683
  984    HG3  GLU  11           HG2      GLU  11 -14.760 -10.498  -1.481
  985    H    PHE  12           H        PHE  12 -11.658 -13.638  -0.299
  986    HA   PHE  12           HA       PHE  12 -10.912 -12.878   2.354
  987    HB2  PHE  12           HB3      PHE  12 -10.742 -15.530   0.901
  988    HB3  PHE  12           HB2      PHE  12 -10.315 -15.313   2.598
  989    HD1  PHE  12           HD1      PHE  12 -13.013 -15.677   0.209
  990    HD2  PHE  12           HD2      PHE  12 -12.050 -14.690   4.235
  991    HE1  PHE  12           HE1      PHE  12 -15.363 -16.021   0.855
  992    HE2  PHE  12           HE2      PHE  12 -14.398 -15.033   4.886
  993    HZ   PHE  12           HZ       PHE  12 -16.057 -15.701   3.194
  994    H    SER  13           H        SER  13  -9.008 -12.164   2.964
  995    HA   SER  13           HA       SER  13  -6.800 -12.125   1.137
  996    HB2  SER  13           HB3      SER  13  -5.665 -10.895   3.025
  997    HB3  SER  13           HB2      SER  13  -7.188 -10.176   2.516
  998    HG   SER  13           HG       SER  13  -6.479 -11.254   4.923
  999    H    VAL  14           H        VAL  14  -4.852 -13.186   1.318
 1000    HA   VAL  14           HA       VAL  14  -4.833 -15.787   2.359
 1001    HB   VAL  14           HB       VAL  14  -2.369 -15.743   1.879
 1002   HG11  VAL  14          HG11      VAL  14  -2.620 -15.482  -0.547
 1003   HG12  VAL  14          HG12      VAL  14  -4.179 -14.697  -0.296
 1004   HG13  VAL  14          HG13      VAL  14  -3.960 -16.388   0.158
 1005   HG21  VAL  14          HG21      VAL  14  -2.933 -12.904   1.025
 1006   HG22  VAL  14          HG22      VAL  14  -1.431 -13.785   0.757
 1007   HG23  VAL  14          HG23      VAL  14  -1.943 -13.395   2.399
 1008    H    CYS  15           H        CYS  15  -4.111 -12.795   3.846
 1009    HA   CYS  15           HA       CYS  15  -3.494 -14.165   6.345
 1010    HB2  CYS  15           HB3      CYS  15  -1.334 -13.450   5.233
 1011    HB3  CYS  15           HB2      CYS  15  -1.896 -11.783   5.362
 1012    H    ASP  16           H        ASP  16  -4.085 -12.899   8.207
 1013    HA   ASP  16           HA       ASP  16  -6.247 -11.063   7.603
 1014    HB2  ASP  16           HB3      ASP  16  -5.282 -12.380  10.122
 1015    HB3  ASP  16           HB2      ASP  16  -6.362 -10.994  10.214
 1016    H    SER  17           H        SER  17  -6.348  -8.921   8.065
 1017    HA   SER  17           HA       SER  17  -3.923  -7.626   9.061
 1018    HB2  SER  17           HB3      SER  17  -4.099  -5.995   7.133
 1019    HB3  SER  17           HB2      SER  17  -3.595  -7.627   6.679
 1020    HG   SER  17           HG       SER  17  -5.977  -6.270   6.149
 1021    H    VAL  18           H        VAL  18  -4.226  -5.554   9.907
 1022    HA   VAL  18           HA       VAL  18  -7.025  -4.683  10.142
 1023    HB   VAL  18           HB       VAL  18  -6.363  -5.538  12.287
 1024   HG11  VAL  18          HG11      VAL  18  -4.449  -4.639  13.538
 1025   HG12  VAL  18          HG12      VAL  18  -3.973  -3.713  12.114
 1026   HG13  VAL  18          HG13      VAL  18  -3.960  -5.475  12.064
 1027   HG21  VAL  18          HG21      VAL  18  -7.734  -3.541  12.326
 1028   HG22  VAL  18          HG22      VAL  18  -6.292  -2.526  12.289
 1029   HG23  VAL  18          HG23      VAL  18  -6.618  -3.543  13.693
 1030    H    SER  19           H        SER  19  -7.342  -2.819   9.145
 1031    HA   SER  19           HA       SER  19  -5.082  -1.050   8.630
 1032    HB2  SER  19           HB3      SER  19  -7.929  -0.963   7.597
 1033    HB3  SER  19           HB2      SER  19  -6.624   0.110   7.087
 1034    HG   SER  19           HG       SER  19  -5.504  -1.712   6.303
 1035    H    VAL  20           H        VAL  20  -4.717   0.720   9.785
 1036    HA   VAL  20           HA       VAL  20  -6.883   1.729  11.507
 1037    HB   VAL  20           HB       VAL  20  -3.914   1.701  12.068
 1038   HG11  VAL  20          HG11      VAL  20  -6.204   2.665  13.769
 1039   HG12  VAL  20          HG12      VAL  20  -4.947   3.660  13.033
 1040   HG13  VAL  20          HG13      VAL  20  -4.531   2.508  14.302
 1041   HG21  VAL  20          HG21      VAL  20  -4.898  -0.513  12.242
 1042   HG22  VAL  20          HG22      VAL  20  -6.150   0.113  13.315
 1043   HG23  VAL  20          HG23      VAL  20  -4.467   0.103  13.836
 1044    H    TRP  21           H        TRP  21  -7.300   3.857  11.450
 1045    HA   TRP  21           HA       TRP  21  -5.649   5.548   9.734
 1046    HB2  TRP  21           HB3      TRP  21  -8.402   5.924  10.926
 1047    HB3  TRP  21           HB2      TRP  21  -7.530   7.222  10.119
 1048    HD1  TRP  21           HD1      TRP  21  -9.568   4.111   9.419
 1049    HE1  TRP  21           HE1      TRP  21  -9.954   3.898   6.880
 1050    HE3  TRP  21           HE3      TRP  21  -6.360   7.758   7.803
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.011   5.109   4.514
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.161   8.162   5.383
 1053    HH2  TRP  21           HH2      TRP  21  -7.459   6.865   3.776
 1054    H    VAL  22           H        VAL  22  -3.912   6.071  10.914
 1055    HA   VAL  22           HA       VAL  22  -4.066   6.721  13.708
 1056    HB   VAL  22           HB       VAL  22  -1.761   7.087  11.787
 1057   HG11  VAL  22          HG11      VAL  22  -0.374   7.039  13.821
 1058   HG12  VAL  22          HG12      VAL  22  -1.842   6.999  14.796
 1059   HG13  VAL  22          HG13      VAL  22  -1.487   8.406  13.795
 1060   HG21  VAL  22          HG21      VAL  22  -0.926   4.956  12.663
 1061   HG22  VAL  22          HG22      VAL  22  -2.478   4.763  11.845
 1062   HG23  VAL  22          HG23      VAL  22  -2.403   4.771  13.608
 1063    H    GLY  23           H        GLY  23  -4.586   8.652  14.504
 1064    HA2  GLY  23           HA3      GLY  23  -4.455  10.963  12.676
 1065    HA3  GLY  23           HA2      GLY  23  -5.603  10.797  14.002
 1066    H    ASP  24           H        ASP  24  -2.582   9.692  14.936
 1067    HA   ASP  24           HA       ASP  24  -1.570  12.297  15.749
 1068    HB2  ASP  24           HB3      ASP  24  -2.535  10.209  17.696
 1069    HB3  ASP  24           HB2      ASP  24  -1.288  11.369  18.145
 1070    H    LYS  25           H        LYS  25  -0.440  10.628  13.907
 1071    HA   LYS  25           HA       LYS  25   1.545   8.929  15.048
 1072    HB2  LYS  25           HB3      LYS  25   0.661   8.829  12.673
 1073    HB3  LYS  25           HB2      LYS  25   1.626  10.258  12.337
 1074    HG2  LYS  25           HG3      LYS  25   3.657   9.055  12.842
 1075    HG3  LYS  25           HG2      LYS  25   2.728   7.624  13.296
 1076    HD2  LYS  25           HD3      LYS  25   1.817   7.574  10.975
 1077    HD3  LYS  25           HD2      LYS  25   2.917   8.891  10.567
 1078    HE2  LYS  25           HE3      LYS  25   3.896   6.785   9.885
 1079    HE3  LYS  25           HE2      LYS  25   4.823   7.461  11.228
 1080    HZ1  LYS  25           HZ1      LYS  25   4.445   5.090  11.504
 1081    HZ2  LYS  25           HZ2      LYS  25   2.766   5.319  11.450
 1082    HZ3  LYS  25           HZ3      LYS  25   3.672   5.958  12.732
 1083    H    THR  26           H        THR  26   3.606   9.432  15.730
 1084    HA   THR  26           HA       THR  26   4.109  12.315  15.926
 1085    HB   THR  26           HB       THR  26   3.802  11.131  18.063
 1086    HG1  THR  26           HG1      THR  26   5.132  12.952  18.102
 1087   HG21  THR  26          HG21      THR  26   4.697   8.953  17.499
 1088   HG22  THR  26          HG22      THR  26   5.568   9.616  18.879
 1089   HG23  THR  26          HG23      THR  26   6.304   9.641  17.277
 1090    H    THR  27           H        THR  27   5.628   9.295  14.933
 1091    HA   THR  27           HA       THR  27   7.780  10.868  13.733
 1092    HB   THR  27           HB       THR  27   9.355   8.937  14.441
 1093    HG1  THR  27           HG1      THR  27   8.048   8.705  16.826
 1094   HG21  THR  27          HG21      THR  27   8.411  10.982  16.448
 1095   HG22  THR  27          HG22      THR  27   9.625  11.237  15.194
 1096   HG23  THR  27          HG23      THR  27   9.943  10.112  16.514
 1097    H    ALA  28           H        ALA  28   8.695   9.996  11.904
 1098    HA   ALA  28           HA       ALA  28   7.938   7.309  11.075
 1099    HB1  ALA  28           HB1      ALA  28   7.357   9.701   9.334
 1100    HB2  ALA  28           HB2      ALA  28   6.145   8.751  10.192
 1101    HB3  ALA  28           HB3      ALA  28   7.104   8.007   8.913
 1102    H    THR  29           H        THR  29   9.064   6.780   8.964
 1103    HA   THR  29           HA       THR  29  11.719   8.033   8.976
 1104    HB   THR  29           HB       THR  29  10.953   5.313   7.900
 1105    HG1  THR  29           HG1      THR  29  10.992   5.902  10.355
 1106   HG21  THR  29          HG21      THR  29  12.935   6.276   6.832
 1107   HG22  THR  29          HG22      THR  29  13.377   4.921   7.872
 1108   HG23  THR  29          HG23      THR  29  13.651   6.576   8.417
 1109    H    ASP  30           H        ASP  30  12.131   9.345   7.378
 1110    HA   ASP  30           HA       ASP  30  10.504   9.617   5.059
 1111    HB2  ASP  30           HB3      ASP  30  11.765  11.504   6.037
 1112    HB3  ASP  30           HB2      ASP  30  13.282  10.689   5.652
 1113    H    ILE  31           H        ILE  31  11.301   9.385   2.835
 1114    HA   ILE  31           HA       ILE  31  12.125   6.777   2.279
 1115    HB   ILE  31           HB       ILE  31  10.800   8.139   0.726
 1116   HG12  ILE  31          HG13      ILE  31  13.426   7.295  -0.523
 1117   HG13  ILE  31          HG12      ILE  31  12.105   6.201  -0.131
 1118   HG21  ILE  31          HG21      ILE  31  13.348   9.688   0.277
 1119   HG22  ILE  31          HG22      ILE  31  11.887  10.281   1.065
 1120   HG23  ILE  31          HG23      ILE  31  11.856   9.866  -0.648
 1121   HD11  ILE  31          HD11      ILE  31  11.995   8.469  -2.103
 1122   HD12  ILE  31          HD12      ILE  31  10.666   7.381  -1.712
 1123   HD13  ILE  31          HD13      ILE  31  12.118   6.754  -2.492
 1124    H    LYS  32           H        LYS  32  14.001   9.591   2.953
 1125    HA   LYS  32           HA       LYS  32  16.426   8.594   1.735
 1126    HB2  LYS  32           HB3      LYS  32  16.022  10.880   3.668
 1127    HB3  LYS  32           HB2      LYS  32  17.469  10.575   2.715
 1128    HG2  LYS  32           HG3      LYS  32  14.752  11.221   1.588
 1129    HG3  LYS  32           HG2      LYS  32  16.069  12.372   1.787
 1130    HD2  LYS  32           HD3      LYS  32  17.447  11.028   0.261
 1131    HD3  LYS  32           HD2      LYS  32  16.100   9.909   0.059
 1132    HE2  LYS  32           HE3      LYS  32  14.739  11.674  -0.883
 1133    HE3  LYS  32           HE2      LYS  32  16.037  12.838  -0.633
 1134    HZ1  LYS  32           HZ1      LYS  32  17.405  11.618  -2.186
 1135    HZ2  LYS  32           HZ2      LYS  32  15.945  12.042  -2.924
 1136    HZ3  LYS  32           HZ3      LYS  32  16.196  10.455  -2.401
 1137    H    GLY  33           H        GLY  33  14.748   7.925   4.556
 1138    HA2  GLY  33           HA3      GLY  33  15.439   6.239   6.066
 1139    HA3  GLY  33           HA2      GLY  33  17.115   6.588   5.655
 1140    H    LYS  34           H        LYS  34  15.162   9.319   6.260
 1141    HA   LYS  34           HA       LYS  34  16.576   9.781   8.772
 1142    HB2  LYS  34           HB3      LYS  34  14.881  11.588   7.048
 1143    HB3  LYS  34           HB2      LYS  34  15.627  12.087   8.556
 1144    HG2  LYS  34           HG3      LYS  34  17.088  11.160   6.094
 1145    HG3  LYS  34           HG2      LYS  34  16.894  12.828   6.615
 1146    HD2  LYS  34           HD3      LYS  34  18.021  12.141   8.773
 1147    HD3  LYS  34           HD2      LYS  34  18.448  10.636   7.956
 1148    HE2  LYS  34           HE3      LYS  34  20.302  12.130   7.745
 1149    HE3  LYS  34           HE2      LYS  34  19.525  12.005   6.172
 1150    HZ1  LYS  34           HZ1      LYS  34  19.130  14.223   8.105
 1151    HZ2  LYS  34           HZ2      LYS  34  18.420  14.107   6.577
 1152    HZ3  LYS  34           HZ3      LYS  34  20.091  14.298   6.717
 1153    H    GLU  35           H        GLU  35  15.581   9.935  10.729
 1154    HA   GLU  35           HA       GLU  35  12.782   9.206  10.912
 1155    HB2  GLU  35           HB3      GLU  35  14.369   8.268  12.536
 1156    HB3  GLU  35           HB2      GLU  35  14.796   9.889  13.064
 1157    HG2  GLU  35           HG3      GLU  35  12.519  10.235  13.865
 1158    HG3  GLU  35           HG2      GLU  35  12.082   8.616  13.329
 1159    H    VAL  36           H        VAL  36  11.256  10.685  10.753
 1160    HA   VAL  36           HA       VAL  36  11.922  13.457  11.476
 1161    HB   VAL  36           HB       VAL  36  10.277  14.175   9.759
 1162   HG11  VAL  36          HG11      VAL  36  12.638  14.160   9.216
 1163   HG12  VAL  36          HG12      VAL  36  11.690  13.686   7.806
 1164   HG13  VAL  36          HG13      VAL  36  12.541  12.463   8.749
 1165   HG21  VAL  36          HG21      VAL  36   9.515  12.590   8.075
 1166   HG22  VAL  36          HG22      VAL  36   8.943  12.121   9.676
 1167   HG23  VAL  36          HG23      VAL  36  10.303  11.272   8.942
 1168    H    THR  37           H        THR  37  10.303  14.730  12.387
 1169    HA   THR  37           HA       THR  37   8.418  13.266  14.016
 1170    HB   THR  37           HB       THR  37   8.771  16.257  13.836
 1171    HG1  THR  37           HG1      THR  37  10.541  14.443  14.673
 1172   HG21  THR  37          HG21      THR  37   6.756  15.520  14.999
 1173   HG22  THR  37          HG22      THR  37   7.908  16.224  16.133
 1174   HG23  THR  37          HG23      THR  37   7.725  14.472  16.033
 1175    H    VAL  38           H        VAL  38   6.425  12.844  13.379
 1176    HA   VAL  38           HA       VAL  38   5.443  13.998  10.922
 1177    HB   VAL  38           HB       VAL  38   4.263  11.885  12.732
 1178   HG11  VAL  38          HG11      VAL  38   2.732  11.407  10.891
 1179   HG12  VAL  38          HG12      VAL  38   3.381  12.779   9.993
 1180   HG13  VAL  38          HG13      VAL  38   2.508  13.043  11.504
 1181   HG21  VAL  38          HG21      VAL  38   4.948  10.329  10.997
 1182   HG22  VAL  38          HG22      VAL  38   6.337  11.226  11.613
 1183   HG23  VAL  38          HG23      VAL  38   5.627  11.657  10.056
 1184    H    LEU  39           H        LEU  39   3.838  15.442  10.712
 1185    HA   LEU  39           HA       LEU  39   2.658  16.489  13.185
 1186    HB2  LEU  39           HB3      LEU  39   2.766  17.767  10.446
 1187    HB3  LEU  39           HB2      LEU  39   2.220  18.526  11.933
 1188    HG   LEU  39           HG       LEU  39   5.043  17.632  11.352
 1189   HD11  LEU  39          HD11      LEU  39   4.375  19.580  10.045
 1190   HD12  LEU  39          HD12      LEU  39   5.561  20.007  11.277
 1191   HD13  LEU  39          HD13      LEU  39   3.857  20.393  11.520
 1192   HD21  LEU  39          HD21      LEU  39   3.881  19.077  13.724
 1193   HD22  LEU  39          HD22      LEU  39   5.601  18.830  13.423
 1194   HD23  LEU  39          HD23      LEU  39   4.547  17.445  13.711
 1195    H    ALA  40           H        ALA  40   0.814  15.452  13.576
 1196    HA   ALA  40           HA       ALA  40  -0.849  14.264  11.626
 1197    HB1  ALA  40           HB1      ALA  40  -2.450  13.967  13.439
 1198    HB2  ALA  40           HB2      ALA  40  -1.541  15.098  14.442
 1199    HB3  ALA  40           HB3      ALA  40  -0.820  13.557  13.978
 1200    H    GLU  41           H        GLU  41  -0.657  17.401  13.048
 1201    HA   GLU  41           HA       GLU  41  -2.947  18.308  11.450
 1202    HB2  GLU  41           HB3      GLU  41  -1.475  19.691  13.703
 1203    HB3  GLU  41           HB2      GLU  41  -2.858  20.343  12.840
 1204    HG2  GLU  41           HG3      GLU  41  -4.292  18.657  13.715
 1205    HG3  GLU  41           HG2      GLU  41  -2.926  17.785  14.412
 1206    H    VAL  42           H        VAL  42  -2.523  19.472   9.664
 1207    HA   VAL  42           HA       VAL  42   0.274  19.982   9.078
 1208    HB   VAL  42           HB       VAL  42  -0.481  20.484   6.772
 1209   HG11  VAL  42          HG11      VAL  42  -1.451  17.866   7.904
 1210   HG12  VAL  42          HG12      VAL  42   0.183  18.230   7.350
 1211   HG13  VAL  42          HG13      VAL  42  -1.150  18.192   6.198
 1212   HG21  VAL  42          HG21      VAL  42  -2.723  21.329   7.294
 1213   HG22  VAL  42          HG22      VAL  42  -3.218  19.705   7.771
 1214   HG23  VAL  42          HG23      VAL  42  -2.770  20.033   6.098
 1215    H    ASN  43           H        ASN  43   1.184  21.854   9.299
 1216    HA   ASN  43           HA       ASN  43  -0.421  24.164   9.995
 1217    HB2  ASN  43           HB3      ASN  43   2.562  23.663   9.998
 1218    HB3  ASN  43           HB2      ASN  43   1.853  25.230  10.374
 1219   HD21  ASN  43          HD21      ASN  43   2.262  21.939  11.441
 1220   HD22  ASN  43          HD22      ASN  43   1.753  22.195  13.070
 1221    H    ILE  44           H        ILE  44  -1.356  24.908   8.207
 1222    HA   ILE  44           HA       ILE  44   0.415  25.857   6.047
 1223    HB   ILE  44           HB       ILE  44  -2.538  25.172   5.928
 1224   HG12  ILE  44          HG13      ILE  44  -0.190  23.760   4.639
 1225   HG13  ILE  44          HG12      ILE  44  -1.029  23.197   6.085
 1226   HG21  ILE  44          HG21      ILE  44  -2.368  25.564   3.532
 1227   HG22  ILE  44          HG22      ILE  44  -0.675  26.015   3.715
 1228   HG23  ILE  44          HG23      ILE  44  -1.936  27.017   4.435
 1229   HD11  ILE  44          HD11      ILE  44  -3.088  22.957   4.787
 1230   HD12  ILE  44          HD12      ILE  44  -1.774  21.993   4.114
 1231   HD13  ILE  44          HD13      ILE  44  -2.240  23.509   3.344
 1232    H    ASN  45           H        ASN  45   0.055  28.010   5.335
 1233    HA   ASN  45           HA       ASN  45  -0.615  29.851   7.330
 1234    HB2  ASN  45           HB3      ASN  45  -0.205  30.106   4.362
 1235    HB3  ASN  45           HB2      ASN  45  -0.770  31.488   5.299
 1236   HD21  ASN  45          HD21      ASN  45   1.897  29.369   4.635
 1237   HD22  ASN  45          HD22      ASN  45   3.085  30.258   5.520
 1238    H    ASN  46           H        ASN  46  -2.498  30.048   8.219
 1239    HA   ASN  46           HA       ASN  46  -4.686  30.525   8.548
 1240    HB2  ASN  46           HB3      ASN  46  -4.198  32.038   6.461
 1241    HB3  ASN  46           HB2      ASN  46  -5.184  30.858   5.610
 1242   HD21  ASN  46          HD21      ASN  46  -6.895  30.420   8.015
 1243   HD22  ASN  46          HD22      ASN  46  -7.914  31.814   8.093
 1244    H    SER  47           H        SER  47  -3.668  27.803   7.865
 1245    HA   SER  47           HA       SER  47  -6.278  26.578   7.825
 1246    HB2  SER  47           HB3      SER  47  -4.277  25.975   5.630
 1247    HB3  SER  47           HB2      SER  47  -5.696  24.990   5.971
 1248    HG   SER  47           HG       SER  47  -6.300  27.638   5.704
 1249    H    VAL  48           H        VAL  48  -6.142  25.302   9.553
 1250    HA   VAL  48           HA       VAL  48  -3.835  23.485   9.773
 1251    HB   VAL  48           HB       VAL  48  -5.196  24.834  12.115
 1252   HG11  VAL  48          HG11      VAL  48  -2.825  22.976  12.020
 1253   HG12  VAL  48          HG12      VAL  48  -4.429  22.591  12.643
 1254   HG13  VAL  48          HG13      VAL  48  -3.431  23.794  13.459
 1255   HG21  VAL  48          HG21      VAL  48  -2.427  25.286  11.013
 1256   HG22  VAL  48          HG22      VAL  48  -3.111  26.034  12.456
 1257   HG23  VAL  48          HG23      VAL  48  -3.787  26.398  10.869
 1258    H    PHE  49           H        PHE  49  -4.568  21.458   9.571
 1259    HA   PHE  49           HA       PHE  49  -6.964  20.649  10.981
 1260    HB2  PHE  49           HB3      PHE  49  -7.900  19.563   8.884
 1261    HB3  PHE  49           HB2      PHE  49  -8.033  21.314   8.973
 1262    HD1  PHE  49           HD1      PHE  49  -6.598  22.738   7.550
 1263    HD2  PHE  49           HD2      PHE  49  -6.590  18.493   7.215
 1264    HE1  PHE  49           HE1      PHE  49  -5.522  22.913   5.344
 1265    HE2  PHE  49           HE2      PHE  49  -5.508  18.668   5.014
 1266    HZ   PHE  49           HZ       PHE  49  -4.975  20.878   4.077
 1267    H    ARG  50           H        ARG  50  -7.275  18.326  10.999
 1268    HA   ARG  50           HA       ARG  50  -4.703  17.023  11.275
 1269    HB2  ARG  50           HB3      ARG  50  -7.488  16.033  11.924
 1270    HB3  ARG  50           HB2      ARG  50  -5.998  15.192  12.318
 1271    HG2  ARG  50           HG3      ARG  50  -5.339  16.990  13.792
 1272    HG3  ARG  50           HG2      ARG  50  -6.780  17.908  13.356
 1273    HD2  ARG  50           HD3      ARG  50  -7.234  16.870  15.437
 1274    HD3  ARG  50           HD2      ARG  50  -8.133  15.974  14.216
 1275    HE   ARG  50           HE       ARG  50  -5.516  14.974  15.097
 1276   HH11  ARG  50          HH11      ARG  50  -8.993  14.618  14.910
 1277   HH12  ARG  50          HH12      ARG  50  -8.992  12.985  15.488
 1278   HH21  ARG  50          HH21      ARG  50  -5.501  12.820  15.878
 1279   HH22  ARG  50          HH22      ARG  50  -7.004  11.965  16.058
 1280    H    GLN  51           H        GLN  51  -3.830  15.713   9.872
 1281    HA   GLN  51           HA       GLN  51  -5.519  14.569   7.742
 1282    HB2  GLN  51           HB3      GLN  51  -2.609  15.392   7.745
 1283    HB3  GLN  51           HB2      GLN  51  -3.343  14.446   6.458
 1284    HG2  GLN  51           HG3      GLN  51  -4.311  17.168   7.301
 1285    HG3  GLN  51           HG2      GLN  51  -3.159  16.889   5.995
 1286   HE21  GLN  51          HE21      GLN  51  -3.867  16.067   4.061
 1287   HE22  GLN  51          HE22      GLN  51  -5.541  15.901   3.662
 1288    H    TYR  52           H        TYR  52  -6.007  12.560   8.424
 1289    HA   TYR  52           HA       TYR  52  -4.416  11.088  10.247
 1290    HB2  TYR  52           HB3      TYR  52  -6.586   9.912   8.511
 1291    HB3  TYR  52           HB2      TYR  52  -6.101   9.419  10.129
 1292    HD1  TYR  52           HD1      TYR  52  -6.440  11.261  12.003
 1293    HD2  TYR  52           HD2      TYR  52  -8.448  11.240   8.250
 1294    HE1  TYR  52           HE1      TYR  52  -8.197  12.699  12.941
 1295    HE2  TYR  52           HE2      TYR  52 -10.207  12.674   9.181
 1296    HH   TYR  52           HH       TYR  52 -11.158  13.245  11.348
 1297    H    PHE  53           H        PHE  53  -3.779   8.775   9.826
 1298    HA   PHE  53           HA       PHE  53  -2.539   8.492   7.164
 1299    HB2  PHE  53           HB3      PHE  53  -1.360   7.684   9.837
 1300    HB3  PHE  53           HB2      PHE  53  -0.605   7.434   8.265
 1301    HD1  PHE  53           HD1      PHE  53   0.409   9.253   7.075
 1302    HD2  PHE  53           HD2      PHE  53  -1.501   9.897  10.818
 1303    HE1  PHE  53           HE1      PHE  53   1.445  11.476   7.216
 1304    HE2  PHE  53           HE2      PHE  53  -0.471  12.124  10.968
 1305    HZ   PHE  53           HZ       PHE  53   1.000  12.918   9.165
 1306    H    PHE  54           H        PHE  54  -2.722   6.538   6.195
 1307    HA   PHE  54           HA       PHE  54  -4.433   4.559   7.490
 1308    HB2  PHE  54           HB3      PHE  54  -5.031   5.340   5.224
 1309    HB3  PHE  54           HB2      PHE  54  -3.468   4.805   4.622
 1310    HD1  PHE  54           HD1      PHE  54  -6.724   3.678   5.926
 1311    HD2  PHE  54           HD2      PHE  54  -3.073   2.537   4.057
 1312    HE1  PHE  54           HE1      PHE  54  -7.690   1.482   5.385
 1313    HE2  PHE  54           HE2      PHE  54  -4.033   0.339   3.514
 1314    HZ   PHE  54           HZ       PHE  54  -6.342  -0.191   4.177
 1315    H    GLU  55           H        GLU  55  -3.206   3.272   8.796
 1316    HA   GLU  55           HA       GLU  55  -0.884   1.971   7.524
 1317    HB2  GLU  55           HB3      GLU  55  -1.209   2.590  10.473
 1318    HB3  GLU  55           HB2      GLU  55   0.165   1.780   9.731
 1319    HG2  GLU  55           HG3      GLU  55   0.385   3.952   8.331
 1320    HG3  GLU  55           HG2      GLU  55  -0.636   4.660   9.584
 1321    H    THR  56           H        THR  56  -1.097  -0.113   7.245
 1322    HA   THR  56           HA       THR  56  -3.172  -1.545   8.761
 1323    HB   THR  56           HB       THR  56  -1.918  -2.282   6.105
 1324    HG1  THR  56           HG1      THR  56  -3.349  -0.946   5.328
 1325   HG21  THR  56          HG21      THR  56  -4.260  -3.494   7.583
 1326   HG22  THR  56          HG22      THR  56  -2.676  -4.238   7.362
 1327   HG23  THR  56          HG23      THR  56  -3.717  -3.947   5.968
 1328    H    LYS  57           H        LYS  57  -2.586  -3.097  10.125
 1329    HA   LYS  57           HA       LYS  57   0.193  -4.074  10.007
 1330    HB2  LYS  57           HB3      LYS  57  -1.674  -3.806  12.376
 1331    HB3  LYS  57           HB2      LYS  57  -0.095  -4.577  12.442
 1332    HG2  LYS  57           HG3      LYS  57   0.934  -2.439  11.742
 1333    HG3  LYS  57           HG2      LYS  57  -0.658  -1.685  11.815
 1334    HD2  LYS  57           HD3      LYS  57   0.549  -1.222  13.851
 1335    HD3  LYS  57           HD2      LYS  57  -0.797  -2.303  14.203
 1336    HE2  LYS  57           HE3      LYS  57   0.708  -4.204  14.228
 1337    HE3  LYS  57           HE2      LYS  57   2.061  -3.164  13.794
 1338    HZ1  LYS  57           HZ1      LYS  57   2.010  -3.663  16.163
 1339    HZ2  LYS  57           HZ2      LYS  57   0.480  -2.954  16.297
 1340    HZ3  LYS  57           HZ3      LYS  57   1.815  -2.005  15.882
 1341    H    CYS  58           H        CYS  58   0.537  -6.300  10.628
 1342    HA   CYS  58           HA       CYS  58  -1.458  -8.035   9.491
 1343    HB2  CYS  58           HB3      CYS  58   1.179  -8.717  10.822
 1344    HB3  CYS  58           HB2      CYS  58   0.183  -9.830   9.894
 1345    H    ARG  59           H        ARG  59  -3.019  -9.047  10.566
 1346    HA   ARG  59           HA       ARG  59  -3.115  -8.943  13.455
 1347    HB2  ARG  59           HB3      ARG  59  -4.979  -9.946  11.325
 1348    HB3  ARG  59           HB2      ARG  59  -5.258 -10.334  13.013
 1349    HG2  ARG  59           HG3      ARG  59  -5.432  -7.977  13.549
 1350    HG3  ARG  59           HG2      ARG  59  -5.076  -7.556  11.874
 1351    HD2  ARG  59           HD3      ARG  59  -7.101  -8.543  11.112
 1352    HD3  ARG  59           HD2      ARG  59  -7.415  -9.269  12.684
 1353    HE   ARG  59           HE       ARG  59  -7.407  -6.691  13.320
 1354   HH11  ARG  59          HH11      ARG  59  -8.911  -8.334  10.620
 1355   HH12  ARG  59          HH12      ARG  59 -10.266  -7.257  10.555
 1356   HH21  ARG  59          HH21      ARG  59  -9.200  -5.265  13.236
 1357   HH22  ARG  59          HH22      ARG  59 -10.433  -5.520  12.045
 1358    H    ALA  60           H        ALA  60  -1.408 -10.228  14.114
 1359    HA   ALA  60           HA       ALA  60  -0.258 -12.104  14.670
 1360    HB1  ALA  60           HB1      ALA  60  -2.856 -13.519  14.069
 1361    HB2  ALA  60           HB2      ALA  60  -2.404 -12.814  15.620
 1362    HB3  ALA  60           HB3      ALA  60  -1.498 -14.183  14.977
 1363    H    SER  61           H        SER  61   1.172 -11.938  12.975
 1364    HA   SER  61           HA       SER  61   0.780 -12.588  10.326
 1365    HB2  SER  61           HB3      SER  61   3.334 -12.892  11.925
 1366    HB3  SER  61           HB2      SER  61   3.223 -12.768  10.170
 1367    HG   SER  61           HG       SER  61   2.635 -10.800  12.118
 1368    H    ASN  62           H        ASN  62   0.776 -14.369   9.133
 1369    HA   ASN  62           HA       ASN  62   0.797 -16.535   8.488
 1370    HB2  ASN  62           HB3      ASN  62   2.433 -16.968  10.997
 1371    HB3  ASN  62           HB2      ASN  62   2.126 -18.207   9.782
 1372   HD21  ASN  62          HD21      ASN  62   4.297 -18.445   9.255
 1373   HD22  ASN  62          HD22      ASN  62   5.180 -17.239   8.396
 1374    HA   PRO  63           HA       PRO  63  -2.917 -16.966  11.196
 1375    HB2  PRO  63           HB3      PRO  63  -4.493 -17.881   9.123
 1376    HB3  PRO  63           HB2      PRO  63  -4.318 -16.178   9.574
 1377    HG2  PRO  63           HG3      PRO  63  -2.966 -17.723   7.401
 1378    HG3  PRO  63           HG2      PRO  63  -3.593 -16.067   7.375
 1379    HD2  PRO  63           HD3      PRO  63  -0.960 -16.573   7.630
 1380    HD3  PRO  63           HD2      PRO  63  -1.729 -15.204   8.471
 1381    H    VAL  64           H        VAL  64  -1.395 -19.186   8.955
 1382    HA   VAL  64           HA       VAL  64  -2.486 -21.431  10.518
 1383    HB   VAL  64           HB       VAL  64  -2.179 -22.861   8.533
 1384   HG11  VAL  64          HG11      VAL  64  -4.360 -21.901   8.918
 1385   HG12  VAL  64          HG12      VAL  64  -4.030 -21.958   7.185
 1386   HG13  VAL  64          HG13      VAL  64  -3.895 -20.433   8.059
 1387   HG21  VAL  64          HG21      VAL  64  -1.715 -21.914   6.355
 1388   HG22  VAL  64          HG22      VAL  64  -0.385 -21.565   7.458
 1389   HG23  VAL  64          HG23      VAL  64  -1.556 -20.308   7.064
 1390    H    GLU  65           H        GLU  65  -1.024 -23.330  10.625
 1391    HA   GLU  65           HA       GLU  65   1.454 -22.430  11.695
 1392    HB2  GLU  65           HB3      GLU  65   0.337 -25.208  11.312
 1393    HB3  GLU  65           HB2      GLU  65   1.859 -24.878  12.121
 1394    HG2  GLU  65           HG3      GLU  65   0.156 -25.217  13.762
 1395    HG3  GLU  65           HG2      GLU  65   0.634 -23.523  13.784
 1396    H    SER  66           H        SER  66   0.580 -23.249   8.569
 1397    HA   SER  66           HA       SER  66   3.335 -23.958   7.852
 1398    HB2  SER  66           HB3      SER  66   0.830 -24.144   6.156
 1399    HB3  SER  66           HB2      SER  66   2.427 -24.765   5.742
 1400    HG   SER  66           HG       SER  66   0.797 -25.606   7.913
 1401    H    GLY  67           H        GLY  67   1.978 -21.242   8.457
 1402    HA2  GLY  67           HA3      GLY  67   3.067 -19.210   7.762
 1403    HA3  GLY  67           HA2      GLY  67   3.193 -19.889   6.140
 1404    H    CYS  68           H        CYS  68   1.656 -19.416   4.698
 1405    HA   CYS  68           HA       CYS  68  -0.699 -17.966   5.694
 1406    HB2  CYS  68           HB3      CYS  68   0.787 -17.731   3.069
 1407    HB3  CYS  68           HB2      CYS  68  -0.773 -16.960   3.379
 1408    H    ARG  69           H        ARG  69  -2.714 -18.383   4.775
 1409    HA   ARG  69           HA       ARG  69  -3.164 -21.157   4.441
 1410    HB2  ARG  69           HB3      ARG  69  -4.771 -19.767   5.603
 1411    HB3  ARG  69           HB2      ARG  69  -5.005 -18.771   4.171
 1412    HG2  ARG  69           HG3      ARG  69  -6.087 -20.576   3.023
 1413    HG3  ARG  69           HG2      ARG  69  -5.729 -21.690   4.345
 1414    HD2  ARG  69           HD3      ARG  69  -7.443 -19.216   4.564
 1415    HD3  ARG  69           HD2      ARG  69  -8.060 -20.860   4.391
 1416    HE   ARG  69           HE       ARG  69  -6.941 -21.336   6.555
 1417   HH11  ARG  69          HH11      ARG  69  -7.779 -18.030   5.742
 1418   HH12  ARG  69          HH12      ARG  69  -7.899 -17.526   7.395
 1419   HH21  ARG  69          HH21      ARG  69  -7.087 -20.668   8.726
 1420   HH22  ARG  69          HH22      ARG  69  -7.506 -19.025   9.095
 1421    H    GLY  70           H        GLY  70  -2.950 -22.304   2.643
 1422    HA2  GLY  70           HA3      GLY  70  -3.915 -22.734   0.442
 1423    HA3  GLY  70           HA2      GLY  70  -3.714 -21.023   0.092
 1424    H    ILE  71           H        ILE  71  -1.021 -21.075   1.403
 1425    HA   ILE  71           HA       ILE  71   0.448 -21.580  -1.003
 1426    HB   ILE  71           HB       ILE  71   1.418 -20.825   1.759
 1427   HG12  ILE  71          HG13      ILE  71  -0.055 -19.136   0.779
 1428   HG13  ILE  71          HG12      ILE  71   1.604 -18.554   0.826
 1429   HG21  ILE  71          HG21      ILE  71   2.880 -20.784  -0.880
 1430   HG22  ILE  71          HG22      ILE  71   3.199 -21.864   0.477
 1431   HG23  ILE  71          HG23      ILE  71   3.490 -20.132   0.641
 1432   HD11  ILE  71          HD11      ILE  71   1.833 -19.127  -1.562
 1433   HD12  ILE  71          HD12      ILE  71   0.577 -17.927  -1.254
 1434   HD13  ILE  71          HD13      ILE  71   0.135 -19.602  -1.582
 1435    H    ASP  72           H        ASP  72   1.646 -23.303  -1.549
 1436    HA   ASP  72           HA       ASP  72   1.637 -25.686   0.005
 1437    HB2  ASP  72           HB3      ASP  72   1.786 -25.766  -2.445
 1438    HB3  ASP  72           HB2      ASP  72   3.339 -24.937  -2.389
 1439    H    SER  73           H        SER  73   2.829 -26.053   1.739
 1440    HA   SER  73           HA       SER  73   5.012 -24.268   2.369
 1441    HB2  SER  73           HB3      SER  73   4.920 -25.640   4.564
 1442    HB3  SER  73           HB2      SER  73   3.552 -24.592   4.175
 1443    HG   SER  73           HG       SER  73   3.698 -27.352   4.304
 1444    H    LYS  74           H        LYS  74   4.990 -26.882   0.511
 1445    HA   LYS  74           HA       LYS  74   7.355 -28.132   1.693
 1446    HB2  LYS  74           HB3      LYS  74   5.721 -28.948  -0.716
 1447    HB3  LYS  74           HB2      LYS  74   7.070 -29.853  -0.046
 1448    HG2  LYS  74           HG3      LYS  74   5.791 -30.067   2.079
 1449    HG3  LYS  74           HG2      LYS  74   4.420 -29.310   1.266
 1450    HD2  LYS  74           HD3      LYS  74   5.775 -31.867   0.432
 1451    HD3  LYS  74           HD2      LYS  74   4.225 -31.747   1.262
 1452    HE2  LYS  74           HE3      LYS  74   3.352 -30.458  -0.664
 1453    HE3  LYS  74           HE2      LYS  74   4.888 -30.718  -1.490
 1454    HZ1  LYS  74           HZ1      LYS  74   4.499 -33.091  -1.409
 1455    HZ2  LYS  74           HZ2      LYS  74   3.214 -32.317  -2.186
 1456    HZ3  LYS  74           HZ3      LYS  74   3.037 -32.858  -0.594
 1457    H    HIS  75           H        HIS  75   6.264 -26.531  -1.259
 1458    HA   HIS  75           HA       HIS  75   8.999 -26.414  -2.273
 1459    HB2  HIS  75           HB3      HIS  75   6.370 -25.476  -3.446
 1460    HB3  HIS  75           HB2      HIS  75   7.927 -25.280  -4.244
 1461    HD1  HIS  75           HD1      HIS  75   8.744 -27.193  -5.616
 1462    HD2  HIS  75           HD2      HIS  75   5.602 -28.267  -3.118
 1463    HE1  HIS  75           HE1      HIS  75   8.113 -29.525  -6.292
 1464    HE2  HIS  75           HE2      HIS  75   6.096 -30.081  -4.894
 1465    H    TRP  76           H        TRP  76   6.620 -24.394  -0.752
 1466    HA   TRP  76           HA       TRP  76   8.487 -22.126  -0.882
 1467    HB2  TRP  76           HB3      TRP  76   5.468 -22.060  -1.132
 1468    HB3  TRP  76           HB2      TRP  76   6.469 -20.630  -0.897
 1469    HD1  TRP  76           HD1      TRP  76   5.178 -22.946  -3.550
 1470    HE1  TRP  76           HE1      TRP  76   6.009 -22.163  -5.854
 1471    HE3  TRP  76           HE3      TRP  76   8.640 -19.498  -2.041
 1472    HZ2  TRP  76           HZ2      TRP  76   7.883 -20.328  -6.894
 1473    HZ3  TRP  76           HZ3      TRP  76   9.908 -18.274  -3.754
 1474    HH2  TRP  76           HH2      TRP  76   9.535 -18.682  -6.131
 1475    H    ASN  77           H        ASN  77   8.503 -20.766   0.934
 1476    HA   ASN  77           HA       ASN  77   6.652 -21.490   3.101
 1477    HB2  ASN  77           HB3      ASN  77   8.267 -20.921   4.781
 1478    HB3  ASN  77           HB2      ASN  77   9.055 -22.036   3.682
 1479   HD21  ASN  77          HD21      ASN  77   8.959 -18.806   4.917
 1480   HD22  ASN  77          HD22      ASN  77  10.432 -18.265   4.188
 1481    H    SER  78           H        SER  78   5.648 -19.751   4.113
 1482    HA   SER  78           HA       SER  78   6.113 -17.147   2.853
 1483    HB2  SER  78           HB3      SER  78   4.239 -18.442   1.713
 1484    HB3  SER  78           HB2      SER  78   3.338 -18.292   3.222
 1485    HG   SER  78           HG       SER  78   4.432 -16.057   1.870
 1486    H    TYR  79           H        TYR  79   5.685 -15.399   4.116
 1487    HA   TYR  79           HA       TYR  79   4.301 -15.798   6.625
 1488    HB2  TYR  79           HB3      TYR  79   6.056 -14.612   7.929
 1489    HB3  TYR  79           HB2      TYR  79   6.578 -16.177   7.321
 1490    HD1  TYR  79           HD1      TYR  79   7.073 -12.556   7.139
 1491    HD2  TYR  79           HD2      TYR  79   8.304 -16.329   5.602
 1492    HE1  TYR  79           HE1      TYR  79   9.104 -11.515   6.221
 1493    HE2  TYR  79           HE2      TYR  79  10.334 -15.295   4.676
 1494    HH   TYR  79           HH       TYR  79  11.372 -12.189   5.558
 1495    H    CYS  80           H        CYS  80   3.511 -13.895   7.561
 1496    HA   CYS  80           HA       CYS  80   2.689 -12.009   5.546
 1497    HB2  CYS  80           HB3      CYS  80   2.046 -12.028   8.506
 1498    HB3  CYS  80           HB2      CYS  80   1.182 -11.147   7.245
 1499    H    THR  81           H        THR  81   3.677 -10.188   5.094
 1500    HA   THR  81           HA       THR  81   5.164  -8.798   7.217
 1501    HB   THR  81           HB       THR  81   6.078  -9.100   4.341
 1502    HG1  THR  81           HG1      THR  81   6.351 -11.016   5.564
 1503   HG21  THR  81          HG21      THR  81   7.458  -7.843   6.719
 1504   HG22  THR  81          HG22      THR  81   6.745  -6.966   5.365
 1505   HG23  THR  81          HG23      THR  81   8.133  -8.020   5.099
 1506    H    THR  82           H        THR  82   4.619  -6.697   7.384
 1507    HA   THR  82           HA       THR  82   2.636  -5.601   5.665
 1508    HB   THR  82           HB       THR  82   3.176  -3.473   7.014
 1509    HG1  THR  82           HG1      THR  82   4.766  -3.605   8.379
 1510   HG21  THR  82          HG21      THR  82   1.221  -4.846   7.438
 1511   HG22  THR  82          HG22      THR  82   1.934  -4.317   8.961
 1512   HG23  THR  82          HG23      THR  82   2.192  -5.966   8.396
 1513    H    THR  83           H        THR  83   2.939  -4.627   3.798
 1514    HA   THR  83           HA       THR  83   5.602  -4.015   2.902
 1515    HB   THR  83           HB       THR  83   4.033  -5.010   1.317
 1516    HG1  THR  83           HG1      THR  83   4.244  -3.279  -0.344
 1517   HG21  THR  83          HG21      THR  83   2.439  -2.470   1.664
 1518   HG22  THR  83          HG22      THR  83   1.931  -4.103   2.097
 1519   HG23  THR  83          HG23      THR  83   2.161  -3.672   0.404
 1520    H    HIS  84           H        HIS  84   6.452  -2.030   2.459
 1521    HA   HIS  84           HA       HIS  84   5.177   0.137   3.981
 1522    HB2  HIS  84           HB3      HIS  84   8.076   0.097   3.160
 1523    HB3  HIS  84           HB2      HIS  84   7.321   0.988   4.474
 1524    HD1  HIS  84           HD1      HIS  84   6.422  -0.643   6.523
 1525    HD2  HIS  84           HD2      HIS  84   9.288  -2.192   3.927
 1526    HE1  HIS  84           HE1      HIS  84   7.452  -2.594   7.723
 1527    HE2  HIS  84           HE2      HIS  84   9.218  -3.476   6.167
 1528    H    THR  85           H        THR  85   4.462   1.862   2.924
 1529    HA   THR  85           HA       THR  85   5.523   2.376   0.223
 1530    HB   THR  85           HB       THR  85   3.116   1.705   0.216
 1531    HG1  THR  85           HG1      THR  85   2.545   3.314  -1.194
 1532   HG21  THR  85          HG21      THR  85   1.439   3.257   1.118
 1533   HG22  THR  85          HG22      THR  85   2.729   4.243   1.808
 1534   HG23  THR  85          HG23      THR  85   2.465   2.601   2.393
 1535    H    PHE  86           H        PHE  86   5.575   4.697  -0.357
 1536    HA   PHE  86           HA       PHE  86   6.269   6.263   2.028
 1537    HB2  PHE  86           HB3      PHE  86   7.178   6.656  -0.840
 1538    HB3  PHE  86           HB2      PHE  86   7.693   7.617   0.546
 1539    HD1  PHE  86           HD1      PHE  86   8.958   6.461   2.409
 1540    HD2  PHE  86           HD2      PHE  86   8.283   4.673  -1.394
 1541    HE1  PHE  86           HE1      PHE  86  10.798   4.884   2.830
 1542    HE2  PHE  86           HE2      PHE  86  10.120   3.090  -0.981
 1543    HZ   PHE  86           HZ       PHE  86  11.379   3.193   1.132
 1544    H    VAL  87           H        VAL  87   4.853   7.743   2.611
 1545    HA   VAL  87           HA       VAL  87   3.033   8.786   0.551
 1546    HB   VAL  87           HB       VAL  87   1.459   9.282   2.430
 1547   HG11  VAL  87          HG11      VAL  87   2.252   6.400   2.066
 1548   HG12  VAL  87          HG12      VAL  87   1.177   7.323   1.017
 1549   HG13  VAL  87          HG13      VAL  87   0.701   6.971   2.678
 1550   HG21  VAL  87          HG21      VAL  87   1.782   8.158   4.566
 1551   HG22  VAL  87          HG22      VAL  87   3.089   9.302   4.257
 1552   HG23  VAL  87          HG23      VAL  87   3.356   7.574   4.033
 1553    H    LYS  88           H        LYS  88   2.498  10.902   0.513
 1554    HA   LYS  88           HA       LYS  88   4.544  12.721   1.371
 1555    HB2  LYS  88           HB3      LYS  88   3.044  14.390   0.135
 1556    HB3  LYS  88           HB2      LYS  88   3.756  13.093  -0.815
 1557    HG2  LYS  88           HG3      LYS  88   1.593  11.850  -0.577
 1558    HG3  LYS  88           HG2      LYS  88   0.920  13.297   0.165
 1559    HD2  LYS  88           HD3      LYS  88   1.329  14.565  -1.822
 1560    HD3  LYS  88           HD2      LYS  88   2.167  13.205  -2.574
 1561    HE2  LYS  88           HE3      LYS  88  -0.005  11.915  -2.299
 1562    HE3  LYS  88           HE2      LYS  88  -0.753  13.463  -1.905
 1563    HZ1  LYS  88           HZ1      LYS  88  -1.032  12.960  -4.233
 1564    HZ2  LYS  88           HZ2      LYS  88   0.637  12.784  -4.443
 1565    HZ3  LYS  88           HZ3      LYS  88  -0.015  14.301  -4.069
 1566    H    ALA  89           H        ALA  89   4.506  13.167   3.476
 1567    HA   ALA  89           HA       ALA  89   2.021  14.306   4.580
 1568    HB1  ALA  89           HB1      ALA  89   2.376  12.046   5.476
 1569    HB2  ALA  89           HB2      ALA  89   2.513  13.281   6.729
 1570    HB3  ALA  89           HB3      ALA  89   3.967  12.538   6.062
 1571    H    LEU  90           H        LEU  90   2.285  16.030   6.013
 1572    HA   LEU  90           HA       LEU  90   4.701  17.533   5.722
 1573    HB2  LEU  90           HB3      LEU  90   2.415  18.560   5.907
 1574    HB3  LEU  90           HB2      LEU  90   2.380  18.050   7.590
 1575    HG   LEU  90           HG       LEU  90   4.498  19.443   7.903
 1576   HD11  LEU  90          HD11      LEU  90   5.124  19.702   5.588
 1577   HD12  LEU  90          HD12      LEU  90   4.790  21.281   6.298
 1578   HD13  LEU  90          HD13      LEU  90   3.603  20.520   5.239
 1579   HD21  LEU  90          HD21      LEU  90   2.353  20.147   8.770
 1580   HD22  LEU  90          HD22      LEU  90   1.904  20.803   7.196
 1581   HD23  LEU  90          HD23      LEU  90   3.224  21.533   8.113
 1582    H    THR  91           H        THR  91   6.462  17.041   6.811
 1583    HA   THR  91           HA       THR  91   6.205  16.186   9.616
 1584    HB   THR  91           HB       THR  91   8.128  14.666   9.282
 1585    HG1  THR  91           HG1      THR  91   7.789  15.385   6.544
 1586   HG21  THR  91          HG21      THR  91   6.967  12.922   8.001
 1587   HG22  THR  91          HG22      THR  91   5.830  14.126   7.398
 1588   HG23  THR  91          HG23      THR  91   5.873  13.736   9.115
 1589    H    THR  92           H        THR  92   8.134  16.655  10.914
 1590    HA   THR  92           HA       THR  92   9.794  18.752   9.696
 1591    HB   THR  92           HB       THR  92   8.310  19.785  11.326
 1592    HG1  THR  92           HG1      THR  92  10.402  20.633  11.192
 1593   HG21  THR  92          HG21      THR  92   7.909  17.813  12.752
 1594   HG22  THR  92          HG22      THR  92   8.370  19.236  13.685
 1595   HG23  THR  92          HG23      THR  92   9.550  17.960  13.384
 1596    H    ASP  93           H        ASP  93  11.856  18.271   9.567
 1597    HA   ASP  93           HA       ASP  93  12.855  15.855  10.780
 1598    HB2  ASP  93           HB3      ASP  93  14.844  16.218   9.464
 1599    HB3  ASP  93           HB2      ASP  93  13.449  16.576   8.449
 1600    H    GLU  94           H        GLU  94  12.857  19.202  11.503
 1601    HA   GLU  94           HA       GLU  94  14.229  18.786  13.974
 1602    HB2  GLU  94           HB3      GLU  94  16.129  18.967  12.355
 1603    HB3  GLU  94           HB2      GLU  94  15.567  20.574  11.931
 1604    HG2  GLU  94           HG3      GLU  94  15.911  21.266  14.277
 1605    HG3  GLU  94           HG2      GLU  94  16.566  19.669  14.618
 1606    H    LYS  95           H        LYS  95  13.796  21.527  11.721
 1607    HA   LYS  95           HA       LYS  95  12.205  22.846  13.822
 1608    HB2  LYS  95           HB3      LYS  95  14.077  24.141  11.835
 1609    HB3  LYS  95           HB2      LYS  95  13.083  24.995  13.003
 1610    HG2  LYS  95           HG3      LYS  95  14.311  23.910  14.825
 1611    HG3  LYS  95           HG2      LYS  95  15.322  23.090  13.634
 1612    HD2  LYS  95           HD3      LYS  95  16.047  25.277  12.782
 1613    HD3  LYS  95           HD2      LYS  95  15.090  26.068  14.035
 1614    HE2  LYS  95           HE3      LYS  95  16.429  24.921  15.746
 1615    HE3  LYS  95           HE2      LYS  95  17.396  24.180  14.474
 1616    HZ1  LYS  95           HZ1      LYS  95  18.053  26.411  13.759
 1617    HZ2  LYS  95           HZ2      LYS  95  18.514  26.105  15.356
 1618    HZ3  LYS  95           HZ3      LYS  95  17.176  27.086  15.036
 1619    H    GLN  96           H        GLN  96  12.822  22.842  10.318
 1620    HA   GLN  96           HA       GLN  96  10.377  24.258   9.786
 1621    HB2  GLN  96           HB3      GLN  96  12.402  22.980   7.940
 1622    HB3  GLN  96           HB2      GLN  96  11.028  23.931   7.396
 1623    HG2  GLN  96           HG3      GLN  96  13.254  24.926   9.151
 1624    HG3  GLN  96           HG2      GLN  96  13.093  25.227   7.422
 1625   HE21  GLN  96          HE21      GLN  96  13.148  27.061   9.731
 1626   HE22  GLN  96          HE22      GLN  96  11.706  28.002   9.603
 1627    H    ALA  97           H        ALA  97   8.615  23.494   8.591
 1628    HA   ALA  97           HA       ALA  97   8.210  20.591   8.764
 1629    HB1  ALA  97           HB1      ALA  97   5.822  21.073   8.597
 1630    HB2  ALA  97           HB2      ALA  97   6.173  22.792   8.415
 1631    HB3  ALA  97           HB3      ALA  97   6.549  21.970   9.929
 1632    H    ALA  98           H        ALA  98   8.113  19.410   6.951
 1633    HA   ALA  98           HA       ALA  98   7.694  20.790   4.400
 1634    HB1  ALA  98           HB1      ALA  98   9.562  19.558   3.397
 1635    HB2  ALA  98           HB2      ALA  98   9.947  18.869   4.975
 1636    HB3  ALA  98           HB3      ALA  98  10.104  20.605   4.708
 1637    H    TRP  99           H        TRP  99   6.766  19.559   2.787
 1638    HA   TRP  99           HA       TRP  99   5.317  17.224   3.647
 1639    HB2  TRP  99           HB3      TRP  99   5.515  18.526   0.915
 1640    HB3  TRP  99           HB2      TRP  99   4.408  17.225   1.332
 1641    HD1  TRP  99           HD1      TRP  99   4.996  20.961   1.967
 1642    HE1  TRP  99           HE1      TRP  99   2.817  22.000   2.862
 1643    HE3  TRP  99           HE3      TRP  99   2.257  16.687   2.556
 1644    HZ2  TRP  99           HZ2      TRP  99   0.270  21.114   3.704
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.046  16.871   3.415
 1646    HH2  TRP  99           HH2      TRP  99  -1.015  19.039   3.974
 1647    H    ARG 100           H        ARG 100   6.640  15.570   4.041
 1648    HA   ARG 100           HA       ARG 100   8.670  14.846   2.038
 1649    HB2  ARG 100           HB3      ARG 100   8.424  14.069   4.955
 1650    HB3  ARG 100           HB2      ARG 100   9.718  13.562   3.883
 1651    HG2  ARG 100           HG3      ARG 100   9.138  16.431   4.578
 1652    HG3  ARG 100           HG2      ARG 100  10.304  15.419   5.432
 1653    HD2  ARG 100           HD3      ARG 100  10.384  16.159   2.507
 1654    HD3  ARG 100           HD2      ARG 100  11.421  16.807   3.775
 1655    HE   ARG 100           HE       ARG 100  11.486  13.918   3.426
 1656   HH11  ARG 100          HH11      ARG 100  12.955  17.012   2.676
 1657   HH12  ARG 100          HH12      ARG 100  14.490  16.326   2.258
 1658   HH21  ARG 100          HH21      ARG 100  13.495  13.001   2.838
 1659   HH22  ARG 100          HH22      ARG 100  14.796  14.048   2.340
 1660    H    PHE 101           H        PHE 101   9.012  12.546   1.678
 1661    HA   PHE 101           HA       PHE 101   6.490  11.063   1.764
 1662    HB2  PHE 101           HB3      PHE 101   9.016  10.618   0.150
 1663    HB3  PHE 101           HB2      PHE 101   7.653   9.511   0.152
 1664    HD1  PHE 101           HD1      PHE 101   8.761  12.897  -0.816
 1665    HD2  PHE 101           HD2      PHE 101   5.673   9.973  -1.062
 1666    HE1  PHE 101           HE1      PHE 101   7.676  14.193  -2.602
 1667    HE2  PHE 101           HE2      PHE 101   4.586  11.268  -2.847
 1668    HZ   PHE 101           HZ       PHE 101   5.588  13.380  -3.619
 1669    H    ILE 102           H        ILE 102   6.229   9.812   3.467
 1670    HA   ILE 102           HA       ILE 102   8.622   8.645   4.746
 1671    HB   ILE 102           HB       ILE 102   7.244   8.566   6.835
 1672   HG12  ILE 102          HG13      ILE 102   5.378  10.384   5.300
 1673   HG13  ILE 102          HG12      ILE 102   5.028   8.710   5.704
 1674   HG21  ILE 102          HG21      ILE 102   7.728  11.284   5.629
 1675   HG22  ILE 102          HG22      ILE 102   8.890  10.302   6.523
 1676   HG23  ILE 102          HG23      ILE 102   7.475  10.960   7.344
 1677   HD11  ILE 102          HD11      ILE 102   5.459  10.955   7.658
 1678   HD12  ILE 102          HD12      ILE 102   5.134   9.274   8.081
 1679   HD13  ILE 102          HD13      ILE 102   3.915  10.220   7.227
 1680    H    ARG 103           H        ARG 103   8.543   6.529   5.501
 1681    HA   ARG 103           HA       ARG 103   6.857   4.816   3.919
 1682    HB2  ARG 103           HB3      ARG 103   8.085   2.949   5.021
 1683    HB3  ARG 103           HB2      ARG 103   9.141   4.114   4.235
 1684    HG2  ARG 103           HG3      ARG 103  10.097   4.755   6.175
 1685    HG3  ARG 103           HG2      ARG 103   8.601   4.587   7.091
 1686    HD2  ARG 103           HD3      ARG 103  10.203   2.234   6.104
 1687    HD3  ARG 103           HD2      ARG 103  10.434   2.963   7.695
 1688    HE   ARG 103           HE       ARG 103   7.733   2.100   7.018
 1689   HH11  ARG 103          HH11      ARG 103  10.728   1.408   8.688
 1690   HH12  ARG 103          HH12      ARG 103  10.006   0.259   9.771
 1691   HH21  ARG 103          HH21      ARG 103   6.775   0.558   8.446
 1692   HH22  ARG 103          HH22      ARG 103   7.780  -0.222   9.634
 1693    H    ILE 104           H        ILE 104   4.854   4.409   4.466
 1694    HA   ILE 104           HA       ILE 104   4.331   3.672   7.270
 1695    HB   ILE 104           HB       ILE 104   1.950   4.097   6.874
 1696   HG12  ILE 104          HG13      ILE 104   2.746   5.281   4.215
 1697   HG13  ILE 104          HG12      ILE 104   2.076   3.664   4.388
 1698   HG21  ILE 104          HG21      ILE 104   3.290   5.889   7.802
 1699   HG22  ILE 104          HG22      ILE 104   2.040   6.547   6.746
 1700   HG23  ILE 104          HG23      ILE 104   3.707   6.445   6.180
 1701   HD11  ILE 104          HD11      ILE 104   0.038   4.607   5.326
 1702   HD12  ILE 104          HD12      ILE 104   0.381   5.270   3.729
 1703   HD13  ILE 104          HD13      ILE 104   0.716   6.227   5.173
 1704    H    ASP 105           H        ASP 105   3.115   1.794   7.627
 1705    HA   ASP 105           HA       ASP 105   3.520  -0.231   5.598
 1706    HB2  ASP 105           HB3      ASP 105   2.508  -0.331   8.451
 1707    HB3  ASP 105           HB2      ASP 105   2.605  -1.753   7.413
 1708    H    THR 106           H        THR 106   2.038  -0.441   4.036
 1709    HA   THR 106           HA       THR 106  -0.582   0.754   4.568
 1710    HB   THR 106           HB       THR 106   0.573   1.652   2.636
 1711    HG1  THR 106           HG1      THR 106  -1.850   0.345   2.441
 1712   HG21  THR 106          HG21      THR 106   0.511  -1.172   1.564
 1713   HG22  THR 106          HG22      THR 106   1.945  -0.235   1.993
 1714   HG23  THR 106          HG23      THR 106   0.946   0.256   0.626
 1715    H    ALA 107           H        ALA 107   0.803  -2.366   3.967
 1716    HA   ALA 107           HA       ALA 107  -1.774  -3.604   4.292
 1717    HB1  ALA 107           HB1      ALA 107  -1.760  -4.830   2.179
 1718    HB2  ALA 107           HB2      ALA 107  -0.315  -3.953   1.674
 1719    HB3  ALA 107           HB3      ALA 107  -1.836  -3.090   1.902
 1720    H    CYS 108           H        CYS 108  -1.615  -5.951   4.425
 1721    HA   CYS 108           HA       CYS 108   1.076  -6.808   5.248
 1722    HB2  CYS 108           HB3      CYS 108  -0.630  -6.876   7.042
 1723    HB3  CYS 108           HB2      CYS 108  -1.627  -7.936   6.044
 1724    H    VAL 109           H        VAL 109   2.071  -8.096   3.836
 1725    HA   VAL 109           HA       VAL 109   0.384  -9.609   1.950
 1726    HB   VAL 109           HB       VAL 109   2.125  -9.357   0.267
 1727   HG11  VAL 109          HG11      VAL 109   0.405  -7.654   0.350
 1728   HG12  VAL 109          HG12      VAL 109   1.945  -6.936  -0.125
 1729   HG13  VAL 109          HG13      VAL 109   1.345  -6.728   1.522
 1730   HG21  VAL 109          HG21      VAL 109   4.064  -7.907   0.627
 1731   HG22  VAL 109          HG22      VAL 109   4.082  -9.282   1.732
 1732   HG23  VAL 109          HG23      VAL 109   3.593  -7.690   2.312
 1733    H    CYS 110           H        CYS 110   0.967 -11.702   1.445
 1734    HA   CYS 110           HA       CYS 110   2.822 -12.989   3.272
 1735    HB2  CYS 110           HB3      CYS 110   0.868 -14.068   1.237
 1736    HB3  CYS 110           HB2      CYS 110   2.006 -15.096   2.095
 1737    H    VAL 111           H        VAL 111   4.888 -13.023   2.766
 1738    HA   VAL 111           HA       VAL 111   5.689 -12.827  -0.035
 1739    HB   VAL 111           HB       VAL 111   7.985 -12.586   0.857
 1740   HG11  VAL 111          HG11      VAL 111   7.659 -10.404   1.937
 1741   HG12  VAL 111          HG12      VAL 111   5.944 -10.769   2.134
 1742   HG13  VAL 111          HG13      VAL 111   6.630 -10.596   0.518
 1743   HG21  VAL 111          HG21      VAL 111   6.679 -12.713   3.568
 1744   HG22  VAL 111          HG22      VAL 111   8.382 -12.394   3.233
 1745   HG23  VAL 111          HG23      VAL 111   7.691 -13.975   2.865
 1746    H    LEU 112           H        LEU 112   6.945 -14.379  -1.112
 1747    HA   LEU 112           HA       LEU 112   6.802 -17.056   0.105
 1748    HB2  LEU 112           HB3      LEU 112   6.984 -16.230  -2.797
 1749    HB3  LEU 112           HB2      LEU 112   7.011 -17.890  -2.237
 1750    HG   LEU 112           HG       LEU 112   4.694 -15.965  -1.979
 1751   HD11  LEU 112          HD11      LEU 112   5.034 -16.767  -4.251
 1752   HD12  LEU 112          HD12      LEU 112   3.592 -17.497  -3.544
 1753   HD13  LEU 112          HD13      LEU 112   5.080 -18.433  -3.673
 1754   HD21  LEU 112          HD21      LEU 112   4.775 -17.464  -0.066
 1755   HD22  LEU 112          HD22      LEU 112   4.935 -18.855  -1.138
 1756   HD23  LEU 112          HD23      LEU 112   3.449 -17.906  -1.139
 1757    H    SER 113           H        SER 113   8.572 -18.279   0.365
 1758    HA   SER 113           HA       SER 113  11.056 -17.440  -0.965
 1759    HB2  SER 113           HB3      SER 113  11.048 -16.781   1.461
 1760    HB3  SER 113           HB2      SER 113  10.894 -18.487   1.873
 1761    HG   SER 113           HG       SER 113  13.032 -17.296   0.424
 1762    H    ARG 114           H        ARG 114  12.445 -19.139  -1.541
 1763    HA   ARG 114           HA       ARG 114  11.039 -21.526  -2.277
 1764    HB2  ARG 114           HB3      ARG 114  12.601 -20.417  -3.808
 1765    HB3  ARG 114           HB2      ARG 114  13.924 -20.708  -2.693
 1766    HG2  ARG 114           HG3      ARG 114  13.992 -22.265  -4.551
 1767    HG3  ARG 114           HG2      ARG 114  13.694 -23.114  -3.033
 1768    HD2  ARG 114           HD3      ARG 114  12.247 -24.054  -4.667
 1769    HD3  ARG 114           HD2      ARG 114  11.254 -23.070  -3.596
 1770    HE   ARG 114           HE       ARG 114  11.976 -21.442  -5.712
 1771   HH11  ARG 114          HH11      ARG 114  10.165 -24.397  -5.237
 1772   HH12  ARG 114          HH12      ARG 114   9.139 -24.136  -6.612
 1773   HH21  ARG 114          HH21      ARG 114  10.640 -21.109  -7.536
 1774   HH22  ARG 114          HH22      ARG 114   9.408 -22.270  -7.911
 1775    H    LYS 115           H        LYS 115  12.161 -20.792   0.603
 1776    HA   LYS 115           HA       LYS 115  12.814 -21.929   2.460
 1777    HB2  LYS 115           HB3      LYS 115  12.297 -24.428   0.827
 1778    HB3  LYS 115           HB2      LYS 115  12.392 -24.331   2.578
 1779    HG2  LYS 115           HG3      LYS 115  10.383 -22.904   2.574
 1780    HG3  LYS 115           HG2      LYS 115  10.289 -23.091   0.820
 1781    HD2  LYS 115           HD3      LYS 115   8.777 -24.652   1.846
 1782    HD3  LYS 115           HD2      LYS 115  10.120 -25.537   1.125
 1783    HE2  LYS 115           HE3      LYS 115  11.187 -25.683   3.323
 1784    HE3  LYS 115           HE2      LYS 115   9.822 -24.827   4.038
 1785    HZ1  LYS 115           HZ1      LYS 115   9.723 -27.473   2.701
 1786    HZ2  LYS 115           HZ2      LYS 115   8.379 -26.642   3.314
 1787    HZ3  LYS 115           HZ3      LYS 115   9.592 -27.184   4.362
 1788    H    ALA 116           H        ALA 116  14.740 -21.111   0.524
 1789    HA   ALA 116           HA       ALA 116  16.954 -22.829   1.291
 1790    HB1  ALA 116           HB1      ALA 116  16.379 -22.163  -1.595
 1791    HB2  ALA 116           HB2      ALA 116  16.222 -23.756  -0.855
 1792    HB3  ALA 116           HB3      ALA 116  17.808 -22.999  -0.989
 1793    H    THR 117           H        THR 117  18.783 -21.688   1.633
 1794    HA   THR 117           HA       THR 117  18.601 -18.803   1.380
 1795    HB   THR 117           HB       THR 117  20.861 -18.948   2.605
 1796    HG1  THR 117           HG1      THR 117  21.575 -20.953   2.655
 1797   HG21  THR 117          HG21      THR 117  19.760 -19.360   4.771
 1798   HG22  THR 117          HG22      THR 117  18.359 -20.011   3.921
 1799   HG23  THR 117          HG23      THR 117  18.794 -18.314   3.730
 1800    H    ARG 118           H        ARG 118  20.281 -17.536   0.418
 1801    HA   ARG 118           HA       ARG 118  21.385 -18.794  -1.961
 1802    HB2  ARG 118           HB3      ARG 118  20.193 -16.413  -1.675
 1803    HB3  ARG 118           HB2      ARG 118  21.828 -15.909  -1.305
 1804    HG2  ARG 118           HG3      ARG 118  21.006 -17.297  -3.848
 1805    HG3  ARG 118           HG2      ARG 118  21.149 -15.554  -3.659
 1806    HD2  ARG 118           HD3      ARG 118  23.174 -16.146  -4.633
 1807    HD3  ARG 118           HD2      ARG 118  23.572 -16.059  -2.921
 1808    HE   ARG 118           HE       ARG 118  22.839 -18.697  -3.554
 1809   HH11  ARG 118          HH11      ARG 118  25.408 -16.407  -4.164
 1810   HH12  ARG 118          HH12      ARG 118  26.626 -17.625  -4.366
 1811   HH21  ARG 118          HH21      ARG 118  24.437 -20.310  -3.813
 1812   HH22  ARG 118          HH22      ARG 118  26.070 -19.850  -4.168
  Start of MODEL   11
    1    H1   SER   1           H1       SER   1  19.507 -10.432   9.295
    2    H2   SER   1           H2       SER   1  18.383 -10.946   8.143
    3    H3   SER   1           H3       SER   1  18.225  -9.423   8.855
    4    HA   SER   1           HA       SER   1  20.430 -10.286   7.093
    5    HB2  SER   1           HB3      SER   1  18.164  -8.339   6.592
    6    HB3  SER   1           HB2      SER   1  19.450  -8.754   5.460
    7    HG   SER   1           HG       SER   1  17.198  -9.900   5.513
    8    H    SER   2           H        SER   2  22.221  -9.348   7.835
    9    HA   SER   2           HA       SER   2  22.077  -6.479   8.485
   10    HB2  SER   2           HB3      SER   2  24.027  -6.916  10.053
   11    HB3  SER   2           HB2      SER   2  22.480  -7.588  10.570
   12    HG   SER   2           HG       SER   2  24.328  -9.037  10.723
   13    H    THR   3           H        THR   3  24.513  -8.990   7.816
   14    HA   THR   3           HA       THR   3  25.952  -7.144   6.082
   15    HB   THR   3           HB       THR   3  27.530  -9.166   5.889
   16    HG1  THR   3           HG1      THR   3  26.880 -10.920   6.868
   17   HG21  THR   3          HG21      THR   3  28.566  -8.689   8.058
   18   HG22  THR   3          HG22      THR   3  27.087  -7.894   8.594
   19   HG23  THR   3          HG23      THR   3  28.028  -7.206   7.270
   20    H    HIS   4           H        HIS   4  23.959  -9.987   5.946
   21    HA   HIS   4           HA       HIS   4  24.170  -9.982   3.008
   22    HB2  HIS   4           HB3      HIS   4  25.051 -12.045   4.067
   23    HB3  HIS   4           HB2      HIS   4  23.491 -12.299   4.831
   24    HD1  HIS   4           HD1      HIS   4  25.330 -12.829   1.683
   25    HD2  HIS   4           HD2      HIS   4  21.407 -13.073   3.026
   26    HE1  HIS   4           HE1      HIS   4  24.097 -14.150  -0.064
   27    HE2  HIS   4           HE2      HIS   4  21.699 -14.155   0.699
   28    HA   PRO   5           HA       PRO   5  19.849  -8.821   3.510
   29    HB2  PRO   5           HB3      PRO   5  19.420  -8.171   0.920
   30    HB3  PRO   5           HB2      PRO   5  20.277  -7.098   2.033
   31    HG2  PRO   5           HG3      PRO   5  21.367  -8.928  -0.061
   32    HG3  PRO   5           HG2      PRO   5  21.907  -7.304   0.397
   33    HD2  PRO   5           HD3      PRO   5  23.132  -9.626   1.208
   34    HD3  PRO   5           HD2      PRO   5  23.217  -8.094   2.099
   35    H    VAL   6           H        VAL   6  18.472 -10.479   3.763
   36    HA   VAL   6           HA       VAL   6  18.467 -12.672   1.844
   37    HB   VAL   6           HB       VAL   6  16.771 -12.411   4.330
   38   HG11  VAL   6          HG11      VAL   6  17.588 -14.805   2.690
   39   HG12  VAL   6          HG12      VAL   6  15.982 -14.078   2.751
   40   HG13  VAL   6          HG13      VAL   6  16.653 -14.857   4.184
   41   HG21  VAL   6          HG21      VAL   6  19.478 -13.708   4.037
   42   HG22  VAL   6          HG22      VAL   6  18.446 -13.793   5.464
   43   HG23  VAL   6          HG23      VAL   6  19.120 -12.246   4.954
   44    H    PHE   7           H        PHE   7  17.688 -10.859   0.313
   45    HA   PHE   7           HA       PHE   7  14.826 -10.377   0.519
   46    HB2  PHE   7           HB3      PHE   7  16.926  -9.375  -1.397
   47    HB3  PHE   7           HB2      PHE   7  15.212  -9.084  -1.646
   48    HD1  PHE   7           HD1      PHE   7  14.201  -8.452   0.972
   49    HD2  PHE   7           HD2      PHE   7  17.919  -7.392  -0.805
   50    HE1  PHE   7           HE1      PHE   7  14.307  -6.458   2.398
   51    HE2  PHE   7           HE2      PHE   7  18.038  -5.397   0.630
   52    HZ   PHE   7           HZ       PHE   7  16.232  -4.924   2.233
   53    H    HIS   8           H        HIS   8  16.995 -12.525  -1.012
   54    HA   HIS   8           HA       HIS   8  15.344 -13.217  -3.235
   55    HB2  HIS   8           HB3      HIS   8  17.851 -13.586  -3.046
   56    HB3  HIS   8           HB2      HIS   8  17.488 -14.940  -1.985
   57    HD1  HIS   8           HD1      HIS   8  16.884 -13.798  -5.543
   58    HD2  HIS   8           HD2      HIS   8  16.940 -17.290  -3.288
   59    HE1  HIS   8           HE1      HIS   8  16.682 -15.682  -7.199
   60    HE2  HIS   8           HE2      HIS   8  16.913 -17.776  -5.823
   61    H    MET   9           H        MET   9  14.988 -13.691   0.003
   62    HA   MET   9           HA       MET   9  12.873 -15.637  -0.530
   63    HB2  MET   9           HB3      MET   9  14.851 -15.791   1.756
   64    HB3  MET   9           HB2      MET   9  13.340 -16.689   1.720
   65    HG2  MET   9           HG3      MET   9  14.095 -17.802  -0.355
   66    HG3  MET   9           HG2      MET   9  15.631 -16.953  -0.216
   67    HE1  MET   9           HE1      MET   9  16.171 -16.980   2.893
   68    HE2  MET   9           HE2      MET   9  17.399 -17.375   1.690
   69    HE3  MET   9           HE3      MET   9  17.126 -18.453   3.058
   70    H    GLY  10           H        GLY  10  12.937 -12.781  -0.320
   71    HA2  GLY  10           HA3      GLY  10  11.064 -12.449   1.917
   72    HA3  GLY  10           HA2      GLY  10  12.438 -11.360   1.821
   73    H    GLU  11           H        GLU  11  12.467 -11.131  -1.040
   74    HA   GLU  11           HA       GLU  11  10.141  -9.387  -1.382
   75    HB2  GLU  11           HB3      GLU  11  12.735  -9.621  -2.921
   76    HB3  GLU  11           HB2      GLU  11  11.415  -8.551  -3.389
   77    HG2  GLU  11           HG3      GLU  11  12.886  -8.426  -0.760
   78    HG3  GLU  11           HG2      GLU  11  13.218  -7.408  -2.161
   79    H    PHE  12           H        PHE  12   9.694 -12.145  -1.489
   80    HA   PHE  12           HA       PHE  12   9.140 -12.570  -4.345
   81    HB2  PHE  12           HB3      PHE  12   9.748 -14.478  -2.116
   82    HB3  PHE  12           HB2      PHE  12   8.730 -15.016  -3.449
   83    HD1  PHE  12           HD1      PHE  12  11.855 -12.948  -3.235
   84    HD2  PHE  12           HD2      PHE  12   9.878 -16.329  -4.904
   85    HE1  PHE  12           HE1      PHE  12  13.839 -13.436  -4.597
   86    HE2  PHE  12           HE2      PHE  12  11.863 -16.821  -6.265
   87    HZ   PHE  12           HZ       PHE  12  13.847 -15.374  -6.114
   88    H    SER  13           H        SER  13   7.207 -11.712  -4.671
   89    HA   SER  13           HA       SER  13   5.091 -12.027  -2.704
   90    HB2  SER  13           HB3      SER  13   5.444  -9.819  -3.768
   91    HB3  SER  13           HB2      SER  13   5.112 -10.531  -5.342
   92    HG   SER  13           HG       SER  13   3.235  -9.599  -4.601
   93    H    VAL  14           H        VAL  14   3.000 -12.812  -3.305
   94    HA   VAL  14           HA       VAL  14   3.118 -15.234  -4.830
   95    HB   VAL  14           HB       VAL  14   0.719 -15.469  -4.247
   96   HG11  VAL  14          HG11      VAL  14   1.036 -15.647  -1.811
   97   HG12  VAL  14          HG12      VAL  14   2.536 -14.733  -1.958
   98   HG13  VAL  14          HG13      VAL  14   2.390 -16.318  -2.719
   99   HG21  VAL  14          HG21      VAL  14  -0.353 -13.859  -2.768
  100   HG22  VAL  14          HG22      VAL  14   0.107 -13.095  -4.290
  101   HG23  VAL  14          HG23      VAL  14   1.071 -12.822  -2.840
  102    H    CYS  15           H        CYS  15   2.359 -11.996  -5.529
  103    HA   CYS  15           HA       CYS  15   1.354 -12.784  -8.172
  104    HB2  CYS  15           HB3      CYS  15  -0.554 -12.019  -6.782
  105    HB3  CYS  15           HB2      CYS  15   0.278 -10.486  -6.510
  106    H    ASP  16           H        ASP  16   1.846 -11.276  -9.852
  107    HA   ASP  16           HA       ASP  16   4.268  -9.746  -9.266
  108    HB2  ASP  16           HB3      ASP  16   4.289 -11.413 -11.135
  109    HB3  ASP  16           HB2      ASP  16   3.079 -10.440 -11.964
  110    H    SER  17           H        SER  17   4.113  -7.649  -8.925
  111    HA   SER  17           HA       SER  17   1.795  -6.210 -10.041
  112    HB2  SER  17           HB3      SER  17   3.087  -5.757  -7.340
  113    HB3  SER  17           HB2      SER  17   1.648  -4.946  -7.970
  114    HG   SER  17           HG       SER  17   1.622  -7.734  -7.889
  115    H    VAL  18           H        VAL  18   2.094  -3.890 -10.319
  116    HA   VAL  18           HA       VAL  18   4.920  -3.084 -10.462
  117    HB   VAL  18           HB       VAL  18   4.224  -3.410 -12.723
  118   HG11  VAL  18          HG11      VAL  18   2.300  -2.262 -13.715
  119   HG12  VAL  18          HG12      VAL  18   1.852  -1.657 -12.119
  120   HG13  VAL  18          HG13      VAL  18   1.823  -3.391 -12.447
  121   HG21  VAL  18          HG21      VAL  18   4.433  -1.133 -13.650
  122   HG22  VAL  18          HG22      VAL  18   5.614  -1.478 -12.386
  123   HG23  VAL  18          HG23      VAL  18   4.202  -0.484 -12.027
  124    H    SER  19           H        SER  19   5.302  -1.537  -9.028
  125    HA   SER  19           HA       SER  19   3.137   0.246  -8.214
  126    HB2  SER  19           HB3      SER  19   5.930  -0.092  -7.080
  127    HB3  SER  19           HB2      SER  19   4.669   0.942  -6.403
  128    HG   SER  19           HG       SER  19   3.452  -0.860  -5.923
  129    H    VAL  20           H        VAL  20   2.925   2.177  -9.075
  130    HA   VAL  20           HA       VAL  20   5.248   3.386 -10.436
  131    HB   VAL  20           HB       VAL  20   2.330   3.676 -11.166
  132   HG11  VAL  20          HG11      VAL  20   4.816   4.647 -12.552
  133   HG12  VAL  20          HG12      VAL  20   3.600   5.640 -11.746
  134   HG13  VAL  20          HG13      VAL  20   3.182   4.744 -13.207
  135   HG21  VAL  20          HG21      VAL  20   2.861   2.327 -13.140
  136   HG22  VAL  20          HG22      VAL  20   3.102   1.428 -11.642
  137   HG23  VAL  20          HG23      VAL  20   4.491   2.071 -12.518
  138    H    TRP  21           H        TRP  21   5.722   5.468  -9.949
  139    HA   TRP  21           HA       TRP  21   4.020   6.834  -8.007
  140    HB2  TRP  21           HB3      TRP  21   6.824   7.420  -8.990
  141    HB3  TRP  21           HB2      TRP  21   5.936   8.475  -7.896
  142    HD1  TRP  21           HD1      TRP  21   7.830   5.171  -7.989
  143    HE1  TRP  21           HE1      TRP  21   8.156   4.321  -5.579
  144    HE3  TRP  21           HE3      TRP  21   4.838   8.523  -5.531
  145    HZ2  TRP  21           HZ2      TRP  21   7.258   4.984  -2.986
  146    HZ3  TRP  21           HZ3      TRP  21   4.627   8.341  -3.086
  147    HH2  TRP  21           HH2      TRP  21   5.812   6.609  -1.842
  148    H    VAL  22           H        VAL  22   2.362   7.640  -9.097
  149    HA   VAL  22           HA       VAL  22   2.723   8.771 -11.744
  150    HB   VAL  22           HB       VAL  22   0.227   8.333 -10.100
  151   HG11  VAL  22          HG11      VAL  22  -0.119  10.109 -11.705
  152   HG12  VAL  22          HG12      VAL  22  -0.978   8.657 -12.216
  153   HG13  VAL  22          HG13      VAL  22   0.540   9.103 -12.995
  154   HG21  VAL  22          HG21      VAL  22   1.345   6.254 -10.695
  155   HG22  VAL  22          HG22      VAL  22   1.376   6.747 -12.388
  156   HG23  VAL  22          HG23      VAL  22  -0.164   6.439 -11.588
  157    H    GLY  23           H        GLY  23   3.082  10.841 -12.051
  158    HA2  GLY  23           HA3      GLY  23   1.888  12.776 -10.159
  159    HA3  GLY  23           HA2      GLY  23   3.420  13.052 -10.993
  160    H    ASP  24           H        ASP  24   0.824  11.482 -12.636
  161    HA   ASP  24           HA       ASP  24   0.225  13.950 -14.122
  162    HB2  ASP  24           HB3      ASP  24   0.226  12.677 -16.223
  163    HB3  ASP  24           HB2      ASP  24   1.801  12.584 -15.435
  164    H    LYS  25           H        LYS  25  -1.139  12.104 -12.037
  165    HA   LYS  25           HA       LYS  25  -3.422  11.028 -13.357
  166    HB2  LYS  25           HB3      LYS  25  -2.635  10.220 -11.150
  167    HB3  LYS  25           HB2      LYS  25  -3.058  11.772 -10.445
  168    HG2  LYS  25           HG3      LYS  25  -5.409  11.381 -10.993
  169    HG3  LYS  25           HG2      LYS  25  -4.982   9.822 -11.696
  170    HD2  LYS  25           HD3      LYS  25  -4.422  10.580  -8.838
  171    HD3  LYS  25           HD2      LYS  25  -5.881   9.740  -9.356
  172    HE2  LYS  25           HE3      LYS  25  -3.061   8.733  -9.748
  173    HE3  LYS  25           HE2      LYS  25  -4.165   8.203  -8.480
  174    HZ1  LYS  25           HZ1      LYS  25  -4.549   7.860 -11.405
  175    HZ2  LYS  25           HZ2      LYS  25  -5.684   7.433 -10.227
  176    HZ3  LYS  25           HZ3      LYS  25  -4.187   6.640 -10.282
  177    H    THR  26           H        THR  26  -5.247  12.047 -13.989
  178    HA   THR  26           HA       THR  26  -5.404  14.910 -13.393
  179    HB   THR  26           HB       THR  26  -5.216  14.364 -15.769
  180    HG1  THR  26           HG1      THR  26  -6.613  16.141 -14.927
  181   HG21  THR  26          HG21      THR  26  -7.822  12.890 -15.384
  182   HG22  THR  26          HG22      THR  26  -6.270  12.180 -15.823
  183   HG23  THR  26          HG23      THR  26  -7.091  13.265 -16.943
  184    H    THR  27           H        THR  27  -7.228  11.932 -13.138
  185    HA   THR  27           HA       THR  27  -9.235  13.387 -11.588
  186    HB   THR  27           HB       THR  27 -10.932  11.707 -12.663
  187    HG1  THR  27           HG1      THR  27  -9.244  10.702 -13.963
  188   HG21  THR  27          HG21      THR  27 -11.129  14.129 -12.786
  189   HG22  THR  27          HG22      THR  27 -11.519  13.400 -14.345
  190   HG23  THR  27          HG23      THR  27  -9.952  14.174 -14.098
  191    H    ALA  28           H        ALA  28 -10.079  12.326  -9.880
  192    HA   ALA  28           HA       ALA  28  -9.568   9.464  -9.574
  193    HB1  ALA  28           HB1      ALA  28  -7.639  10.589  -8.533
  194    HB2  ALA  28           HB2      ALA  28  -8.624   9.721  -7.357
  195    HB3  ALA  28           HB3      ALA  28  -8.743  11.477  -7.484
  196    H    THR  29           H        THR  29 -10.734   8.634  -7.583
  197    HA   THR  29           HA       THR  29 -13.269  10.100  -7.325
  198    HB   THR  29           HB       THR  29 -12.809   7.164  -6.786
  199    HG1  THR  29           HG1      THR  29 -12.477   7.799  -9.030
  200   HG21  THR  29          HG21      THR  29 -14.760   8.146  -5.666
  201   HG22  THR  29          HG22      THR  29 -15.249   7.028  -6.940
  202   HG23  THR  29          HG23      THR  29 -15.334   8.767  -7.214
  203    H    ASP  30           H        ASP  30 -13.603  11.081  -5.486
  204    HA   ASP  30           HA       ASP  30 -11.949  10.789  -3.199
  205    HB2  ASP  30           HB3      ASP  30 -13.022  12.913  -3.692
  206    HB3  ASP  30           HB2      ASP  30 -14.619  12.173  -3.590
  207    H    ILE  31           H        ILE  31 -12.861  10.325  -0.977
  208    HA   ILE  31           HA       ILE  31 -13.769   7.685  -0.841
  209    HB   ILE  31           HB       ILE  31 -12.497   8.697   0.967
  210   HG12  ILE  31          HG13      ILE  31 -15.259   7.936   1.945
  211   HG13  ILE  31          HG12      ILE  31 -14.005   6.790   1.480
  212   HG21  ILE  31          HG21      ILE  31 -13.494  10.322   2.501
  213   HG22  ILE  31          HG22      ILE  31 -14.931  10.400   1.484
  214   HG23  ILE  31          HG23      ILE  31 -13.380  10.959   0.861
  215   HD11  ILE  31          HD11      ILE  31 -14.121   7.025   3.884
  216   HD12  ILE  31          HD12      ILE  31 -13.856   8.763   3.746
  217   HD13  ILE  31          HD13      ILE  31 -12.582   7.636   3.278
  218    H    LYS  32           H        LYS  32 -15.529  10.701  -0.933
  219    HA   LYS  32           HA       LYS  32 -18.022   9.580  -0.050
  220    HB2  LYS  32           HB3      LYS  32 -17.454  12.162  -1.514
  221    HB3  LYS  32           HB2      LYS  32 -18.958  11.749  -0.696
  222    HG2  LYS  32           HG3      LYS  32 -17.825  11.717   1.439
  223    HG3  LYS  32           HG2      LYS  32 -16.279  12.013   0.650
  224    HD2  LYS  32           HD3      LYS  32 -17.182  14.156  -0.187
  225    HD3  LYS  32           HD2      LYS  32 -18.647  13.872   0.755
  226    HE2  LYS  32           HE3      LYS  32 -15.845  14.126   1.833
  227    HE3  LYS  32           HE2      LYS  32 -17.112  15.343   1.951
  228    HZ1  LYS  32           HZ1      LYS  32 -17.141  12.649   3.200
  229    HZ2  LYS  32           HZ2      LYS  32 -18.417  13.754   3.264
  230    HZ3  LYS  32           HZ3      LYS  32 -16.943  14.126   4.002
  231    H    GLY  33           H        GLY  33 -16.283   9.441  -2.925
  232    HA2  GLY  33           HA3      GLY  33 -16.945   8.023  -4.708
  233    HA3  GLY  33           HA2      GLY  33 -18.627   8.322  -4.287
  234    H    LYS  34           H        LYS  34 -16.591  11.063  -4.376
  235    HA   LYS  34           HA       LYS  34 -17.991  12.002  -6.757
  236    HB2  LYS  34           HB3      LYS  34 -16.239  13.493  -4.800
  237    HB3  LYS  34           HB2      LYS  34 -17.176  14.223  -6.096
  238    HG2  LYS  34           HG3      LYS  34 -18.297  12.746  -3.727
  239    HG3  LYS  34           HG2      LYS  34 -18.260  14.490  -3.935
  240    HD2  LYS  34           HD3      LYS  34 -19.663  14.259  -5.944
  241    HD3  LYS  34           HD2      LYS  34 -19.742  12.518  -5.665
  242    HE2  LYS  34           HE3      LYS  34 -21.739  13.565  -4.801
  243    HE3  LYS  34           HE2      LYS  34 -20.769  12.944  -3.471
  244    HZ1  LYS  34           HZ1      LYS  34 -19.932  15.182  -3.092
  245    HZ2  LYS  34           HZ2      LYS  34 -21.614  15.142  -2.978
  246    HZ3  LYS  34           HZ3      LYS  34 -20.877  15.773  -4.361
  247    H    GLU  35           H        GLU  35 -16.995  12.501  -8.636
  248    HA   GLU  35           HA       GLU  35 -14.252  11.670  -8.996
  249    HB2  GLU  35           HB3      GLU  35 -15.918  11.180 -10.732
  250    HB3  GLU  35           HB2      GLU  35 -16.221  12.900 -10.937
  251    HG2  GLU  35           HG3      GLU  35 -13.894  13.197 -11.670
  252    HG3  GLU  35           HG2      GLU  35 -13.644  11.461 -11.522
  253    H    VAL  36           H        VAL  36 -12.626  12.975  -8.553
  254    HA   VAL  36           HA       VAL  36 -13.058  15.876  -8.775
  255    HB   VAL  36           HB       VAL  36 -11.343  16.172  -7.039
  256   HG11  VAL  36          HG11      VAL  36 -12.651  15.349  -5.131
  257   HG12  VAL  36          HG12      VAL  36 -13.594  14.339  -6.228
  258   HG13  VAL  36          HG13      VAL  36 -13.670  16.096  -6.360
  259   HG21  VAL  36          HG21      VAL  36 -10.073  14.122  -7.441
  260   HG22  VAL  36          HG22      VAL  36 -11.412  13.167  -6.805
  261   HG23  VAL  36          HG23      VAL  36 -10.535  14.275  -5.747
  262    H    THR  37           H        THR  37 -11.343  17.153  -9.513
  263    HA   THR  37           HA       THR  37  -9.578  15.795 -11.376
  264    HB   THR  37           HB       THR  37  -9.916  18.754 -10.880
  265    HG1  THR  37           HG1      THR  37 -11.699  17.155 -11.831
  266   HG21  THR  37          HG21      THR  37  -8.714  17.246 -13.203
  267   HG22  THR  37          HG22      THR  37  -7.823  18.187 -12.007
  268   HG23  THR  37          HG23      THR  37  -8.930  18.993 -13.117
  269    H    VAL  38           H        VAL  38  -7.559  15.323 -10.893
  270    HA   VAL  38           HA       VAL  38  -6.555  16.012  -8.286
  271    HB   VAL  38           HB       VAL  38  -5.377  14.288 -10.469
  272   HG11  VAL  38          HG11      VAL  38  -4.478  14.660  -7.617
  273   HG12  VAL  38          HG12      VAL  38  -3.615  15.192  -9.059
  274   HG13  VAL  38          HG13      VAL  38  -3.839  13.470  -8.750
  275   HG21  VAL  38          HG21      VAL  38  -7.440  13.401  -9.506
  276   HG22  VAL  38          HG22      VAL  38  -6.754  13.553  -7.887
  277   HG23  VAL  38          HG23      VAL  38  -6.048  12.423  -9.044
  278    H    LEU  39           H        LEU  39  -5.093  17.519  -7.824
  279    HA   LEU  39           HA       LEU  39  -3.867  18.986 -10.038
  280    HB2  LEU  39           HB3      LEU  39  -4.018  19.708  -7.104
  281    HB3  LEU  39           HB2      LEU  39  -3.416  20.734  -8.394
  282    HG   LEU  39           HG       LEU  39  -6.270  19.797  -8.101
  283   HD11  LEU  39          HD11      LEU  39  -5.634  21.388  -6.370
  284   HD12  LEU  39          HD12      LEU  39  -6.745  22.120  -7.527
  285   HD13  LEU  39          HD13      LEU  39  -5.022  22.493  -7.602
  286   HD21  LEU  39          HD21      LEU  39  -5.010  21.728 -10.041
  287   HD22  LEU  39          HD22      LEU  39  -6.738  21.410  -9.881
  288   HD23  LEU  39          HD23      LEU  39  -5.654  20.131 -10.426
  289    H    ALA  40           H        ALA  40  -2.145  17.670 -10.561
  290    HA   ALA  40           HA       ALA  40  -0.403  16.440  -8.737
  291    HB1  ALA  40           HB1      ALA  40   1.146  16.237 -10.606
  292    HB2  ALA  40           HB2      ALA  40   0.210  17.416 -11.526
  293    HB3  ALA  40           HB3      ALA  40  -0.498  15.853 -11.119
  294    H    GLU  41           H        GLU  41  -0.487  19.618 -10.165
  295    HA   GLU  41           HA       GLU  41   1.772  20.469  -8.488
  296    HB2  GLU  41           HB3      GLU  41   0.428  21.911 -10.786
  297    HB3  GLU  41           HB2      GLU  41   1.903  22.404  -9.966
  298    HG2  GLU  41           HG3      GLU  41   3.138  20.656 -10.897
  299    HG3  GLU  41           HG2      GLU  41   1.690  19.773 -11.375
  300    H    VAL  42           H        VAL  42   1.169  21.388  -6.614
  301    HA   VAL  42           HA       VAL  42  -1.582  22.375  -6.399
  302    HB   VAL  42           HB       VAL  42  -1.365  22.149  -3.992
  303   HG11  VAL  42          HG11      VAL  42  -2.052  20.188  -5.240
  304   HG12  VAL  42          HG12      VAL  42  -1.096  19.725  -3.832
  305   HG13  VAL  42          HG13      VAL  42  -0.367  19.704  -5.440
  306   HG21  VAL  42          HG21      VAL  42   0.991  22.754  -3.762
  307   HG22  VAL  42          HG22      VAL  42   1.455  21.220  -4.501
  308   HG23  VAL  42          HG23      VAL  42   0.628  21.234  -2.944
  309    H    ASN  43           H        ASN  43  -2.076  24.410  -5.768
  310    HA   ASN  43           HA       ASN  43   0.182  26.280  -5.472
  311    HB2  ASN  43           HB3      ASN  43  -2.631  26.833  -6.454
  312    HB3  ASN  43           HB2      ASN  43  -1.360  28.036  -6.278
  313   HD21  ASN  43          HD21      ASN  43  -2.555  25.379  -8.150
  314   HD22  ASN  43          HD22      ASN  43  -1.497  25.591  -9.500
  315    H    ILE  44           H        ILE  44   0.454  26.351  -3.295
  316    HA   ILE  44           HA       ILE  44  -1.920  26.966  -1.670
  317    HB   ILE  44           HB       ILE  44   0.817  26.123  -0.697
  318   HG12  ILE  44          HG13      ILE  44  -1.709  24.467  -0.924
  319   HG13  ILE  44          HG12      ILE  44  -0.325  24.339  -2.007
  320   HG21  ILE  44          HG21      ILE  44  -1.828  26.318   0.741
  321   HG22  ILE  44          HG22      ILE  44  -0.472  27.435   0.913
  322   HG23  ILE  44          HG23      ILE  44  -0.308  25.759   1.439
  323   HD11  ILE  44          HD11      ILE  44   1.072  23.667  -0.099
  324   HD12  ILE  44          HD12      ILE  44  -0.279  22.567  -0.368
  325   HD13  ILE  44          HD13      ILE  44  -0.347  23.742   0.946
  326    H    ASN  45           H        ASN  45  -2.037  29.125  -2.274
  327    HA   ASN  45           HA       ASN  45  -1.762  31.353  -1.991
  328    HB2  ASN  45           HB3      ASN  45   0.107  30.406   0.180
  329    HB3  ASN  45           HB2      ASN  45  -0.094  32.116  -0.177
  330   HD21  ASN  45          HD21      ASN  45  -2.731  29.823  -0.438
  331   HD22  ASN  45          HD22      ASN  45  -3.620  30.417   0.921
  332    H    ASN  46           H        ASN  46   1.589  30.398  -1.325
  333    HA   ASN  46           HA       ASN  46   2.367  31.520  -3.928
  334    HB2  ASN  46           HB3      ASN  46   4.291  32.653  -2.891
  335    HB3  ASN  46           HB2      ASN  46   2.771  33.268  -2.249
  336   HD21  ASN  46          HD21      ASN  46   5.666  31.490  -1.558
  337   HD22  ASN  46          HD22      ASN  46   5.453  31.421   0.159
  338    H    SER  47           H        SER  47   2.298  28.875  -2.070
  339    HA   SER  47           HA       SER  47   4.995  27.985  -2.823
  340    HB2  SER  47           HB3      SER  47   3.125  26.757  -0.779
  341    HB3  SER  47           HB2      SER  47   4.812  26.324  -1.059
  342    HG   SER  47           HG       SER  47   5.309  28.546  -0.475
  343    H    VAL  48           H        VAL  48   5.065  26.819  -4.594
  344    HA   VAL  48           HA       VAL  48   2.773  25.096  -5.273
  345    HB   VAL  48           HB       VAL  48   4.793  26.280  -7.186
  346   HG11  VAL  48          HG11      VAL  48   3.251  25.553  -8.927
  347   HG12  VAL  48          HG12      VAL  48   2.184  24.863  -7.704
  348   HG13  VAL  48          HG13      VAL  48   3.795  24.189  -7.950
  349   HG21  VAL  48          HG21      VAL  48   1.970  27.177  -6.628
  350   HG22  VAL  48          HG22      VAL  48   3.012  27.796  -7.907
  351   HG23  VAL  48          HG23      VAL  48   3.442  28.054  -6.217
  352    H    PHE  49           H        PHE  49   3.182  22.962  -5.236
  353    HA   PHE  49           HA       PHE  49   5.797  22.015  -6.073
  354    HB2  PHE  49           HB3      PHE  49   6.137  20.558  -4.158
  355    HB3  PHE  49           HB2      PHE  49   5.997  22.221  -3.609
  356    HD1  PHE  49           HD1      PHE  49   4.210  22.903  -2.173
  357    HD2  PHE  49           HD2      PHE  49   4.348  18.943  -3.731
  358    HE1  PHE  49           HE1      PHE  49   2.502  22.198  -0.541
  359    HE2  PHE  49           HE2      PHE  49   2.637  18.238  -2.110
  360    HZ   PHE  49           HZ       PHE  49   1.714  19.867  -0.513
  361    H    ARG  50           H        ARG  50   5.787  19.580  -6.295
  362    HA   ARG  50           HA       ARG  50   3.192  18.832  -7.443
  363    HB2  ARG  50           HB3      ARG  50   6.011  18.036  -8.163
  364    HB3  ARG  50           HB2      ARG  50   4.601  17.191  -8.788
  365    HG2  ARG  50           HG3      ARG  50   3.791  19.287  -9.751
  366    HG3  ARG  50           HG2      ARG  50   5.242  20.104  -9.172
  367    HD2  ARG  50           HD3      ARG  50   6.632  18.787 -10.604
  368    HD3  ARG  50           HD2      ARG  50   5.278  17.742 -11.042
  369    HE   ARG  50           HE       ARG  50   4.702  20.435 -11.695
  370   HH11  ARG  50          HH11      ARG  50   6.669  17.754 -12.761
  371   HH12  ARG  50          HH12      ARG  50   6.643  18.231 -14.428
  372   HH21  ARG  50          HH21      ARG  50   4.631  21.063 -13.873
  373   HH22  ARG  50          HH22      ARG  50   5.481  20.123 -15.066
  374    H    GLN  51           H        GLN  51   2.192  17.002  -6.904
  375    HA   GLN  51           HA       GLN  51   3.443  15.410  -4.771
  376    HB2  GLN  51           HB3      GLN  51   1.320  15.046  -3.826
  377    HB3  GLN  51           HB2      GLN  51   1.313  16.742  -4.278
  378    HG2  GLN  51           HG3      GLN  51   0.090  16.090  -6.363
  379    HG3  GLN  51           HG2      GLN  51  -0.039  14.461  -5.702
  380   HE21  GLN  51          HE21      GLN  51  -1.241  17.665  -5.638
  381   HE22  GLN  51          HE22      GLN  51  -2.508  17.404  -4.485
  382    H    TYR  52           H        TYR  52   3.324  13.139  -4.895
  383    HA   TYR  52           HA       TYR  52   2.559  12.116  -7.549
  384    HB2  TYR  52           HB3      TYR  52   4.769  11.005  -5.803
  385    HB3  TYR  52           HB2      TYR  52   4.404  10.564  -7.467
  386    HD1  TYR  52           HD1      TYR  52   4.385  12.771  -9.091
  387    HD2  TYR  52           HD2      TYR  52   6.628  12.309  -5.504
  388    HE1  TYR  52           HE1      TYR  52   5.982  14.467  -9.875
  389    HE2  TYR  52           HE2      TYR  52   8.229  14.006  -6.280
  390    HH   TYR  52           HH       TYR  52   8.993  14.937  -8.479
  391    H    PHE  53           H        PHE  53   1.782   9.943  -7.629
  392    HA   PHE  53           HA       PHE  53   0.689   8.998  -5.058
  393    HB2  PHE  53           HB3      PHE  53  -0.593   8.773  -7.793
  394    HB3  PHE  53           HB2      PHE  53  -1.290   8.223  -6.270
  395    HD1  PHE  53           HD1      PHE  53  -1.900   9.900  -4.540
  396    HD2  PHE  53           HD2      PHE  53  -0.787  11.007  -8.489
  397    HE1  PHE  53           HE1      PHE  53  -2.917  12.110  -4.199
  398    HE2  PHE  53           HE2      PHE  53  -1.801  13.222  -8.160
  399    HZ   PHE  53           HZ       PHE  53  -2.865  13.776  -6.011
  400    H    PHE  54           H        PHE  54   1.235   7.002  -4.500
  401    HA   PHE  54           HA       PHE  54   2.721   5.350  -6.347
  402    HB2  PHE  54           HB3      PHE  54   2.881   3.819  -4.299
  403    HB3  PHE  54           HB2      PHE  54   3.657   5.392  -4.173
  404    HD1  PHE  54           HD1      PHE  54   1.100   3.198  -2.855
  405    HD2  PHE  54           HD2      PHE  54   2.586   7.188  -2.841
  406    HE1  PHE  54           HE1      PHE  54  -0.168   3.662  -0.802
  407    HE2  PHE  54           HE2      PHE  54   1.318   7.656  -0.787
  408    HZ   PHE  54           HZ       PHE  54  -0.060   5.892   0.234
  409    H    GLU  55           H        GLU  55   1.485   4.358  -7.818
  410    HA   GLU  55           HA       GLU  55  -0.926   2.962  -6.863
  411    HB2  GLU  55           HB3      GLU  55  -0.191   3.679  -9.714
  412    HB3  GLU  55           HB2      GLU  55  -1.700   2.951  -9.181
  413    HG2  GLU  55           HG3      GLU  55  -2.021   5.056  -7.769
  414    HG3  GLU  55           HG2      GLU  55  -0.712   5.750  -8.727
  415    H    THR  56           H        THR  56  -0.574   0.913  -6.440
  416    HA   THR  56           HA       THR  56   1.408  -0.578  -7.996
  417    HB   THR  56           HB       THR  56  -0.125  -1.473  -5.545
  418    HG1  THR  56           HG1      THR  56   1.252  -0.232  -4.531
  419   HG21  THR  56          HG21      THR  56   1.595  -3.222  -5.412
  420   HG22  THR  56          HG22      THR  56   2.314  -2.628  -6.908
  421   HG23  THR  56          HG23      THR  56   0.692  -3.322  -6.925
  422    H    LYS  57           H        LYS  57   0.579  -1.296  -9.834
  423    HA   LYS  57           HA       LYS  57  -2.225  -2.164  -9.888
  424    HB2  LYS  57           HB3      LYS  57  -0.369  -1.382 -12.148
  425    HB3  LYS  57           HB2      LYS  57  -2.057  -1.842 -12.333
  426    HG2  LYS  57           HG3      LYS  57  -2.741   0.087 -11.012
  427    HG3  LYS  57           HG2      LYS  57  -1.055   0.547 -10.792
  428    HD2  LYS  57           HD3      LYS  57  -1.967   1.892 -12.542
  429    HD3  LYS  57           HD2      LYS  57  -0.862   0.729 -13.272
  430    HE2  LYS  57           HE3      LYS  57  -2.774  -0.682 -13.873
  431    HE3  LYS  57           HE2      LYS  57  -3.864   0.507 -13.166
  432    HZ1  LYS  57           HZ1      LYS  57  -2.053   0.966 -15.472
  433    HZ2  LYS  57           HZ2      LYS  57  -3.066   2.128 -14.781
  434    HZ3  LYS  57           HZ3      LYS  57  -3.732   0.777 -15.548
  435    H    CYS  58           H        CYS  58  -2.797  -4.045 -11.060
  436    HA   CYS  58           HA       CYS  58  -0.949  -6.210 -10.615
  437    HB2  CYS  58           HB3      CYS  58  -3.749  -6.207 -11.773
  438    HB3  CYS  58           HB2      CYS  58  -2.831  -7.647 -11.349
  439    H    ARG  59           H        ARG  59   0.622  -6.532 -12.060
  440    HA   ARG  59           HA       ARG  59  -0.017  -6.299 -14.911
  441    HB2  ARG  59           HB3      ARG  59   2.413  -6.472 -15.291
  442    HB3  ARG  59           HB2      ARG  59   2.010  -5.138 -14.223
  443    HG2  ARG  59           HG3      ARG  59   2.699  -6.420 -12.304
  444    HG3  ARG  59           HG2      ARG  59   3.019  -7.823 -13.324
  445    HD2  ARG  59           HD3      ARG  59   4.413  -5.159 -13.512
  446    HD3  ARG  59           HD2      ARG  59   5.073  -6.600 -12.749
  447    HE   ARG  59           HE       ARG  59   4.398  -7.292 -15.351
  448   HH11  ARG  59          HH11      ARG  59   6.609  -5.114 -13.736
  449   HH12  ARG  59          HH12      ARG  59   7.788  -5.166 -15.004
  450   HH21  ARG  59          HH21      ARG  59   5.950  -7.365 -17.025
  451   HH22  ARG  59          HH22      ARG  59   7.416  -6.448 -16.878
  452    H    ALA  60           H        ALA  60  -0.725  -8.408 -12.874
  453    HA   ALA  60           HA       ALA  60  -0.588 -10.657 -14.602
  454    HB1  ALA  60           HB1      ALA  60   0.680 -12.149 -13.127
  455    HB2  ALA  60           HB2      ALA  60   1.010 -10.803 -12.036
  456    HB3  ALA  60           HB3      ALA  60   1.685 -10.804 -13.665
  457    H    SER  61           H        SER  61  -1.552 -12.617 -13.346
  458    HA   SER  61           HA       SER  61  -3.157 -11.842 -11.053
  459    HB2  SER  61           HB3      SER  61  -4.548 -11.240 -13.015
  460    HB3  SER  61           HB2      SER  61  -4.450 -12.910 -13.573
  461    HG   SER  61           HG       SER  61  -5.638 -13.568 -11.841
  462    H    ASN  62           H        ASN  62  -2.000 -14.273 -13.270
  463    HA   ASN  62           HA       ASN  62  -1.990 -16.198 -11.071
  464    HB2  ASN  62           HB3      ASN  62  -2.926 -16.878 -13.878
  465    HB3  ASN  62           HB2      ASN  62  -2.750 -18.012 -12.543
  466   HD21  ASN  62          HD21      ASN  62  -4.196 -17.831 -10.759
  467   HD22  ASN  62          HD22      ASN  62  -5.742 -17.084 -10.944
  468    HA   PRO  63           HA       PRO  63   2.055 -15.234 -13.144
  469    HB2  PRO  63           HB3      PRO  63   3.483 -16.275 -10.962
  470    HB3  PRO  63           HB2      PRO  63   3.098 -14.572 -11.245
  471    HG2  PRO  63           HG3      PRO  63   1.729 -16.576  -9.519
  472    HG3  PRO  63           HG2      PRO  63   1.975 -14.842  -9.248
  473    HD2  PRO  63           HD3      PRO  63  -0.417 -15.792  -9.992
  474    HD3  PRO  63           HD2      PRO  63   0.190 -14.242 -10.634
  475    H    VAL  64           H        VAL  64   1.311 -18.242 -11.382
  476    HA   VAL  64           HA       VAL  64   3.347 -19.646 -12.877
  477    HB   VAL  64           HB       VAL  64   2.483 -21.676 -11.602
  478   HG11  VAL  64          HG11      VAL  64   4.500 -20.435 -10.999
  479   HG12  VAL  64          HG12      VAL  64   3.654 -21.024  -9.572
  480   HG13  VAL  64          HG13      VAL  64   3.530 -19.325 -10.031
  481   HG21  VAL  64          HG21      VAL  64   0.273 -20.835 -11.015
  482   HG22  VAL  64          HG22      VAL  64   1.006 -19.533 -10.080
  483   HG23  VAL  64          HG23      VAL  64   1.205 -21.207  -9.564
  484    H    GLU  65           H        GLU  65  -0.188 -19.998 -12.518
  485    HA   GLU  65           HA       GLU  65  -0.561 -20.582 -15.250
  486    HB2  GLU  65           HB3      GLU  65  -1.342 -22.984 -14.900
  487    HB3  GLU  65           HB2      GLU  65   0.391 -22.707 -14.918
  488    HG2  GLU  65           HG3      GLU  65   0.349 -22.707 -12.433
  489    HG3  GLU  65           HG2      GLU  65  -1.350 -23.161 -12.515
  490    H    SER  66           H        SER  66  -2.123 -21.795 -12.248
  491    HA   SER  66           HA       SER  66  -4.554 -20.390 -13.139
  492    HB2  SER  66           HB3      SER  66  -4.457 -23.045 -11.688
  493    HB3  SER  66           HB2      SER  66  -5.892 -22.240 -12.324
  494    HG   SER  66           HG       SER  66  -4.480 -22.384 -14.406
  495    H    GLY  67           H        GLY  67  -2.265 -20.703 -10.696
  496    HA2  GLY  67           HA3      GLY  67  -4.032 -19.253  -8.849
  497    HA3  GLY  67           HA2      GLY  67  -3.071 -20.612  -8.266
  498    H    CYS  68           H        CYS  68  -2.349 -18.781  -6.813
  499    HA   CYS  68           HA       CYS  68  -0.324 -17.103  -8.098
  500    HB2  CYS  68           HB3      CYS  68  -1.666 -16.899  -5.398
  501    HB3  CYS  68           HB2      CYS  68  -0.321 -15.870  -5.898
  502    H    ARG  69           H        ARG  69   0.852 -19.221  -8.266
  503    HA   ARG  69           HA       ARG  69   2.894 -20.126  -7.911
  504    HB2  ARG  69           HB3      ARG  69   3.083 -18.302  -5.509
  505    HB3  ARG  69           HB2      ARG  69   4.413 -19.188  -6.247
  506    HG2  ARG  69           HG3      ARG  69   4.038 -17.882  -8.334
  507    HG3  ARG  69           HG2      ARG  69   2.826 -16.938  -7.466
  508    HD2  ARG  69           HD3      ARG  69   4.845 -15.689  -7.402
  509    HD3  ARG  69           HD2      ARG  69   4.608 -16.373  -5.792
  510    HE   ARG  69           HE       ARG  69   6.182 -18.186  -7.138
  511   HH11  ARG  69          HH11      ARG  69   6.396 -14.820  -6.184
  512   HH12  ARG  69          HH12      ARG  69   8.131 -14.798  -6.186
  513   HH21  ARG  69          HH21      ARG  69   8.473 -18.165  -7.125
  514   HH22  ARG  69          HH22      ARG  69   9.313 -16.702  -6.725
  515    H    GLY  70           H        GLY  70   1.844 -19.570  -4.557
  516    HA2  GLY  70           HA3      GLY  70   2.398 -22.407  -4.054
  517    HA3  GLY  70           HA2      GLY  70   2.254 -21.156  -2.830
  518    H    ILE  71           H        ILE  71  -0.265 -20.315  -4.484
  519    HA   ILE  71           HA       ILE  71  -2.097 -21.479  -2.673
  520    HB   ILE  71           HB       ILE  71  -2.685 -20.042  -5.266
  521   HG12  ILE  71          HG13      ILE  71  -1.382 -18.679  -3.658
  522   HG13  ILE  71          HG12      ILE  71  -3.007 -18.052  -3.898
  523   HG21  ILE  71          HG21      ILE  71  -4.464 -20.645  -2.906
  524   HG22  ILE  71          HG22      ILE  71  -4.576 -21.361  -4.514
  525   HG23  ILE  71          HG23      ILE  71  -4.901 -19.642  -4.290
  526   HD11  ILE  71          HD11      ILE  71  -2.385 -17.942  -1.567
  527   HD12  ILE  71          HD12      ILE  71  -2.058 -19.674  -1.548
  528   HD13  ILE  71          HD13      ILE  71  -3.705 -19.090  -1.790
  529    H    ASP  72           H        ASP  72  -3.036 -23.394  -2.723
  530    HA   ASP  72           HA       ASP  72  -2.864 -25.183  -4.918
  531    HB2  ASP  72           HB3      ASP  72  -3.088 -25.966  -2.587
  532    HB3  ASP  72           HB2      ASP  72  -4.707 -25.276  -2.513
  533    H    SER  73           H        SER  73  -3.855 -24.760  -6.770
  534    HA   SER  73           HA       SER  73  -6.083 -23.022  -6.983
  535    HB2  SER  73           HB3      SER  73  -5.995 -23.757  -9.420
  536    HB3  SER  73           HB2      SER  73  -4.509 -23.050  -8.777
  537    HG   SER  73           HG       SER  73  -3.693 -24.834  -9.580
  538    H    LYS  74           H        LYS  74  -5.901 -26.319  -6.256
  539    HA   LYS  74           HA       LYS  74  -8.343 -27.093  -7.566
  540    HB2  LYS  74           HB3      LYS  74  -6.472 -28.683  -7.165
  541    HB3  LYS  74           HB2      LYS  74  -6.768 -28.555  -5.441
  542    HG2  LYS  74           HG3      LYS  74  -9.053 -29.436  -5.814
  543    HG3  LYS  74           HG2      LYS  74  -8.641 -29.669  -7.513
  544    HD2  LYS  74           HD3      LYS  74  -7.236 -30.941  -5.173
  545    HD3  LYS  74           HD2      LYS  74  -8.396 -31.740  -6.232
  546    HE2  LYS  74           HE3      LYS  74  -6.875 -31.270  -8.140
  547    HE3  LYS  74           HE2      LYS  74  -5.704 -30.629  -6.993
  548    HZ1  LYS  74           HZ1      LYS  74  -5.690 -32.807  -5.901
  549    HZ2  LYS  74           HZ2      LYS  74  -5.173 -32.894  -7.506
  550    HZ3  LYS  74           HZ3      LYS  74  -6.726 -33.412  -7.091
  551    H    HIS  75           H        HIS  75  -7.349 -26.010  -4.398
  552    HA   HIS  75           HA       HIS  75 -10.068 -26.420  -3.385
  553    HB2  HIS  75           HB3      HIS  75  -8.154 -27.183  -1.987
  554    HB3  HIS  75           HB2      HIS  75  -7.590 -25.518  -1.892
  555    HD1  HIS  75           HD1      HIS  75  -8.117 -24.610   0.346
  556    HD2  HIS  75           HD2      HIS  75 -11.135 -27.107  -1.048
  557    HE1  HIS  75           HE1      HIS  75  -9.893 -24.578   2.122
  558    HE2  HIS  75           HE2      HIS  75 -11.598 -26.263   1.349
  559    H    TRP  76           H        TRP  76  -7.840 -23.905  -4.329
  560    HA   TRP  76           HA       TRP  76  -9.890 -21.918  -3.616
  561    HB2  TRP  76           HB3      TRP  76  -6.906 -21.758  -3.224
  562    HB3  TRP  76           HB2      TRP  76  -7.914 -20.316  -3.295
  563    HD1  TRP  76           HD1      TRP  76  -6.523 -22.675  -0.878
  564    HE1  TRP  76           HE1      TRP  76  -7.699 -22.459   1.401
  565    HE3  TRP  76           HE3      TRP  76 -10.599 -19.936  -2.319
  566    HZ2  TRP  76           HZ2      TRP  76 -10.045 -21.291   2.444
  567    HZ3  TRP  76           HZ3      TRP  76 -12.261 -19.314  -0.617
  568    HH2  TRP  76           HH2      TRP  76 -11.988 -19.979   1.716
  569    H    ASN  77           H        ASN  77 -10.394 -20.443  -5.095
  570    HA   ASN  77           HA       ASN  77  -8.949 -20.410  -7.639
  571    HB2  ASN  77           HB3      ASN  77 -11.382 -20.457  -7.803
  572    HB3  ASN  77           HB2      ASN  77 -11.517 -19.076  -6.736
  573   HD21  ASN  77          HD21      ASN  77  -9.299 -19.561  -9.451
  574   HD22  ASN  77          HD22      ASN  77  -9.886 -18.226 -10.385
  575    H    SER  78           H        SER  78  -7.657 -18.697  -8.223
  576    HA   SER  78           HA       SER  78  -7.475 -16.507  -6.269
  577    HB2  SER  78           HB3      SER  78  -5.125 -17.825  -7.642
  578    HB3  SER  78           HB2      SER  78  -5.059 -16.550  -6.426
  579    HG   SER  78           HG       SER  78  -6.513 -18.532  -5.443
  580    H    TYR  79           H        TYR  79  -7.308 -14.512  -7.044
  581    HA   TYR  79           HA       TYR  79  -6.174 -14.041  -9.642
  582    HB2  TYR  79           HB3      TYR  79  -8.104 -12.604 -10.392
  583    HB3  TYR  79           HB2      TYR  79  -8.422 -14.334 -10.394
  584    HD1  TYR  79           HD1      TYR  79  -9.408 -11.110  -9.068
  585    HD2  TYR  79           HD2      TYR  79  -9.880 -15.318  -8.622
  586    HE1  TYR  79           HE1      TYR  79 -11.472 -10.740  -7.778
  587    HE2  TYR  79           HE2      TYR  79 -11.938 -14.956  -7.328
  588    HH   TYR  79           HH       TYR  79 -12.993 -13.205  -5.982
  589    H    CYS  80           H        CYS  80  -5.313 -12.020  -9.851
  590    HA   CYS  80           HA       CYS  80  -4.818 -10.700  -7.337
  591    HB2  CYS  80           HB3      CYS  80  -3.772 -10.120 -10.119
  592    HB3  CYS  80           HB2      CYS  80  -3.200  -9.353  -8.636
  593    H    THR  81           H        THR  81  -5.870  -9.026  -6.591
  594    HA   THR  81           HA       THR  81  -7.238  -7.230  -8.480
  595    HB   THR  81           HB       THR  81  -8.327  -8.110  -5.790
  596    HG1  THR  81           HG1      THR  81  -8.297  -9.637  -7.724
  597   HG21  THR  81          HG21      THR  81  -9.604  -6.497  -8.005
  598   HG22  THR  81          HG22      THR  81  -9.022  -5.852  -6.471
  599   HG23  THR  81          HG23      THR  81 -10.375  -6.982  -6.495
  600    H    THR  82           H        THR  82  -6.993  -5.060  -8.038
  601    HA   THR  82           HA       THR  82  -5.007  -4.397  -6.056
  602    HB   THR  82           HB       THR  82  -5.367  -2.041  -6.994
  603    HG1  THR  82           HG1      THR  82  -6.592  -1.820  -8.767
  604   HG21  THR  82          HG21      THR  82  -4.428  -4.261  -8.809
  605   HG22  THR  82          HG22      THR  82  -3.459  -3.407  -7.609
  606   HG23  THR  82          HG23      THR  82  -4.068  -2.548  -9.024
  607    H    THR  83           H        THR  83  -5.450  -3.840  -4.061
  608    HA   THR  83           HA       THR  83  -8.088  -3.087  -3.214
  609    HB   THR  83           HB       THR  83  -5.502  -2.837  -1.664
  610    HG1  THR  83           HG1      THR  83  -7.119  -5.060  -2.279
  611   HG21  THR  83          HG21      THR  83  -6.955  -3.092   0.296
  612   HG22  THR  83          HG22      THR  83  -8.367  -3.176  -0.759
  613   HG23  THR  83          HG23      THR  83  -7.423  -1.689  -0.664
  614    H    HIS  84           H        HIS  84  -8.860  -1.039  -2.875
  615    HA   HIS  84           HA       HIS  84  -7.095   1.123  -3.801
  616    HB2  HIS  84           HB3      HIS  84 -10.119   0.941  -3.809
  617    HB3  HIS  84           HB2      HIS  84  -9.203   2.357  -4.316
  618    HD1  HIS  84           HD1      HIS  84 -10.362  -0.952  -5.465
  619    HD2  HIS  84           HD2      HIS  84  -7.735   1.996  -6.754
  620    HE1  HIS  84           HE1      HIS  84  -9.831  -1.517  -7.855
  621    HE2  HIS  84           HE2      HIS  84  -8.048   0.134  -8.516
  622    H    THR  85           H        THR  85  -6.414   2.548  -2.377
  623    HA   THR  85           HA       THR  85  -7.883   2.774   0.172
  624    HB   THR  85           HB       THR  85  -5.402   2.011   0.164
  625    HG1  THR  85           HG1      THR  85  -5.169   2.976   2.140
  626   HG21  THR  85          HG21      THR  85  -4.573   3.702  -1.413
  627   HG22  THR  85          HG22      THR  85  -3.759   3.830   0.146
  628   HG23  THR  85          HG23      THR  85  -5.027   4.978  -0.283
  629    H    PHE  86           H        PHE  86  -7.788   4.976   1.168
  630    HA   PHE  86           HA       PHE  86  -8.212   6.967  -0.948
  631    HB2  PHE  86           HB3      PHE  86  -9.238   6.988   1.909
  632    HB3  PHE  86           HB2      PHE  86  -9.638   8.155   0.647
  633    HD1  PHE  86           HD1      PHE  86 -10.915   7.373  -1.370
  634    HD2  PHE  86           HD2      PHE  86 -10.433   4.981   2.117
  635    HE1  PHE  86           HE1      PHE  86 -12.815   5.979  -2.072
  636    HE2  PHE  86           HE2      PHE  86 -12.333   3.581   1.422
  637    HZ   PHE  86           HZ       PHE  86 -13.526   4.077  -0.672
  638    H    VAL  87           H        VAL  87  -6.685   8.435  -1.195
  639    HA   VAL  87           HA       VAL  87  -4.854   8.915   1.054
  640    HB   VAL  87           HB       VAL  87  -3.213   9.674  -0.670
  641   HG11  VAL  87          HG11      VAL  87  -3.068   7.440   0.233
  642   HG12  VAL  87          HG12      VAL  87  -2.660   7.423  -1.483
  643   HG13  VAL  87          HG13      VAL  87  -4.243   6.860  -0.947
  644   HG21  VAL  87          HG21      VAL  87  -5.220   8.548  -2.620
  645   HG22  VAL  87          HG22      VAL  87  -3.583   9.074  -3.006
  646   HG23  VAL  87          HG23      VAL  87  -4.776  10.248  -2.455
  647    H    LYS  88           H        LYS  88  -4.445  10.890   1.753
  648    HA   LYS  88           HA       LYS  88  -6.218  13.022   1.175
  649    HB2  LYS  88           HB3      LYS  88  -4.637  14.322   2.701
  650    HB3  LYS  88           HB2      LYS  88  -5.419  12.911   3.398
  651    HG2  LYS  88           HG3      LYS  88  -3.298  11.633   2.853
  652    HG3  LYS  88           HG2      LYS  88  -2.562  13.195   2.509
  653    HD2  LYS  88           HD3      LYS  88  -2.902  13.936   4.740
  654    HD3  LYS  88           HD2      LYS  88  -3.929  12.550   5.112
  655    HE2  LYS  88           HE3      LYS  88  -1.850  12.073   6.098
  656    HE3  LYS  88           HE2      LYS  88  -1.902  11.104   4.628
  657    HZ1  LYS  88           HZ1      LYS  88  -0.594  12.912   3.544
  658    HZ2  LYS  88           HZ2      LYS  88   0.230  12.104   4.779
  659    HZ3  LYS  88           HZ3      LYS  88  -0.421  13.637   5.067
  660    H    ALA  89           H        ALA  89  -6.163  13.940  -0.738
  661    HA   ALA  89           HA       ALA  89  -3.601  15.031  -1.700
  662    HB1  ALA  89           HB1      ALA  89  -4.209  13.004  -2.978
  663    HB2  ALA  89           HB2      ALA  89  -4.169  14.458  -3.974
  664    HB3  ALA  89           HB3      ALA  89  -5.715  13.787  -3.454
  665    H    LEU  90           H        LEU  90  -3.685  17.119  -2.412
  666    HA   LEU  90           HA       LEU  90  -6.103  18.617  -2.128
  667    HB2  LEU  90           HB3      LEU  90  -3.828  19.603  -1.775
  668    HB3  LEU  90           HB2      LEU  90  -3.531  19.438  -3.501
  669    HG   LEU  90           HG       LEU  90  -5.572  20.930  -3.851
  670   HD11  LEU  90          HD11      LEU  90  -5.127  21.422  -0.913
  671   HD12  LEU  90          HD12      LEU  90  -6.570  20.743  -1.666
  672   HD13  LEU  90          HD13      LEU  90  -6.123  22.421  -1.972
  673   HD21  LEU  90          HD21      LEU  90  -4.290  22.988  -3.415
  674   HD22  LEU  90          HD22      LEU  90  -3.335  21.746  -4.218
  675   HD23  LEU  90          HD23      LEU  90  -3.122  22.042  -2.493
  676    H    THR  91           H        THR  91  -7.711  18.315  -3.507
  677    HA   THR  91           HA       THR  91  -7.093  18.212  -6.383
  678    HB   THR  91           HB       THR  91  -8.901  16.540  -6.683
  679    HG1  THR  91           HG1      THR  91  -8.845  16.387  -3.836
  680   HG21  THR  91          HG21      THR  91  -7.693  14.605  -5.889
  681   HG22  THR  91          HG22      THR  91  -6.827  15.585  -4.707
  682   HG23  THR  91          HG23      THR  91  -6.529  15.814  -6.427
  683    H    THR  92           H        THR  92  -9.027  18.771  -7.724
  684    HA   THR  92           HA       THR  92 -10.766  20.617  -6.236
  685    HB   THR  92           HB       THR  92  -9.324  21.954  -7.604
  686    HG1  THR  92           HG1      THR  92 -11.065  22.610  -9.277
  687   HG21  THR  92          HG21      THR  92  -9.072  21.695  -9.982
  688   HG22  THR  92          HG22      THR  92 -10.228  20.366  -9.999
  689   HG23  THR  92          HG23      THR  92  -8.667  20.165  -9.203
  690    H    ASP  93           H        ASP  93 -12.802  20.043  -6.188
  691    HA   ASP  93           HA       ASP  93 -13.804  17.959  -7.893
  692    HB2  ASP  93           HB3      ASP  93 -15.938  18.285  -6.655
  693    HB3  ASP  93           HB2      ASP  93 -14.560  18.024  -5.592
  694    H    GLU  94           H        GLU  94 -13.465  21.262  -8.218
  695    HA   GLU  94           HA       GLU  94 -14.874  21.249 -10.701
  696    HB2  GLU  94           HB3      GLU  94 -16.727  21.671  -9.084
  697    HB3  GLU  94           HB2      GLU  94 -15.893  23.123  -8.559
  698    HG2  GLU  94           HG3      GLU  94 -17.650  23.676 -10.105
  699    HG3  GLU  94           HG2      GLU  94 -16.078  24.044 -10.807
  700    H    LYS  95           H        LYS  95 -14.264  23.977  -8.507
  701    HA   LYS  95           HA       LYS  95 -11.839  24.636  -9.992
  702    HB2  LYS  95           HB3      LYS  95 -12.574  27.005 -10.240
  703    HB3  LYS  95           HB2      LYS  95 -13.527  25.877 -11.194
  704    HG2  LYS  95           HG3      LYS  95 -15.300  25.957  -9.520
  705    HG3  LYS  95           HG2      LYS  95 -14.339  27.082  -8.558
  706    HD2  LYS  95           HD3      LYS  95 -14.379  28.685 -10.400
  707    HD3  LYS  95           HD2      LYS  95 -15.354  27.568 -11.356
  708    HE2  LYS  95           HE3      LYS  95 -17.118  27.686  -9.657
  709    HE3  LYS  95           HE2      LYS  95 -16.140  28.819  -8.728
  710    HZ1  LYS  95           HZ1      LYS  95 -16.278  30.401 -10.511
  711    HZ2  LYS  95           HZ2      LYS  95 -17.843  29.912 -10.098
  712    HZ3  LYS  95           HZ3      LYS  95 -17.111  29.303 -11.491
  713    H    GLN  96           H        GLN  96 -12.489  23.669  -7.313
  714    HA   GLN  96           HA       GLN  96 -11.213  25.799  -5.749
  715    HB2  GLN  96           HB3      GLN  96 -13.548  24.082  -4.870
  716    HB3  GLN  96           HB2      GLN  96 -12.623  25.115  -3.796
  717    HG2  GLN  96           HG3      GLN  96 -14.102  26.143  -6.201
  718    HG3  GLN  96           HG2      GLN  96 -14.813  26.039  -4.591
  719   HE21  GLN  96          HE21      GLN  96 -12.469  27.650  -6.597
  720   HE22  GLN  96          HE22      GLN  96 -12.180  28.977  -5.528
  721    H    ALA  97           H        ALA  97  -9.335  25.049  -5.036
  722    HA   ALA  97           HA       ALA  97  -8.745  22.237  -5.071
  723    HB1  ALA  97           HB1      ALA  97  -7.066  24.551  -4.109
  724    HB2  ALA  97           HB2      ALA  97  -7.060  23.871  -5.737
  725    HB3  ALA  97           HB3      ALA  97  -6.503  22.901  -4.374
  726    H    ALA  98           H        ALA  98  -9.345  20.923  -3.502
  727    HA   ALA  98           HA       ALA  98  -9.140  21.856  -0.724
  728    HB1  ALA  98           HB1      ALA  98 -11.390  20.203  -1.869
  729    HB2  ALA  98           HB2      ALA  98 -11.497  21.893  -1.378
  730    HB3  ALA  98           HB3      ALA  98 -11.193  20.643  -0.172
  731    H    TRP  99           H        TRP  99  -8.510  20.305   0.772
  732    HA   TRP  99           HA       TRP  99  -7.001  18.107  -0.303
  733    HB2  TRP  99           HB3      TRP  99  -7.564  18.876   2.576
  734    HB3  TRP  99           HB2      TRP  99  -6.412  17.650   2.062
  735    HD1  TRP  99           HD1      TRP  99  -6.829  21.414   2.373
  736    HE1  TRP  99           HE1      TRP  99  -4.581  22.562   1.868
  737    HE3  TRP  99           HE3      TRP  99  -4.224  17.364   0.657
  738    HZ2  TRP  99           HZ2      TRP  99  -2.040  21.841   0.871
  739    HZ3  TRP  99           HZ3      TRP  99  -1.886  17.683  -0.057
  740    HH2  TRP  99           HH2      TRP  99  -0.821  19.874   0.052
  741    H    ARG 100           H        ARG 100  -8.143  16.486  -1.091
  742    HA   ARG 100           HA       ARG 100 -10.473  15.493   0.407
  743    HB2  ARG 100           HB3      ARG 100  -9.663  14.959  -2.465
  744    HB3  ARG 100           HB2      ARG 100 -11.149  14.424  -1.698
  745    HG2  ARG 100           HG3      ARG 100 -10.405  17.306  -2.132
  746    HG3  ARG 100           HG2      ARG 100 -11.415  16.359  -3.216
  747    HD2  ARG 100           HD3      ARG 100 -12.952  15.950  -1.276
  748    HD3  ARG 100           HD2      ARG 100 -11.995  17.115  -0.360
  749    HE   ARG 100           HE       ARG 100 -12.879  18.174  -2.858
  750   HH11  ARG 100          HH11      ARG 100 -13.863  17.552   0.437
  751   HH12  ARG 100          HH12      ARG 100 -15.107  18.760   0.431
  752   HH21  ARG 100          HH21      ARG 100 -14.535  19.756  -2.895
  753   HH22  ARG 100          HH22      ARG 100 -15.497  20.003  -1.466
  754    H    PHE 101           H        PHE 101 -10.782  13.041  -0.087
  755    HA   PHE 101           HA       PHE 101  -8.184  11.668   0.168
  756    HB2  PHE 101           HB3      PHE 101 -10.824  11.049   1.523
  757    HB3  PHE 101           HB2      PHE 101  -9.514   9.884   1.425
  758    HD1  PHE 101           HD1      PHE 101 -10.513  13.150   2.841
  759    HD2  PHE 101           HD2      PHE 101  -7.633  10.010   2.834
  760    HE1  PHE 101           HE1      PHE 101  -9.508  14.066   4.887
  761    HE2  PHE 101           HE2      PHE 101  -6.623  10.930   4.877
  762    HZ   PHE 101           HZ       PHE 101  -7.561  12.959   5.907
  763    H    ILE 102           H        ILE 102  -7.795  10.671  -1.722
  764    HA   ILE 102           HA       ILE 102 -10.144   9.810  -3.287
  765    HB   ILE 102           HB       ILE 102  -8.706  10.067  -5.304
  766   HG12  ILE 102          HG13      ILE 102  -6.807  11.483  -3.424
  767   HG13  ILE 102          HG12      ILE 102  -6.520   9.888  -4.110
  768   HG21  ILE 102          HG21      ILE 102  -9.083  12.537  -3.621
  769   HG22  ILE 102          HG22      ILE 102 -10.282  11.798  -4.684
  770   HG23  ILE 102          HG23      ILE 102  -8.823  12.516  -5.365
  771   HD11  ILE 102          HD11      ILE 102  -6.528  10.864  -6.351
  772   HD12  ILE 102          HD12      ILE 102  -5.294  11.586  -5.318
  773   HD13  ILE 102          HD13      ILE 102  -6.791  12.460  -5.648
  774    H    ARG 103           H        ARG 103 -10.124   7.869  -4.358
  775    HA   ARG 103           HA       ARG 103  -8.563   5.876  -2.966
  776    HB2  ARG 103           HB3      ARG 103 -10.039   4.246  -4.028
  777    HB3  ARG 103           HB2      ARG 103 -10.974   5.540  -3.292
  778    HG2  ARG 103           HG3      ARG 103 -11.044   6.575  -5.622
  779    HG3  ARG 103           HG2      ARG 103 -10.475   5.009  -6.197
  780    HD2  ARG 103           HD3      ARG 103 -12.852   4.997  -6.360
  781    HD3  ARG 103           HD2      ARG 103 -12.417   3.968  -4.995
  782    HE   ARG 103           HE       ARG 103 -12.958   6.681  -4.233
  783   HH11  ARG 103          HH11      ARG 103 -14.414   3.572  -4.919
  784   HH12  ARG 103          HH12      ARG 103 -15.849   3.899  -4.001
  785   HH21  ARG 103          HH21      ARG 103 -14.857   7.127  -3.041
  786   HH22  ARG 103          HH22      ARG 103 -16.098   5.915  -2.922
  787    H    ILE 104           H        ILE 104  -6.786   4.977  -3.660
  788    HA   ILE 104           HA       ILE 104  -6.239   4.928  -6.555
  789    HB   ILE 104           HB       ILE 104  -3.835   5.174  -6.072
  790   HG12  ILE 104          HG13      ILE 104  -4.670   5.831  -3.242
  791   HG13  ILE 104          HG12      ILE 104  -3.986   4.284  -3.727
  792   HG21  ILE 104          HG21      ILE 104  -5.108   7.151  -6.663
  793   HG22  ILE 104          HG22      ILE 104  -3.854   7.558  -5.493
  794   HG23  ILE 104          HG23      ILE 104  -5.532   7.409  -4.970
  795   HD11  ILE 104          HD11      ILE 104  -1.936   5.398  -4.414
  796   HD12  ILE 104          HD12      ILE 104  -2.316   5.733  -2.723
  797   HD13  ILE 104          HD13      ILE 104  -2.628   6.954  -3.955
  798    H    ASP 105           H        ASP 105  -4.981   3.168  -7.303
  799    HA   ASP 105           HA       ASP 105  -5.422   0.666  -6.033
  800    HB2  ASP 105           HB3      ASP 105  -3.502   1.396  -8.273
  801    HB3  ASP 105           HB2      ASP 105  -3.929  -0.251  -7.800
  802    H    THR 106           H        THR 106  -4.465   0.180  -4.172
  803    HA   THR 106           HA       THR 106  -1.944   1.465  -3.490
  804    HB   THR 106           HB       THR 106  -3.460  -0.337  -1.640
  805    HG1  THR 106           HG1      THR 106  -4.420   1.893  -2.910
  806   HG21  THR 106          HG21      THR 106  -2.735   1.296   0.022
  807   HG22  THR 106          HG22      THR 106  -2.035   2.300  -1.247
  808   HG23  THR 106          HG23      THR 106  -1.351   0.710  -0.905
  809    H    ALA 107           H        ALA 107  -3.325  -1.804  -3.575
  810    HA   ALA 107           HA       ALA 107  -0.679  -2.905  -4.028
  811    HB1  ALA 107           HB1      ALA 107  -0.881  -4.539  -2.224
  812    HB2  ALA 107           HB2      ALA 107  -2.393  -3.791  -1.711
  813    HB3  ALA 107           HB3      ALA 107  -0.880  -2.894  -1.590
  814    H    CYS 108           H        CYS 108  -0.720  -4.910  -5.025
  815    HA   CYS 108           HA       CYS 108  -3.343  -5.727  -6.051
  816    HB2  CYS 108           HB3      CYS 108  -1.704  -5.180  -7.781
  817    HB3  CYS 108           HB2      CYS 108  -0.545  -6.305  -7.068
  818    H    VAL 109           H        VAL 109  -4.242  -7.325  -4.939
  819    HA   VAL 109           HA       VAL 109  -2.441  -9.207  -3.565
  820    HB   VAL 109           HB       VAL 109  -4.181  -9.485  -1.861
  821   HG11  VAL 109          HG11      VAL 109  -4.017  -7.263  -0.828
  822   HG12  VAL 109          HG12      VAL 109  -3.438  -6.605  -2.361
  823   HG13  VAL 109          HG13      VAL 109  -2.475  -7.802  -1.493
  824   HG21  VAL 109          HG21      VAL 109  -6.134  -8.010  -1.801
  825   HG22  VAL 109          HG22      VAL 109  -6.151  -9.033  -3.239
  826   HG23  VAL 109          HG23      VAL 109  -5.679  -7.338  -3.367
  827    H    CYS 110           H        CYS 110  -2.826 -11.369  -3.687
  828    HA   CYS 110           HA       CYS 110  -4.687 -12.346  -5.653
  829    HB2  CYS 110           HB3      CYS 110  -2.815 -13.749  -3.737
  830    HB3  CYS 110           HB2      CYS 110  -3.883 -14.607  -4.836
  831    H    VAL 111           H        VAL 111  -6.786 -12.212  -5.104
  832    HA   VAL 111           HA       VAL 111  -7.555 -12.784  -2.347
  833    HB   VAL 111           HB       VAL 111  -9.815 -12.118  -2.992
  834   HG11  VAL 111          HG11      VAL 111  -9.376  -9.773  -3.560
  835   HG12  VAL 111          HG12      VAL 111  -7.714 -10.195  -3.972
  836   HG13  VAL 111          HG13      VAL 111  -8.282 -10.368  -2.311
  837   HG21  VAL 111          HG21      VAL 111  -9.809 -12.997  -5.272
  838   HG22  VAL 111          HG22      VAL 111  -8.698 -11.713  -5.757
  839   HG23  VAL 111          HG23      VAL 111 -10.328 -11.312  -5.218
  840    H    LEU 112           H        LEU 112  -9.007 -14.447  -1.781
  841    HA   LEU 112           HA       LEU 112  -8.743 -16.735  -3.599
  842    HB2  LEU 112           HB3      LEU 112  -9.313 -16.671  -0.630
  843    HB3  LEU 112           HB2      LEU 112  -9.124 -18.122  -1.597
  844    HG   LEU 112           HG       LEU 112  -6.966 -16.070  -1.053
  845   HD11  LEU 112          HD11      LEU 112  -5.929 -17.870   0.247
  846   HD12  LEU 112          HD12      LEU 112  -7.345 -18.883  -0.033
  847   HD13  LEU 112          HD13      LEU 112  -7.494 -17.398   0.908
  848   HD21  LEU 112          HD21      LEU 112  -6.690 -17.076  -3.254
  849   HD22  LEU 112          HD22      LEU 112  -6.843 -18.685  -2.551
  850   HD23  LEU 112          HD23      LEU 112  -5.463 -17.671  -2.137
  851    H    SER 113           H        SER 113 -10.424 -17.863  -4.298
  852    HA   SER 113           HA       SER 113 -13.109 -17.142  -3.340
  853    HB2  SER 113           HB3      SER 113 -12.922 -16.068  -5.462
  854    HB3  SER 113           HB2      SER 113 -12.133 -17.462  -6.184
  855    HG   SER 113           HG       SER 113 -14.382 -17.236  -6.739
  856    H    ARG 114           H        ARG 114 -14.688 -18.833  -3.590
  857    HA   ARG 114           HA       ARG 114 -13.559 -21.355  -2.801
  858    HB2  ARG 114           HB3      ARG 114 -16.363 -20.284  -2.969
  859    HB3  ARG 114           HB2      ARG 114 -16.062 -21.988  -2.660
  860    HG2  ARG 114           HG3      ARG 114 -15.003 -19.724  -0.976
  861    HG3  ARG 114           HG2      ARG 114 -16.437 -20.683  -0.602
  862    HD2  ARG 114           HD3      ARG 114 -15.023 -22.715  -0.599
  863    HD3  ARG 114           HD2      ARG 114 -13.609 -21.698  -0.858
  864    HE   ARG 114           HE       ARG 114 -14.824 -20.695   1.395
  865   HH11  ARG 114          HH11      ARG 114 -13.473 -23.762   0.397
  866   HH12  ARG 114          HH12      ARG 114 -13.060 -24.250   2.010
  867   HH21  ARG 114          HH21      ARG 114 -14.254 -21.324   3.524
  868   HH22  ARG 114          HH22      ARG 114 -13.484 -22.858   3.783
  869    H    LYS 115           H        LYS 115 -13.764 -20.181  -5.722
  870    HA   LYS 115           HA       LYS 115 -13.706 -21.060  -7.813
  871    HB2  LYS 115           HB3      LYS 115 -13.938 -23.749  -6.424
  872    HB3  LYS 115           HB2      LYS 115 -13.523 -23.512  -8.112
  873    HG2  LYS 115           HG3      LYS 115 -11.467 -22.357  -7.438
  874    HG3  LYS 115           HG2      LYS 115 -11.900 -22.604  -5.744
  875    HD2  LYS 115           HD3      LYS 115 -10.315 -24.291  -6.386
  876    HD3  LYS 115           HD2      LYS 115 -11.887 -25.047  -6.141
  877    HE2  LYS 115           HE3      LYS 115 -10.884 -25.968  -8.118
  878    HE3  LYS 115           HE2      LYS 115 -12.258 -24.970  -8.583
  879    HZ1  LYS 115           HZ1      LYS 115 -10.366 -24.587 -10.027
  880    HZ2  LYS 115           HZ2      LYS 115  -9.401 -24.158  -8.705
  881    HZ3  LYS 115           HZ3      LYS 115 -10.717 -23.186  -9.146
  882    H    ALA 116           H        ALA 116 -16.085 -20.124  -6.749
  883    HA   ALA 116           HA       ALA 116 -18.017 -21.661  -8.326
  884    HB1  ALA 116           HB1      ALA 116 -19.732 -21.376  -6.619
  885    HB2  ALA 116           HB2      ALA 116 -18.567 -20.573  -5.564
  886    HB3  ALA 116           HB3      ALA 116 -18.361 -22.276  -5.973
  887    H    THR 117           H        THR 117 -20.047 -20.302  -8.663
  888    HA   THR 117           HA       THR 117 -19.522 -17.428  -8.605
  889    HB   THR 117           HB       THR 117 -20.526 -17.354 -10.995
  890    HG1  THR 117           HG1      THR 117 -19.364 -19.952 -11.101
  891   HG21  THR 117          HG21      THR 117 -18.239 -16.672 -10.489
  892   HG22  THR 117          HG22      THR 117 -18.299 -17.560 -12.013
  893   HG23  THR 117          HG23      THR 117 -17.712 -18.354 -10.552
  894    H    ARG 118           H        ARG 118 -21.677 -16.391  -9.730
  895    HA   ARG 118           HA       ARG 118 -23.894 -17.581  -8.212
  896    HB2  ARG 118           HB3      ARG 118 -23.494 -14.739  -9.172
  897    HB3  ARG 118           HB2      ARG 118 -24.929 -15.315  -8.346
  898    HG2  ARG 118           HG3      ARG 118 -22.141 -15.205  -7.213
  899    HG3  ARG 118           HG2      ARG 118 -23.482 -14.130  -6.817
  900    HD2  ARG 118           HD3      ARG 118 -23.344 -17.098  -6.283
  901    HD3  ARG 118           HD2      ARG 118 -23.203 -15.814  -5.087
  902    HE   ARG 118           HE       ARG 118 -25.613 -15.339  -6.229
  903   HH11  ARG 118          HH11      ARG 118 -24.149 -18.168  -4.787
  904   HH12  ARG 118          HH12      ARG 118 -25.658 -18.828  -4.244
  905   HH21  ARG 118          HH21      ARG 118 -27.604 -16.191  -5.499
  906   HH22  ARG 118          HH22      ARG 118 -27.625 -17.697  -4.637
  907    H1   SER   1           H1       SER   1 -21.405  -8.593 -10.723
  908    H2   SER   1           H2       SER   1 -20.284  -9.316  -9.687
  909    H3   SER   1           H3       SER   1 -20.116  -7.688 -10.106
  910    HA   SER   1           HA       SER   1 -22.328  -8.853  -8.528
  911    HB2  SER   1           HB3      SER   1 -20.062  -7.031  -7.679
  912    HB3  SER   1           HB2      SER   1 -21.356  -7.629  -6.644
  913    HG   SER   1           HG       SER   1 -19.086  -8.757  -6.952
  914    H    SER   2           H        SER   2 -24.120  -7.793  -9.083
  915    HA   SER   2           HA       SER   2 -23.981  -4.861  -9.197
  916    HB2  SER   2           HB3      SER   2 -25.939  -4.998 -10.805
  917    HB3  SER   2           HB2      SER   2 -24.393  -5.554 -11.446
  918    HG   SER   2           HG       SER   2 -26.306  -6.930 -11.825
  919    H    THR   3           H        THR   3 -26.428  -7.440  -8.993
  920    HA   THR   3           HA       THR   3 -27.846  -5.943  -6.934
  921    HB   THR   3           HB       THR   3 -29.425  -7.967  -7.105
  922    HG1  THR   3           HG1      THR   3 -28.784  -9.512  -8.389
  923   HG21  THR   3          HG21      THR   3 -30.467  -7.109  -9.149
  924   HG22  THR   3          HG22      THR   3 -28.989  -6.230  -9.537
  925   HG23  THR   3          HG23      THR   3 -29.928  -5.792  -8.109
  926    H    HIS   4           H        HIS   4 -25.856  -8.768  -7.335
  927    HA   HIS   4           HA       HIS   4 -26.051  -9.301  -4.445
  928    HB2  HIS   4           HB3      HIS   4 -26.944 -11.137  -5.857
  929    HB3  HIS   4           HB2      HIS   4 -25.388 -11.250  -6.663
  930    HD1  HIS   4           HD1      HIS   4 -27.207 -12.329  -3.634
  931    HD2  HIS   4           HD2      HIS   4 -23.294 -12.340  -5.039
  932    HE1  HIS   4           HE1      HIS   4 -25.968 -13.951  -2.174
  933    HE2  HIS   4           HE2      HIS   4 -23.578 -13.837  -2.948
  934    HA   PRO   5           HA       PRO   5 -21.734  -8.065  -4.744
  935    HB2  PRO   5           HB3      PRO   5 -21.294  -7.901  -2.081
  936    HB3  PRO   5           HB2      PRO   5 -22.154  -6.641  -2.975
  937    HG2  PRO   5           HG3      PRO   5 -23.237  -8.825  -1.247
  938    HG3  PRO   5           HG2      PRO   5 -23.776  -7.144  -1.397
  939    HD2  PRO   5           HD3      PRO   5 -25.010  -9.275  -2.613
  940    HD3  PRO   5           HD2      PRO   5 -25.092  -7.604  -3.211
  941    H    VAL   6           H        VAL   6 -20.363  -9.650  -5.310
  942    HA   VAL   6           HA       VAL   6 -20.343 -12.155  -3.823
  943    HB   VAL   6           HB       VAL   6 -18.658 -11.441  -6.224
  944   HG11  VAL   6          HG11      VAL   6 -19.471 -14.096  -5.047
  945   HG12  VAL   6          HG12      VAL   6 -17.864 -13.370  -4.980
  946   HG13  VAL   6          HG13      VAL   6 -18.541 -13.874  -6.529
  947   HG21  VAL   6          HG21      VAL   6 -21.363 -12.773  -6.160
  948   HG22  VAL   6          HG22      VAL   6 -20.339 -12.593  -7.584
  949   HG23  VAL   6          HG23      VAL   6 -21.011 -11.165  -6.796
  950    H    PHE   7           H        PHE   7 -19.554 -10.645  -1.986
  951    HA   PHE   7           HA       PHE   7 -16.694 -10.140  -2.111
  952    HB2  PHE   7           HB3      PHE   7 -18.782  -9.506  -0.032
  953    HB3  PHE   7           HB2      PHE   7 -17.065  -9.264   0.253
  954    HD1  PHE   7           HD1      PHE   7 -16.074  -8.168  -2.211
  955    HD2  PHE   7           HD2      PHE   7 -19.778  -7.450  -0.243
  956    HE1  PHE   7           HE1      PHE   7 -16.186  -5.946  -3.247
  957    HE2  PHE   7           HE2      PHE   7 -19.900  -5.226  -1.287
  958    HZ   PHE   7           HZ       PHE   7 -18.105  -4.469  -2.786
  959    H    HIS   8           H        HIS   8 -18.857 -12.534  -0.989
  960    HA   HIS   8           HA       HIS   8 -17.202 -13.617   1.070
  961    HB2  HIS   8           HB3      HIS   8 -19.710 -13.949   0.824
  962    HB3  HIS   8           HB2      HIS   8 -19.349 -15.084  -0.470
  963    HD1  HIS   8           HD1      HIS   8 -18.744 -14.624   3.240
  964    HD2  HIS   8           HD2      HIS   8 -18.804 -17.634   0.375
  965    HE1  HIS   8           HE1      HIS   8 -18.516 -16.775   4.515
  966    HE2  HIS   8           HE2      HIS   8 -18.776 -18.580   2.778
  967    H    MET   9           H        MET   9 -16.863 -13.495  -2.204
  968    HA   MET   9           HA       MET   9 -14.740 -15.498  -2.052
  969    HB2  MET   9           HB3      MET   9 -16.730 -15.238  -4.318
  970    HB3  MET   9           HB2      MET   9 -15.220 -16.126  -4.454
  971    HG2  MET   9           HG3      MET   9 -15.963 -17.600  -2.613
  972    HG3  MET   9           HG2      MET   9 -17.499 -16.740  -2.583
  973    HE1  MET   9           HE1      MET   9 -18.059 -16.200  -5.647
  974    HE2  MET   9           HE2      MET   9 -19.281 -16.807  -4.531
  975    HE3  MET   9           HE3      MET   9 -19.015 -17.618  -6.073
  976    H    GLY  10           H        GLY  10 -14.803 -12.654  -1.727
  977    HA2  GLY  10           HA3      GLY  10 -12.942 -11.920  -3.877
  978    HA3  GLY  10           HA2      GLY  10 -14.314 -10.865  -3.577
  979    H    GLU  11           H        GLU  11 -14.330 -11.162  -0.723
  980    HA   GLU  11           HA       GLU  11 -12.005  -9.505  -0.082
  981    HB2  GLU  11           HB3      GLU  11 -14.589 -10.024   1.404
  982    HB3  GLU  11           HB2      GLU  11 -13.268  -9.057   2.054
  983    HG2  GLU  11           HG3      GLU  11 -14.764  -8.450  -0.495
  984    HG3  GLU  11           HG2      GLU  11 -15.078  -7.703   1.072
  985    H    PHE  12           H        PHE  12 -11.562 -12.244  -0.482
  986    HA   PHE  12           HA       PHE  12 -10.986 -13.184   2.246
  987    HB2  PHE  12           HB3      PHE  12 -11.608 -14.653  -0.294
  988    HB3  PHE  12           HB2      PHE  12 -10.583 -15.425   0.913
  989    HD1  PHE  12           HD1      PHE  12 -13.709 -13.358   1.091
  990    HD2  PHE  12           HD2      PHE  12 -11.723 -16.982   2.113
  991    HE1  PHE  12           HE1      PHE  12 -15.688 -14.087   2.347
  992    HE2  PHE  12           HE2      PHE  12 -13.706 -17.716   3.368
  993    HZ   PHE  12           HZ       PHE  12 -15.692 -16.265   3.488
  994    H    SER  13           H        SER  13  -9.050 -12.407   2.713
  995    HA   SER  13           HA       SER  13  -6.945 -12.349   0.708
  996    HB2  SER  13           HB3      SER  13  -7.299 -10.375   2.166
  997    HB3  SER  13           HB2      SER  13  -6.952 -11.365   3.580
  998    HG   SER  13           HG       SER  13  -5.080 -10.316   3.018
  999    H    VAL  14           H        VAL  14  -4.854 -13.228   1.150
 1000    HA   VAL  14           HA       VAL  14  -4.968 -15.890   2.208
 1001    HB   VAL  14           HB       VAL  14  -2.571 -16.014   1.579
 1002   HG11  VAL  14          HG11      VAL  14  -2.897 -15.745  -0.845
 1003   HG12  VAL  14          HG12      VAL  14  -4.398 -14.873  -0.529
 1004   HG13  VAL  14          HG13      VAL  14  -4.250 -16.570  -0.070
 1005   HG21  VAL  14          HG21      VAL  14  -1.506 -14.161   0.412
 1006   HG22  VAL  14          HG22      VAL  14  -1.956 -13.687   2.050
 1007   HG23  VAL  14          HG23      VAL  14  -2.929 -13.156   0.679
 1008    H    CYS  15           H        CYS  15  -4.210 -12.835   3.484
 1009    HA   CYS  15           HA       CYS  15  -3.191 -14.091   5.933
 1010    HB2  CYS  15           HB3      CYS  15  -1.287 -13.086   4.699
 1011    HB3  CYS  15           HB2      CYS  15  -2.119 -11.530   4.713
 1012    H    ASP  16           H        ASP  16  -3.675 -12.916   7.856
 1013    HA   ASP  16           HA       ASP  16  -6.104 -11.307   7.573
 1014    HB2  ASP  16           HB3      ASP  16  -6.109 -13.287   9.108
 1015    HB3  ASP  16           HB2      ASP  16  -4.885 -12.485  10.086
 1016    H    SER  17           H        SER  17  -5.940  -9.183   7.621
 1017    HA   SER  17           HA       SER  17  -3.611  -7.977   8.970
 1018    HB2  SER  17           HB3      SER  17  -4.925  -7.028   6.412
 1019    HB3  SER  17           HB2      SER  17  -3.478  -6.350   7.166
 1020    HG   SER  17           HG       SER  17  -3.456  -9.071   6.578
 1021    H    VAL  18           H        VAL  18  -3.909  -5.739   9.665
 1022    HA   VAL  18           HA       VAL  18  -6.731  -4.978   9.973
 1023    HB   VAL  18           HB       VAL  18  -6.028  -5.709  12.134
 1024   HG11  VAL  18          HG11      VAL  18  -4.097  -4.764  13.309
 1025   HG12  VAL  18          HG12      VAL  18  -3.658  -3.878  11.848
 1026   HG13  VAL  18          HG13      VAL  18  -3.630  -5.642  11.852
 1027   HG21  VAL  18          HG21      VAL  18  -6.229  -3.639  13.462
 1028   HG22  VAL  18          HG22      VAL  18  -7.416  -3.747  12.161
 1029   HG23  VAL  18          HG23      VAL  18  -6.007  -2.705  11.984
 1030    H    SER  19           H        SER  19  -7.120  -3.200   8.846
 1031    HA   SER  19           HA       SER  19  -4.964  -1.291   8.367
 1032    HB2  SER  19           HB3      SER  19  -7.762  -1.425   7.203
 1033    HB3  SER  19           HB2      SER  19  -6.513  -0.264   6.733
 1034    HG   SER  19           HG       SER  19  -5.270  -1.947   5.938
 1035    H    VAL  20           H        VAL  20  -4.745   0.450   9.567
 1036    HA   VAL  20           HA       VAL  20  -7.060   1.390  11.132
 1037    HB   VAL  20           HB       VAL  20  -4.143   1.543  11.895
 1038   HG11  VAL  20          HG11      VAL  20  -6.623   2.245  13.448
 1039   HG12  VAL  20          HG12      VAL  20  -5.411   3.369  12.830
 1040   HG13  VAL  20          HG13      VAL  20  -4.984   2.221  14.098
 1041   HG21  VAL  20          HG21      VAL  20  -4.664  -0.145  13.590
 1042   HG22  VAL  20          HG22      VAL  20  -4.912  -0.756  11.953
 1043   HG23  VAL  20          HG23      VAL  20  -6.297  -0.282  12.938
 1044    H    TRP  21           H        TRP  21  -7.542   3.524  11.029
 1045    HA   TRP  21           HA       TRP  21  -5.840   5.222   9.368
 1046    HB2  TRP  21           HB3      TRP  21  -8.637   5.618  10.457
 1047    HB3  TRP  21           HB2      TRP  21  -7.754   6.858   9.571
 1048    HD1  TRP  21           HD1      TRP  21  -9.656   3.598   9.069
 1049    HE1  TRP  21           HE1      TRP  21  -9.998   3.205   6.548
 1050    HE3  TRP  21           HE3      TRP  21  -6.666   7.337   7.247
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.108   4.323   4.113
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.469   7.603   4.805
 1053    HH2  TRP  21           HH2      TRP  21  -7.665   6.127   3.275
 1054    H    VAL  22           H        VAL  22  -4.178   5.818  10.577
 1055    HA   VAL  22           HA       VAL  22  -4.525   6.443  13.387
 1056    HB   VAL  22           HB       VAL  22  -2.035   6.313  11.683
 1057   HG11  VAL  22          HG11      VAL  22  -1.687   7.772  13.581
 1058   HG12  VAL  22          HG12      VAL  22  -0.823   6.253  13.818
 1059   HG13  VAL  22          HG13      VAL  22  -2.339   6.548  14.672
 1060   HG21  VAL  22          HG21      VAL  22  -3.155   4.162  11.897
 1061   HG22  VAL  22          HG22      VAL  22  -3.178   4.339  13.653
 1062   HG23  VAL  22          HG23      VAL  22  -1.642   4.179  12.801
 1063    H    GLY  23           H        GLY  23  -4.881   8.421  14.069
 1064    HA2  GLY  23           HA3      GLY  23  -3.695  10.670  12.561
 1065    HA3  GLY  23           HA2      GLY  23  -5.223  10.787  13.437
 1066    H    ASP  24           H        ASP  24  -2.627   8.942  14.764
 1067    HA   ASP  24           HA       ASP  24  -2.023  11.105  16.663
 1068    HB2  ASP  24           HB3      ASP  24  -2.000   9.473  18.498
 1069    HB3  ASP  24           HB2      ASP  24  -3.580   9.519  17.720
 1070    H    LYS  25           H        LYS  25  -0.665   9.655  14.273
 1071    HA   LYS  25           HA       LYS  25   1.627   8.369  15.365
 1072    HB2  LYS  25           HB3      LYS  25   0.828   7.988  13.050
 1073    HB3  LYS  25           HB2      LYS  25   1.253   9.640  12.641
 1074    HG2  LYS  25           HG3      LYS  25   3.599   9.156  13.092
 1075    HG3  LYS  25           HG2      LYS  25   3.181   7.496  13.508
 1076    HD2  LYS  25           HD3      LYS  25   2.608   8.749  10.830
 1077    HD3  LYS  25           HD2      LYS  25   4.070   7.833  11.185
 1078    HE2  LYS  25           HE3      LYS  25   1.249   6.775  11.396
 1079    HE3  LYS  25           HE2      LYS  25   2.352   6.468  10.054
 1080    HZ1  LYS  25           HZ1      LYS  25   2.726   5.618  12.878
 1081    HZ2  LYS  25           HZ2      LYS  25   3.872   5.405  11.652
 1082    HZ3  LYS  25           HZ3      LYS  25   2.373   4.615  11.556
 1083    H    THR  26           H        THR  26   3.462   9.253  16.156
 1084    HA   THR  26           HA       THR  26   3.612  12.179  16.105
 1085    HB   THR  26           HB       THR  26   3.429  11.190  18.336
 1086    HG1  THR  26           HG1      THR  26   4.858  13.098  17.794
 1087   HG21  THR  26          HG21      THR  26   6.043   9.835  17.676
 1088   HG22  THR  26          HG22      THR  26   4.497   9.047  17.986
 1089   HG23  THR  26          HG23      THR  26   5.321   9.912  19.282
 1090    H    THR  27           H        THR  27   5.429   9.297  15.293
 1091    HA   THR  27           HA       THR  27   7.430  11.017  14.030
 1092    HB   THR  27           HB       THR  27   9.132   9.166  14.773
 1093    HG1  THR  27           HG1      THR  27   7.504   7.917  15.876
 1094   HG21  THR  27          HG21      THR  27   9.329  11.531  15.330
 1095   HG22  THR  27          HG22      THR  27   9.732  10.531  16.727
 1096   HG23  THR  27          HG23      THR  27   8.164  11.333  16.640
 1097    H    ALA  28           H        ALA  28   8.273  10.285  12.153
 1098    HA   ALA  28           HA       ALA  28   7.755   7.530  11.329
 1099    HB1  ALA  28           HB1      ALA  28   5.821   8.822  10.521
 1100    HB2  ALA  28           HB2      ALA  28   6.800   8.187   9.199
 1101    HB3  ALA  28           HB3      ALA  28   6.922   9.889   9.645
 1102    H    THR  29           H        THR  29   8.905   7.084   9.206
 1103    HA   THR  29           HA       THR  29  11.447   8.561   9.217
 1104    HB   THR  29           HB       THR  29  10.978   5.778   8.144
 1105    HG1  THR  29           HG1      THR  29  10.650   6.017  10.479
 1106   HG21  THR  29          HG21      THR  29  12.930   6.942   7.228
 1107   HG22  THR  29          HG22      THR  29  13.416   5.609   8.276
 1108   HG23  THR  29          HG23      THR  29  13.504   7.271   8.864
 1109    H    ASP  30           H        ASP  30  11.767   9.864   7.588
 1110    HA   ASP  30           HA       ASP  30  10.106   9.996   5.291
 1111    HB2  ASP  30           HB3      ASP  30  11.176  11.995   6.165
 1112    HB3  ASP  30           HB2      ASP  30  12.774  11.288   5.928
 1113    H    ILE  31           H        ILE  31  11.009   9.947   3.017
 1114    HA   ILE  31           HA       ILE  31  11.914   7.378   2.398
 1115    HB   ILE  31           HB       ILE  31  10.636   8.700   0.814
 1116   HG12  ILE  31          HG13      ILE  31  13.393   8.135  -0.300
 1117   HG13  ILE  31          HG12      ILE  31  12.142   6.921  -0.050
 1118   HG21  ILE  31          HG21      ILE  31  11.624  10.581  -0.402
 1119   HG22  ILE  31          HG22      ILE  31  13.064  10.473   0.611
 1120   HG23  ILE  31          HG23      ILE  31  11.512  10.904   1.328
 1121   HD11  ILE  31          HD11      ILE  31  12.247   7.595  -2.372
 1122   HD12  ILE  31          HD12      ILE  31  11.983   9.276  -1.915
 1123   HD13  ILE  31          HD13      ILE  31  10.711   8.083  -1.658
 1124    H    LYS  32           H        LYS  32  13.679  10.322   3.039
 1125    HA   LYS  32           HA       LYS  32  16.168   9.383   1.952
 1126    HB2  LYS  32           HB3      LYS  32  15.610  11.655   3.861
 1127    HB3  LYS  32           HB2      LYS  32  17.108  11.399   2.974
 1128    HG2  LYS  32           HG3      LYS  32  15.960  11.753   0.872
 1129    HG3  LYS  32           HG2      LYS  32  14.419  11.903   1.715
 1130    HD2  LYS  32           HD3      LYS  32  15.331  13.857   2.919
 1131    HD3  LYS  32           HD2      LYS  32  16.791  13.746   1.937
 1132    HE2  LYS  32           HE3      LYS  32  13.987  14.195   0.934
 1133    HE3  LYS  32           HE2      LYS  32  15.254  15.413   1.041
 1134    HZ1  LYS  32           HZ1      LYS  32  15.284  12.995  -0.682
 1135    HZ2  LYS  32           HZ2      LYS  32  16.557  14.095  -0.543
 1136    HZ3  LYS  32           HZ3      LYS  32  15.083  14.592  -1.200
 1137    H    GLY  33           H        GLY  33  14.439   8.720   4.756
 1138    HA2  GLY  33           HA3      GLY  33  15.104   7.004   6.249
 1139    HA3  GLY  33           HA2      GLY  33  16.787   7.368   5.878
 1140    H    LYS  34           H        LYS  34  14.752  10.048   6.479
 1141    HA   LYS  34           HA       LYS  34  16.165  10.533   8.985
 1142    HB2  LYS  34           HB3      LYS  34  14.408  12.364   7.346
 1143    HB3  LYS  34           HB2      LYS  34  15.356  12.837   8.747
 1144    HG2  LYS  34           HG3      LYS  34  16.457  11.820   6.139
 1145    HG3  LYS  34           HG2      LYS  34  16.423  13.497   6.666
 1146    HD2  LYS  34           HD3      LYS  34  17.838  12.901   8.588
 1147    HD3  LYS  34           HD2      LYS  34  17.915  11.242   7.992
 1148    HE2  LYS  34           HE3      LYS  34  19.907  12.430   7.320
 1149    HE3  LYS  34           HE2      LYS  34  18.924  12.067   5.907
 1150    HZ1  LYS  34           HZ1      LYS  34  18.094  14.335   5.945
 1151    HZ2  LYS  34           HZ2      LYS  34  19.780  14.316   5.826
 1152    HZ3  LYS  34           HZ3      LYS  34  19.043  14.682   7.300
 1153    H    GLU  35           H        GLU  35  15.175  10.668  10.925
 1154    HA   GLU  35           HA       GLU  35  12.432   9.797  11.140
 1155    HB2  GLU  35           HB3      GLU  35  14.105   9.001  12.750
 1156    HB3  GLU  35           HB2      GLU  35  14.414  10.654  13.257
 1157    HG2  GLU  35           HG3      GLU  35  12.096  10.820  14.052
 1158    HG3  GLU  35           HG2      GLU  35  11.842   9.137  13.600
 1159    H    VAL  36           H        VAL  36  10.803  11.163  10.954
 1160    HA   VAL  36           HA       VAL  36  11.247  13.974  11.699
 1161    HB   VAL  36           HB       VAL  36   9.523  14.586  10.054
 1162   HG11  VAL  36          HG11      VAL  36  10.820  14.125   8.023
 1163   HG12  VAL  36          HG12      VAL  36  11.765  12.930   8.911
 1164   HG13  VAL  36          HG13      VAL  36  11.846  14.634   9.363
 1165   HG21  VAL  36          HG21      VAL  36   8.252  12.494  10.081
 1166   HG22  VAL  36          HG22      VAL  36   9.588  11.674   9.270
 1167   HG23  VAL  36          HG23      VAL  36   8.704  12.958   8.442
 1168    H    THR  37           H        THR  37   9.536  15.098  12.670
 1169    HA   THR  37           HA       THR  37   7.777  13.423  14.261
 1170    HB   THR  37           HB       THR  37   8.115  16.423  14.311
 1171    HG1  THR  37           HG1      THR  37   9.915  14.711  14.925
 1172   HG21  THR  37          HG21      THR  37   6.922  14.517  16.326
 1173   HG22  THR  37          HG22      THR  37   6.027  15.660  15.326
 1174   HG23  THR  37          HG23      THR  37   7.140  16.252  16.558
 1175    H    VAL  38           H        VAL  38   5.760  13.043  13.705
 1176    HA   VAL  38           HA       VAL  38   4.739  14.198  11.274
 1177    HB   VAL  38           HB       VAL  38   3.572  12.106  13.111
 1178   HG11  VAL  38          HG11      VAL  38   2.662  12.992  10.378
 1179   HG12  VAL  38          HG12      VAL  38   1.806  13.255  11.898
 1180   HG13  VAL  38          HG13      VAL  38   2.024  11.618  11.280
 1181   HG21  VAL  38          HG21      VAL  38   5.631  11.409  11.991
 1182   HG22  VAL  38          HG22      VAL  38   4.934  11.850  10.432
 1183   HG23  VAL  38          HG23      VAL  38   4.233  10.532  11.369
 1184    H    LEU  39           H        LEU  39   3.275  15.765  11.102
 1185    HA   LEU  39           HA       LEU  39   2.060  16.803  13.554
 1186    HB2  LEU  39           HB3      LEU  39   2.201  18.046  10.799
 1187    HB3  LEU  39           HB2      LEU  39   1.603  18.822  12.256
 1188    HG   LEU  39           HG       LEU  39   4.455  17.955  11.785
 1189   HD11  LEU  39          HD11      LEU  39   3.814  19.839  10.380
 1190   HD12  LEU  39          HD12      LEU  39   4.931  20.343  11.648
 1191   HD13  LEU  39          HD13      LEU  39   3.208  20.697  11.796
 1192   HD21  LEU  39          HD21      LEU  39   3.208  19.495  14.054
 1193   HD22  LEU  39          HD22      LEU  39   4.935  19.212  13.828
 1194   HD23  LEU  39          HD23      LEU  39   3.852  17.855  14.135
 1195    H    ALA  40           H        ALA  40   0.339  15.415  13.834
 1196    HA   ALA  40           HA       ALA  40  -1.411  14.535  11.825
 1197    HB1  ALA  40           HB1      ALA  40  -2.950  13.989  13.632
 1198    HB2  ALA  40           HB2      ALA  40  -2.015  14.983  14.747
 1199    HB3  ALA  40           HB3      ALA  40  -1.305  13.522  14.060
 1200    H    GLU  41           H        GLU  41  -1.321  17.394  13.807
 1201    HA   GLU  41           HA       GLU  41  -3.584  18.544  12.327
 1202    HB2  GLU  41           HB3      GLU  41  -2.220  19.541  14.842
 1203    HB3  GLU  41           HB2      GLU  41  -3.702  20.173  14.134
 1204    HG2  GLU  41           HG3      GLU  41  -4.933  18.284  14.738
 1205    HG3  GLU  41           HG2      GLU  41  -3.485  17.327  15.041
 1206    H    VAL  42           H        VAL  42  -2.991  19.793  10.650
 1207    HA   VAL  42           HA       VAL  42  -0.238  20.798  10.607
 1208    HB   VAL  42           HB       VAL  42  -0.468  21.017   8.200
 1209   HG11  VAL  42          HG11      VAL  42   0.224  18.861   9.065
 1210   HG12  VAL  42          HG12      VAL  42  -0.739  18.663   7.601
 1211   HG13  VAL  42          HG13      VAL  42  -1.460  18.350   9.180
 1212   HG21  VAL  42          HG21      VAL  42  -2.822  21.652   8.096
 1213   HG22  VAL  42          HG22      VAL  42  -3.284  20.009   8.543
 1214   HG23  VAL  42          HG23      VAL  42  -2.463  20.307   7.012
 1215    H    ASN  43           H        ASN  43   0.255  22.918  10.355
 1216    HA   ASN  43           HA       ASN  43  -2.009  24.803  10.420
 1217    HB2  ASN  43           HB3      ASN  43   0.809  25.172  11.481
 1218    HB3  ASN  43           HB2      ASN  43  -0.464  26.385  11.534
 1219   HD21  ASN  43          HD21      ASN  43   0.737  23.423  12.875
 1220   HD22  ASN  43          HD22      ASN  43  -0.319  23.375  14.245
 1221    H    ILE  44           H        ILE  44  -2.289  25.275   8.291
 1222    HA   ILE  44           HA       ILE  44   0.083  26.177   6.800
 1223    HB   ILE  44           HB       ILE  44  -2.661  25.527   5.699
 1224   HG12  ILE  44          HG13      ILE  44  -0.134  23.858   5.605
 1225   HG13  ILE  44          HG12      ILE  44  -1.513  23.534   6.653
 1226   HG21  ILE  44          HG21      ILE  44  -0.024  25.986   4.306
 1227   HG22  ILE  44          HG22      ILE  44  -1.378  27.115   4.350
 1228   HG23  ILE  44          HG23      ILE  44  -1.548  25.566   3.525
 1229   HD11  ILE  44          HD11      ILE  44  -2.920  23.220   4.659
 1230   HD12  ILE  44          HD12      ILE  44  -1.571  22.088   4.723
 1231   HD13  ILE  44          HD13      ILE  44  -1.504  23.479   3.641
 1232    H    ASN  45           H        ASN  45   0.205  28.196   7.788
 1233    HA   ASN  45           HA       ASN  45  -0.075  30.439   7.914
 1234    HB2  ASN  45           HB3      ASN  45  -1.953  29.898   5.614
 1235    HB3  ASN  45           HB2      ASN  45  -1.751  31.515   6.275
 1236   HD21  ASN  45          HD21      ASN  45   0.879  29.213   6.106
 1237   HD22  ASN  45          HD22      ASN  45   1.766  30.034   4.873
 1238    H    ASN  46           H        ASN  46  -3.426  29.615   7.099
 1239    HA   ASN  46           HA       ASN  46  -4.188  30.242   9.866
 1240    HB2  ASN  46           HB3      ASN  46  -6.124  31.536   9.065
 1241    HB3  ASN  46           HB2      ASN  46  -4.611  32.266   8.542
 1242   HD21  ASN  46          HD21      ASN  46  -7.503  30.630   7.550
 1243   HD22  ASN  46          HD22      ASN  46  -7.301  30.878   5.849
 1244    H    SER  47           H        SER  47  -4.138  27.983   7.549
 1245    HA   SER  47           HA       SER  47  -6.832  26.969   8.145
 1246    HB2  SER  47           HB3      SER  47  -4.973  26.140   5.899
 1247    HB3  SER  47           HB2      SER  47  -6.659  25.667   6.101
 1248    HG   SER  47           HG       SER  47  -7.164  27.950   5.933
 1249    H    VAL  48           H        VAL  48  -6.898  25.489   9.670
 1250    HA   VAL  48           HA       VAL  48  -4.600  23.676  10.014
 1251    HB   VAL  48           HB       VAL  48  -6.607  24.491  12.127
 1252   HG11  VAL  48          HG11      VAL  48  -5.055  23.463  13.695
 1253   HG12  VAL  48          HG12      VAL  48  -3.990  23.014  12.363
 1254   HG13  VAL  48          HG13      VAL  48  -5.596  22.298  12.487
 1255   HG21  VAL  48          HG21      VAL  48  -3.788  25.478  11.722
 1256   HG22  VAL  48          HG22      VAL  48  -4.824  25.854  13.097
 1257   HG23  VAL  48          HG23      VAL  48  -5.263  26.415  11.483
 1258    H    PHE  49           H        PHE  49  -5.009  21.589   9.589
 1259    HA   PHE  49           HA       PHE  49  -7.617  20.501  10.253
 1260    HB2  PHE  49           HB3      PHE  49  -7.969  19.419   8.106
 1261    HB3  PHE  49           HB2      PHE  49  -7.832  21.155   7.869
 1262    HD1  PHE  49           HD1      PHE  49  -6.049  22.091   6.571
 1263    HD2  PHE  49           HD2      PHE  49  -6.181  17.911   7.384
 1264    HE1  PHE  49           HE1      PHE  49  -4.349  21.693   4.831
 1265    HE2  PHE  49           HE2      PHE  49  -4.480  17.514   5.654
 1266    HZ   PHE  49           HZ       PHE  49  -3.564  19.406   4.375
 1267    H    ARG  50           H        ARG  50  -7.610  18.071  10.032
 1268    HA   ARG  50           HA       ARG  50  -5.008  17.126  11.006
 1269    HB2  ARG  50           HB3      ARG  50  -7.822  16.207  11.585
 1270    HB3  ARG  50           HB2      ARG  50  -6.407  15.266  12.037
 1271    HG2  ARG  50           HG3      ARG  50  -5.595  17.154  13.363
 1272    HG3  ARG  50           HG2      ARG  50  -7.047  18.058  12.947
 1273    HD2  ARG  50           HD3      ARG  50  -8.430  16.506  14.119
 1274    HD3  ARG  50           HD2      ARG  50  -7.076  15.398  14.355
 1275    HE   ARG  50           HE       ARG  50  -6.495  17.927  15.487
 1276   HH11  ARG  50          HH11      ARG  50  -8.463  15.093  16.040
 1277   HH12  ARG  50          HH12      ARG  50  -8.427  15.253  17.767
 1278   HH21  ARG  50          HH21      ARG  50  -6.410  18.133  17.750
 1279   HH22  ARG  50          HH22      ARG  50  -7.255  16.982  18.746
 1280    H    GLN  51           H        GLN  51  -4.013  15.426  10.138
 1281    HA   GLN  51           HA       GLN  51  -5.276  14.249   7.754
 1282    HB2  GLN  51           HB3      GLN  51  -3.155  14.062   6.748
 1283    HB3  GLN  51           HB2      GLN  51  -3.144  15.647   7.501
 1284    HG2  GLN  51           HG3      GLN  51  -1.913  14.627   9.428
 1285    HG3  GLN  51           HG2      GLN  51  -1.787  13.146   8.479
 1286   HE21  GLN  51          HE21      GLN  51  -0.584  16.310   8.995
 1287   HE22  GLN  51          HE22      GLN  51   0.675  16.265   7.806
 1288    H    TYR  52           H        TYR  52  -5.155  11.993   7.459
 1289    HA   TYR  52           HA       TYR  52  -4.380  10.502   9.879
 1290    HB2  TYR  52           HB3      TYR  52  -6.600   9.731   7.970
 1291    HB3  TYR  52           HB2      TYR  52  -6.225   8.992   9.522
 1292    HD1  TYR  52           HD1      TYR  52  -6.192  10.865  11.523
 1293    HD2  TYR  52           HD2      TYR  52  -8.458  11.066   7.928
 1294    HE1  TYR  52           HE1      TYR  52  -7.785  12.378  12.617
 1295    HE2  TYR  52           HE2      TYR  52 -10.056  12.584   9.015
 1296    HH   TYR  52           HH       TYR  52 -10.812  13.099  11.315
 1297    H    PHE  53           H        PHE  53  -3.603   8.351   9.559
 1298    HA   PHE  53           HA       PHE  53  -2.524   7.890   6.853
 1299    HB2  PHE  53           HB3      PHE  53  -1.226   7.169   9.494
 1300    HB3  PHE  53           HB2      PHE  53  -0.538   6.907   7.892
 1301    HD1  PHE  53           HD1      PHE  53   0.065   8.874   6.494
 1302    HD2  PHE  53           HD2      PHE  53  -1.028   9.239  10.586
 1303    HE1  PHE  53           HE1      PHE  53   1.079  11.110   6.558
 1304    HE2  PHE  53           HE2      PHE  53  -0.016  11.477  10.661
 1305    HZ   PHE  53           HZ       PHE  53   1.037  12.417   8.644
 1306    H    PHE  54           H        PHE  54  -3.071   6.031   5.941
 1307    HA   PHE  54           HA       PHE  54  -4.550   4.070   7.462
 1308    HB2  PHE  54           HB3      PHE  54  -4.723   2.939   5.170
 1309    HB3  PHE  54           HB2      PHE  54  -5.497   4.508   5.339
 1310    HD1  PHE  54           HD1      PHE  54  -2.948   2.594   3.626
 1311    HD2  PHE  54           HD2      PHE  54  -4.433   6.519   4.348
 1312    HE1  PHE  54           HE1      PHE  54  -1.689   3.423   1.687
 1313    HE2  PHE  54           HE2      PHE  54  -3.177   7.355   2.409
 1314    HZ   PHE  54           HZ       PHE  54  -1.803   5.810   1.076
 1315    H    GLU  55           H        GLU  55  -3.307   2.823   8.720
 1316    HA   GLU  55           HA       GLU  55  -0.903   1.624   7.515
 1317    HB2  GLU  55           HB3      GLU  55  -1.622   1.813  10.451
 1318    HB3  GLU  55           HB2      GLU  55  -0.118   1.193   9.786
 1319    HG2  GLU  55           HG3      GLU  55   0.197   3.521   8.775
 1320    HG3  GLU  55           HG2      GLU  55  -1.104   4.028   9.855
 1321    H    THR  56           H        THR  56  -1.259  -0.311   6.726
 1322    HA   THR  56           HA       THR  56  -3.237  -2.059   7.991
 1323    HB   THR  56           HB       THR  56  -1.716  -2.491   5.410
 1324    HG1  THR  56           HG1      THR  56  -3.095  -1.083   4.649
 1325   HG21  THR  56          HG21      THR  56  -3.436  -4.188   4.967
 1326   HG22  THR  56          HG22      THR  56  -4.147  -3.879   6.551
 1327   HG23  THR  56          HG23      THR  56  -2.525  -4.561   6.431
 1328    H    LYS  57           H        LYS  57  -2.403  -3.106   9.662
 1329    HA   LYS  57           HA       LYS  57   0.402  -3.963   9.542
 1330    HB2  LYS  57           HB3      LYS  57  -1.439  -3.606  11.919
 1331    HB3  LYS  57           HB2      LYS  57   0.250  -4.092  12.006
 1332    HG2  LYS  57           HG3      LYS  57   0.928  -1.955  11.059
 1333    HG3  LYS  57           HG2      LYS  57  -0.759  -1.464  10.932
 1334    HD2  LYS  57           HD3      LYS  57   0.159  -0.457  12.895
 1335    HD3  LYS  57           HD2      LYS  57  -0.941  -1.737  13.405
 1336    HE2  LYS  57           HE3      LYS  57   0.974  -3.231  13.730
 1337    HE3  LYS  57           HE2      LYS  57   2.062  -1.930  13.246
 1338    HZ1  LYS  57           HZ1      LYS  57   0.261  -1.903  15.606
 1339    HZ2  LYS  57           HZ2      LYS  57   1.273  -0.636  15.136
 1340    HZ3  LYS  57           HZ3      LYS  57   1.939  -2.102  15.642
 1341    H    CYS  58           H        CYS  58   0.980  -6.024  10.349
 1342    HA   CYS  58           HA       CYS  58  -0.869  -8.073   9.524
 1343    HB2  CYS  58           HB3      CYS  58   1.936  -8.283  10.651
 1344    HB3  CYS  58           HB2      CYS  58   1.016  -9.620   9.978
 1345    H    ARG  59           H        ARG  59  -2.430  -8.662  10.893
 1346    HA   ARG  59           HA       ARG  59  -1.780  -8.949  13.739
 1347    HB2  ARG  59           HB3      ARG  59  -4.209  -9.189  14.092
 1348    HB3  ARG  59           HB2      ARG  59  -3.811  -7.682  13.285
 1349    HG2  ARG  59           HG3      ARG  59  -4.513  -8.589  11.165
 1350    HG3  ARG  59           HG2      ARG  59  -4.828 -10.155  11.912
 1351    HD2  ARG  59           HD3      ARG  59  -6.217  -7.569  12.593
 1352    HD3  ARG  59           HD2      ARG  59  -6.883  -8.847  11.583
 1353    HE   ARG  59           HE       ARG  59  -6.196 -10.003  14.009
 1354   HH11  ARG  59          HH11      ARG  59  -8.422  -7.578  12.824
 1355   HH12  ARG  59          HH12      ARG  59  -9.593  -7.860  14.072
 1356   HH21  ARG  59          HH21      ARG  59  -7.735 -10.380  15.652
 1357   HH22  ARG  59          HH22      ARG  59  -9.204  -9.457  15.682
 1358    H    ALA  60           H        ALA  60  -1.080 -10.647  11.346
 1359    HA   ALA  60           HA       ALA  60  -1.217 -13.176  12.632
 1360    HB1  ALA  60           HB1      ALA  60  -2.492 -14.371  10.910
 1361    HB2  ALA  60           HB2      ALA  60  -2.825 -12.845  10.090
 1362    HB3  ALA  60           HB3      ALA  60  -3.493 -13.149  11.695
 1363    H    SER  61           H        SER  61  -0.265 -14.871  11.024
 1364    HA   SER  61           HA       SER  61   1.345 -13.694   8.916
 1365    HB2  SER  61           HB3      SER  61   2.740 -13.459  10.955
 1366    HB3  SER  61           HB2      SER  61   2.641 -15.203  11.199
 1367    HG   SER  61           HG       SER  61   3.814 -15.531   9.362
 1368    H    ASN  62           H        ASN  62   0.175 -16.482  10.656
 1369    HA   ASN  62           HA       ASN  62   0.166 -17.975   8.144
 1370    HB2  ASN  62           HB3      ASN  62   1.119 -19.157  10.773
 1371    HB3  ASN  62           HB2      ASN  62   0.930 -20.031   9.255
 1372   HD21  ASN  62          HD21      ASN  62   2.366 -19.530   7.522
 1373   HD22  ASN  62          HD22      ASN  62   3.911 -18.825   7.828
 1374    HA   PRO  63           HA       PRO  63  -3.868 -17.414  10.376
 1375    HB2  PRO  63           HB3      PRO  63  -5.310 -18.031   8.048
 1376    HB3  PRO  63           HB2      PRO  63  -4.915 -16.411   8.637
 1377    HG2  PRO  63           HG3      PRO  63  -3.557 -18.067   6.562
 1378    HG3  PRO  63           HG2      PRO  63  -3.803 -16.311   6.618
 1379    HD2  PRO  63           HD3      PRO  63  -1.410 -17.387   7.163
 1380    HD3  PRO  63           HD2      PRO  63  -2.011 -15.980   8.078
 1381    H    VAL  64           H        VAL  64  -3.137 -20.042   8.084
 1382    HA   VAL  64           HA       VAL  64  -5.159 -21.699   9.311
 1383    HB   VAL  64           HB       VAL  64  -4.299 -23.463   7.685
 1384   HG11  VAL  64          HG11      VAL  64  -6.326 -22.138   7.326
 1385   HG12  VAL  64          HG12      VAL  64  -5.485 -22.461   5.813
 1386   HG13  VAL  64          HG13      VAL  64  -5.361 -20.870   6.568
 1387   HG21  VAL  64          HG21      VAL  64  -2.098 -22.525   7.247
 1388   HG22  VAL  64          HG22      VAL  64  -2.838 -21.076   6.567
 1389   HG23  VAL  64          HG23      VAL  64  -3.039 -22.629   5.758
 1390    H    GLU  65           H        GLU  65  -1.623 -21.980   8.868
 1391    HA   GLU  65           HA       GLU  65  -1.243 -23.050  11.452
 1392    HB2  GLU  65           HB3      GLU  65  -0.466 -25.346  10.664
 1393    HB3  GLU  65           HB2      GLU  65  -2.198 -25.076  10.742
 1394    HG2  GLU  65           HG3      GLU  65  -2.171 -24.632   8.296
 1395    HG3  GLU  65           HG2      GLU  65  -0.470 -25.089   8.281
 1396    H    SER  66           H        SER  66   0.298 -23.688   8.270
 1397    HA   SER  66           HA       SER  66   2.740 -22.482   9.391
 1398    HB2  SER  66           HB3      SER  66   2.624 -24.841   7.495
 1399    HB3  SER  66           HB2      SER  66   4.070 -24.156   8.240
 1400    HG   SER  66           HG       SER  66   2.650 -24.657  10.275
 1401    H    GLY  67           H        GLY  67   0.439 -22.335   6.949
 1402    HA2  GLY  67           HA3      GLY  67   2.199 -20.573   5.389
 1403    HA3  GLY  67           HA2      GLY  67   1.235 -21.803   4.571
 1404    H    CYS  68           H        CYS  68   0.508 -19.736   3.480
 1405    HA   CYS  68           HA       CYS  68  -1.513 -18.326   5.061
 1406    HB2  CYS  68           HB3      CYS  68  -0.185 -17.630   2.436
 1407    HB3  CYS  68           HB2      CYS  68  -1.525 -16.711   3.126
 1408    H    ARG  69           H        ARG  69  -2.692 -20.436   4.847
 1409    HA   ARG  69           HA       ARG  69  -4.733 -21.265   4.337
 1410    HB2  ARG  69           HB3      ARG  69  -4.932 -19.031   2.313
 1411    HB3  ARG  69           HB2      ARG  69  -6.259 -20.036   2.884
 1412    HG2  ARG  69           HG3      ARG  69  -5.874 -19.134   5.171
 1413    HG3  ARG  69           HG2      ARG  69  -4.664 -18.048   4.484
 1414    HD2  ARG  69           HD3      ARG  69  -6.681 -16.807   4.654
 1415    HD3  ARG  69           HD2      ARG  69  -6.450 -17.187   2.945
 1416    HE   ARG  69           HE       ARG  69  -8.022 -19.211   3.939
 1417   HH11  ARG  69          HH11      ARG  69  -8.236 -15.731   3.634
 1418   HH12  ARG  69          HH12      ARG  69  -9.972 -15.708   3.650
 1419   HH21  ARG  69          HH21      ARG  69 -10.313 -19.192   3.941
 1420   HH22  ARG  69          HH22      ARG  69 -11.152 -17.680   3.815
 1421    H    GLY  70           H        GLY  70  -3.700 -20.100   1.137
 1422    HA2  GLY  70           HA3      GLY  70  -4.257 -22.798   0.125
 1423    HA3  GLY  70           HA2      GLY  70  -4.117 -21.343  -0.850
 1424    H    ILE  71           H        ILE  71  -1.591 -20.816   0.916
 1425    HA   ILE  71           HA       ILE  71   0.234 -21.632  -1.080
 1426    HB   ILE  71           HB       ILE  71   0.833 -20.696   1.729
 1427   HG12  ILE  71          HG13      ILE  71  -0.476 -19.064   0.402
 1428   HG13  ILE  71          HG12      ILE  71   1.150 -18.490   0.750
 1429   HG21  ILE  71          HG21      ILE  71   2.604 -20.857  -0.707
 1430   HG22  ILE  71          HG22      ILE  71   2.722 -21.853   0.743
 1431   HG23  ILE  71          HG23      ILE  71   3.048 -20.122   0.833
 1432   HD11  ILE  71          HD11      ILE  71   0.520 -17.953  -1.519
 1433   HD12  ILE  71          HD12      ILE  71   0.191 -19.652  -1.854
 1434   HD13  ILE  71          HD13      ILE  71   1.840 -19.123  -1.517
 1435    H    ASP  72           H        ASP  72   1.169 -23.523  -1.386
 1436    HA   ASP  72           HA       ASP  72   1.011 -25.685   0.442
 1437    HB2  ASP  72           HB3      ASP  72   1.226 -26.012  -1.997
 1438    HB3  ASP  72           HB2      ASP  72   2.849 -25.328  -1.941
 1439    H    SER  73           H        SER  73   2.005 -25.609   2.338
 1440    HA   SER  73           HA       SER  73   4.239 -23.943   2.858
 1441    HB2  SER  73           HB3      SER  73   4.160 -25.110   5.120
 1442    HB3  SER  73           HB2      SER  73   2.676 -24.290   4.625
 1443    HG   SER  73           HG       SER  73   1.857 -26.187   5.110
 1444    H    LYS  74           H        LYS  74   4.054 -27.042   1.533
 1445    HA   LYS  74           HA       LYS  74   6.499 -28.046   2.678
 1446    HB2  LYS  74           HB3      LYS  74   4.625 -29.537   1.996
 1447    HB3  LYS  74           HB2      LYS  74   4.917 -29.095   0.325
 1448    HG2  LYS  74           HG3      LYS  74   7.201 -30.031   0.520
 1449    HG3  LYS  74           HG2      LYS  74   6.796 -30.571   2.151
 1450    HD2  LYS  74           HD3      LYS  74   5.377 -31.387  -0.376
 1451    HD3  LYS  74           HD2      LYS  74   6.540 -32.371   0.510
 1452    HE2  LYS  74           HE3      LYS  74   5.028 -32.264   2.481
 1453    HE3  LYS  74           HE2      LYS  74   3.854 -31.416   1.477
 1454    HZ1  LYS  74           HZ1      LYS  74   3.821 -33.353  -0.003
 1455    HZ2  LYS  74           HZ2      LYS  74   3.322 -33.740   1.566
 1456    HZ3  LYS  74           HZ3      LYS  74   4.872 -34.168   1.045
 1457    H    HIS  75           H        HIS  75   5.489 -26.402  -0.237
 1458    HA   HIS  75           HA       HIS  75   8.206 -26.617  -1.318
 1459    HB2  HIS  75           HB3      HIS  75   6.285 -27.119  -2.823
 1460    HB3  HIS  75           HB2      HIS  75   5.722 -25.464  -2.613
 1461    HD1  HIS  75           HD1      HIS  75   6.238 -24.165  -4.646
 1462    HD2  HIS  75           HD2      HIS  75   9.260 -26.876  -3.751
 1463    HE1  HIS  75           HE1      HIS  75   8.007 -23.804  -6.392
 1464    HE2  HIS  75           HE2      HIS  75   9.731 -25.582  -5.941
 1465    H    TRP  76           H        TRP  76   5.979 -24.320   0.077
 1466    HA   TRP  76           HA       TRP  76   8.028 -22.239  -0.267
 1467    HB2  TRP  76           HB3      TRP  76   5.043 -22.007  -0.616
 1468    HB3  TRP  76           HB2      TRP  76   6.055 -20.602  -0.284
 1469    HD1  TRP  76           HD1      TRP  76   4.652 -22.475  -3.086
 1470    HE1  TRP  76           HE1      TRP  76   5.819 -21.847  -5.294
 1471    HE3  TRP  76           HE3      TRP  76   8.735 -20.049  -1.186
 1472    HZ2  TRP  76           HZ2      TRP  76   8.160 -20.507  -6.115
 1473    HZ3  TRP  76           HZ3      TRP  76  10.389 -19.124  -2.751
 1474    HH2  TRP  76           HH2      TRP  76  10.107 -19.349  -5.166
 1475    H    ASN  77           H        ASN  77   8.539 -21.063   1.453
 1476    HA   ASN  77           HA       ASN  77   7.108 -21.490   3.969
 1477    HB2  ASN  77           HB3      ASN  77   9.544 -21.564   4.101
 1478    HB3  ASN  77           HB2      ASN  77   9.668 -20.010   3.305
 1479   HD21  ASN  77          HD21      ASN  77   7.472 -20.982   5.902
 1480   HD22  ASN  77          HD22      ASN  77   8.075 -19.852   7.064
 1481    H    SER  78           H        SER  78   5.824 -19.909   4.861
 1482    HA   SER  78           HA       SER  78   5.627 -17.401   3.341
 1483    HB2  SER  78           HB3      SER  78   3.284 -18.949   4.466
 1484    HB3  SER  78           HB2      SER  78   3.214 -17.477   3.496
 1485    HG   SER  78           HG       SER  78   4.661 -19.232   2.158
 1486    H    TYR  79           H        TYR  79   5.466 -15.583   4.469
 1487    HA   TYR  79           HA       TYR  79   4.346 -15.595   7.113
 1488    HB2  TYR  79           HB3      TYR  79   6.281 -14.316   8.105
 1489    HB3  TYR  79           HB2      TYR  79   6.597 -16.017   7.791
 1490    HD1  TYR  79           HD1      TYR  79   7.580 -12.606   7.074
 1491    HD2  TYR  79           HD2      TYR  79   8.045 -16.660   5.860
 1492    HE1  TYR  79           HE1      TYR  79   9.635 -12.004   5.860
 1493    HE2  TYR  79           HE2      TYR  79  10.095 -16.067   4.640
 1494    HH   TYR  79           HH       TYR  79  11.135 -14.095   3.627
 1495    H    CYS  80           H        CYS  80   3.490 -13.643   7.694
 1496    HA   CYS  80           HA       CYS  80   2.980 -11.887   5.464
 1497    HB2  CYS  80           HB3      CYS  80   1.946 -11.829   8.310
 1498    HB3  CYS  80           HB2      CYS  80   1.367 -10.803   6.997
 1499    H    THR  81           H        THR  81   4.029 -10.105   5.034
 1500    HA   THR  81           HA       THR  81   5.406  -8.681   7.210
 1501    HB   THR  81           HB       THR  81   6.489  -9.067   4.404
 1502    HG1  THR  81           HG1      THR  81   6.462 -10.922   6.003
 1503   HG21  THR  81          HG21      THR  81   7.774  -7.872   6.868
 1504   HG22  THR  81          HG22      THR  81   7.187  -6.961   5.477
 1505   HG23  THR  81          HG23      THR  81   8.539  -8.078   5.292
 1506    H    THR  82           H        THR  82   5.166  -6.472   7.166
 1507    HA   THR  82           HA       THR  82   3.171  -5.460   5.353
 1508    HB   THR  82           HB       THR  82   3.535  -3.315   6.708
 1509    HG1  THR  82           HG1      THR  82   4.770  -3.416   8.479
 1510   HG21  THR  82          HG21      THR  82   2.605  -5.830   8.089
 1511   HG22  THR  82          HG22      THR  82   1.630  -4.771   7.069
 1512   HG23  THR  82          HG23      THR  82   2.246  -4.186   8.615
 1513    H    THR  83           H        THR  83   3.603  -4.541   3.492
 1514    HA   THR  83           HA       THR  83   6.241  -3.649   2.788
 1515    HB   THR  83           HB       THR  83   3.648  -3.128   1.312
 1516    HG1  THR  83           HG1      THR  83   5.244  -5.422   1.552
 1517   HG21  THR  83          HG21      THR  83   5.093  -3.003  -0.661
 1518   HG22  THR  83          HG22      THR  83   6.510  -3.277   0.351
 1519   HG23  THR  83          HG23      THR  83   5.562  -1.803   0.542
 1520    H    HIS  84           H        HIS  84   7.005  -1.571   2.812
 1521    HA   HIS  84           HA       HIS  84   5.253   0.381   4.138
 1522    HB2  HIS  84           HB3      HIS  84   8.276   0.196   4.095
 1523    HB3  HIS  84           HB2      HIS  84   7.368   1.498   4.860
 1524    HD1  HIS  84           HD1      HIS  84   8.520  -1.975   5.373
 1525    HD2  HIS  84           HD2      HIS  84   5.913   0.701   7.196
 1526    HE1  HIS  84           HE1      HIS  84   8.002  -2.960   7.623
 1527    HE2  HIS  84           HE2      HIS  84   6.226  -1.455   8.585
 1528    H    THR  85           H        THR  85   4.561   2.042   3.004
 1529    HA   THR  85           HA       THR  85   6.022   2.733   0.534
 1530    HB   THR  85           HB       THR  85   3.544   1.980   0.408
 1531    HG1  THR  85           HG1      THR  85   3.308   3.286  -1.358
 1532   HG21  THR  85          HG21      THR  85   2.720   3.348   2.275
 1533   HG22  THR  85          HG22      THR  85   1.896   3.758   0.771
 1534   HG23  THR  85          HG23      THR  85   3.162   4.813   1.398
 1535    H    PHE  86           H        PHE  86   5.920   5.080  -0.042
 1536    HA   PHE  86           HA       PHE  86   6.357   6.649   2.400
 1537    HB2  PHE  86           HB3      PHE  86   7.369   7.192  -0.409
 1538    HB3  PHE  86           HB2      PHE  86   7.776   8.110   1.042
 1539    HD1  PHE  86           HD1      PHE  86   9.062   6.972   2.876
 1540    HD2  PHE  86           HD2      PHE  86   8.563   5.258  -0.988
 1541    HE1  PHE  86           HE1      PHE  86  10.964   5.474   3.300
 1542    HE2  PHE  86           HE2      PHE  86  10.465   3.754  -0.570
 1543    HZ   PHE  86           HZ       PHE  86  11.668   3.860   1.575
 1544    H    VAL  87           H        VAL  87   4.832   8.046   2.920
 1545    HA   VAL  87           HA       VAL  87   2.991   8.930   0.805
 1546    HB   VAL  87           HB       VAL  87   1.360   9.363   2.644
 1547   HG11  VAL  87          HG11      VAL  87   1.210   7.332   1.346
 1548   HG12  VAL  87          HG12      VAL  87   0.808   6.999   3.032
 1549   HG13  VAL  87          HG13      VAL  87   2.388   6.545   2.396
 1550   HG21  VAL  87          HG21      VAL  87   3.374   7.900   4.345
 1551   HG22  VAL  87          HG22      VAL  87   1.739   8.343   4.830
 1552   HG23  VAL  87          HG23      VAL  87   2.929   9.599   4.496
 1553    H    LYS  88           H        LYS  88   2.583  11.000   0.478
 1554    HA   LYS  88           HA       LYS  88   4.359  12.991   1.427
 1555    HB2  LYS  88           HB3      LYS  88   2.768  14.545   0.173
 1556    HB3  LYS  88           HB2      LYS  88   3.549  13.289  -0.773
 1557    HG2  LYS  88           HG3      LYS  88   1.428  11.929  -0.460
 1558    HG3  LYS  88           HG2      LYS  88   0.698  13.403   0.166
 1559    HD2  LYS  88           HD3      LYS  88   1.026  14.539  -1.896
 1560    HD3  LYS  88           HD2      LYS  88   2.049  13.245  -2.519
 1561    HE2  LYS  88           HE3      LYS  88  -0.033  12.955  -3.567
 1562    HE3  LYS  88           HE2      LYS  88   0.024  11.735  -2.295
 1563    HZ1  LYS  88           HZ1      LYS  88  -1.278  13.315  -0.896
 1564    HZ2  LYS  88           HZ2      LYS  88  -2.107  12.749  -2.254
 1565    HZ3  LYS  88           HZ3      LYS  88  -1.454  14.307  -2.260
 1566    H    ALA  89           H        ALA  89   4.313  13.545   3.477
 1567    HA   ALA  89           HA       ALA  89   1.755  14.438   4.636
 1568    HB1  ALA  89           HB1      ALA  89   2.368  12.211   5.515
 1569    HB2  ALA  89           HB2      ALA  89   2.332  13.456   6.762
 1570    HB3  ALA  89           HB3      ALA  89   3.876  12.893   6.122
 1571    H    LEU  90           H        LEU  90   1.842  16.363   5.715
 1572    HA   LEU  90           HA       LEU  90   4.261  17.885   5.700
 1573    HB2  LEU  90           HB3      LEU  90   1.987  18.919   5.545
 1574    HB3  LEU  90           HB2      LEU  90   1.698  18.442   7.213
 1575    HG   LEU  90           HG       LEU  90   3.742  19.847   7.819
 1576   HD11  LEU  90          HD11      LEU  90   3.279  20.866   5.025
 1577   HD12  LEU  90          HD12      LEU  90   4.727  20.063   5.632
 1578   HD13  LEU  90          HD13      LEU  90   4.279  21.657   6.241
 1579   HD21  LEU  90          HD21      LEU  90   2.461  21.948   7.769
 1580   HD22  LEU  90          HD22      LEU  90   1.505  20.580   8.340
 1581   HD23  LEU  90          HD23      LEU  90   1.287  21.185   6.696
 1582    H    THR  91           H        THR  91   5.875  17.345   6.994
 1583    HA   THR  91           HA       THR  91   5.271  16.711   9.802
 1584    HB   THR  91           HB       THR  91   7.078  15.012   9.783
 1585    HG1  THR  91           HG1      THR  91   7.006  15.385   6.958
 1586   HG21  THR  91          HG21      THR  91   5.866  13.253   8.659
 1587   HG22  THR  91          HG22      THR  91   4.994  14.429   7.677
 1588   HG23  THR  91          HG23      THR  91   4.704  14.345   9.412
 1589    H    THR  92           H        THR  92   7.218  17.010  11.215
 1590    HA   THR  92           HA       THR  92   8.946  19.099  10.081
 1591    HB   THR  92           HB       THR  92   7.506  20.161  11.675
 1592    HG1  THR  92           HG1      THR  92   9.260  20.495  13.436
 1593   HG21  THR  92          HG21      THR  92   7.272  19.476  13.969
 1594   HG22  THR  92          HG22      THR  92   8.425  18.166  13.736
 1595   HG23  THR  92          HG23      THR  92   6.858  18.113  12.928
 1596    H    ASP  93           H        ASP  93  10.982  18.549   9.921
 1597    HA   ASP  93           HA       ASP  93  11.995  16.188  11.201
 1598    HB2  ASP  93           HB3      ASP  93  14.128  16.762  10.044
 1599    HB3  ASP  93           HB2      ASP  93  12.747  16.680   8.957
 1600    H    GLU  94           H        GLU  94  11.656  19.376  12.133
 1601    HA   GLU  94           HA       GLU  94  13.066  18.905  14.573
 1602    HB2  GLU  94           HB3      GLU  94  14.917  19.614  13.050
 1603    HB3  GLU  94           HB2      GLU  94  14.084  21.139  12.808
 1604    HG2  GLU  94           HG3      GLU  94  15.852  21.379  14.428
 1605    HG3  GLU  94           HG2      GLU  94  14.283  21.632  15.183
 1606    H    LYS  95           H        LYS  95  12.458  21.990  12.916
 1607    HA   LYS  95           HA       LYS  95  10.036  22.369  14.502
 1608    HB2  LYS  95           HB3      LYS  95  10.775  24.650  15.173
 1609    HB3  LYS  95           HB2      LYS  95  11.733  23.370  15.900
 1610    HG2  LYS  95           HG3      LYS  95  13.500  23.757  14.262
 1611    HG3  LYS  95           HG2      LYS  95  12.531  25.036  13.526
 1612    HD2  LYS  95           HD3      LYS  95  12.578  26.276  15.633
 1613    HD3  LYS  95           HD2      LYS  95  13.555  25.004  16.364
 1614    HE2  LYS  95           HE3      LYS  95  15.314  25.431  14.705
 1615    HE3  LYS  95           HE2      LYS  95  14.332  26.718  14.009
 1616    HZ1  LYS  95           HZ1      LYS  95  14.478  27.931  16.064
 1617    HZ2  LYS  95           HZ2      LYS  95  16.037  27.546  15.540
 1618    HZ3  LYS  95           HZ3      LYS  95  15.331  26.673  16.804
 1619    H    GLN  96           H        GLN  96  10.661  21.896  11.692
 1620    HA   GLN  96           HA       GLN  96   9.399  24.282  10.546
 1621    HB2  GLN  96           HB3      GLN  96  11.734  22.755   9.368
 1622    HB3  GLN  96           HB2      GLN  96  10.803  23.962   8.497
 1623    HG2  GLN  96           HG3      GLN  96  12.285  24.542  11.046
 1624    HG3  GLN  96           HG2      GLN  96  12.991  24.737   9.442
 1625   HE21  GLN  96          HE21      GLN  96  10.656  25.957  11.724
 1626   HE22  GLN  96          HE22      GLN  96  10.361  27.454  10.912
 1627    H    ALA  97           H        ALA  97   7.511  23.677   9.729
 1628    HA   ALA  97           HA       ALA  97   6.917  20.909   9.243
 1629    HB1  ALA  97           HB1      ALA  97   5.239  23.362   8.729
 1630    HB2  ALA  97           HB2      ALA  97   5.237  22.394  10.205
 1631    HB3  ALA  97           HB3      ALA  97   4.675  21.691   8.689
 1632    H    ALA  98           H        ALA  98   7.509  19.907   7.458
 1633    HA   ALA  98           HA       ALA  98   7.292  21.330   4.897
 1634    HB1  ALA  98           HB1      ALA  98   9.547  19.496   5.711
 1635    HB2  ALA  98           HB2      ALA  98   9.653  21.248   5.538
 1636    HB3  ALA  98           HB3      ALA  98   9.344  20.238   4.125
 1637    H    TRP  99           H        TRP  99   6.637  20.084   3.154
 1638    HA   TRP  99           HA       TRP  99   5.151  17.716   3.807
 1639    HB2  TRP  99           HB3      TRP  99   5.707  19.011   1.122
 1640    HB3  TRP  99           HB2      TRP  99   4.559  17.706   1.401
 1641    HD1  TRP  99           HD1      TRP  99   4.970  21.456   1.782
 1642    HE1  TRP  99           HE1      TRP  99   2.723  22.493   2.496
 1643    HE3  TRP  99           HE3      TRP  99   2.368  17.162   2.745
 1644    HZ2  TRP  99           HZ2      TRP  99   0.187  21.603   3.356
 1645    HZ3  TRP  99           HZ3      TRP  99   0.034  17.343   3.513
 1646    HH2  TRP  99           HH2      TRP  99  -1.031  19.520   3.808
 1647    H    ARG 100           H        ARG 100   6.288  15.974   4.273
 1648    HA   ARG 100           HA       ARG 100   8.618  15.278   2.617
 1649    HB2  ARG 100           HB3      ARG 100   7.818  14.229   5.345
 1650    HB3  ARG 100           HB2      ARG 100   9.300  13.840   4.489
 1651    HG2  ARG 100           HG3      ARG 100   8.559  16.598   5.445
 1652    HG3  ARG 100           HG2      ARG 100   9.577  15.467   6.333
 1653    HD2  ARG 100           HD3      ARG 100  11.102  15.420   4.340
 1654    HD3  ARG 100           HD2      ARG 100  10.141  16.734   3.662
 1655    HE   ARG 100           HE       ARG 100  11.041  17.317   6.305
 1656   HH11  ARG 100          HH11      ARG 100  11.993  17.304   2.942
 1657   HH12  ARG 100          HH12      ARG 100  13.237  18.493   3.156
 1658   HH21  ARG 100          HH21      ARG 100  12.694  18.869   6.613
 1659   HH22  ARG 100          HH22      ARG 100  13.643  19.376   5.246
 1660    H    PHE 101           H        PHE 101   8.927  12.776   2.651
 1661    HA   PHE 101           HA       PHE 101   6.328  11.473   2.161
 1662    HB2  PHE 101           HB3      PHE 101   8.961  11.117   0.705
 1663    HB3  PHE 101           HB2      PHE 101   7.654   9.951   0.594
 1664    HD1  PHE 101           HD1      PHE 101   8.645  13.423  -0.206
 1665    HD2  PHE 101           HD2      PHE 101   5.765  10.333  -0.762
 1666    HE1  PHE 101           HE1      PHE 101   7.627  14.702  -2.042
 1667    HE2  PHE 101           HE2      PHE 101   4.743  11.614  -2.598
 1668    HZ   PHE 101           HZ       PHE 101   5.675  13.799  -3.240
 1669    H    ILE 102           H        ILE 102   5.949  10.147   3.836
 1670    HA   ILE 102           HA       ILE 102   8.304   9.017   5.209
 1671    HB   ILE 102           HB       ILE 102   6.873   8.902   7.244
 1672   HG12  ILE 102          HG13      ILE 102   4.967  10.635   5.662
 1673   HG13  ILE 102          HG12      ILE 102   4.684   8.944   6.047
 1674   HG21  ILE 102          HG21      ILE 102   7.244  11.638   6.041
 1675   HG22  ILE 102          HG22      ILE 102   8.447  10.717   6.945
 1676   HG23  ILE 102          HG23      ILE 102   6.991  11.296   7.754
 1677   HD11  ILE 102          HD11      ILE 102   4.703   9.493   8.430
 1678   HD12  ILE 102          HD12      ILE 102   3.464  10.390   7.551
 1679   HD13  ILE 102          HD13      ILE 102   4.963  11.191   8.027
 1680    H    ARG 103           H        ARG 103   8.290   6.913   5.901
 1681    HA   ARG 103           HA       ARG 103   6.717   5.207   4.183
 1682    HB2  ARG 103           HB3      ARG 103   8.196   3.411   4.920
 1683    HB3  ARG 103           HB2      ARG 103   9.128   4.818   4.430
 1684    HG2  ARG 103           HG3      ARG 103   9.208   5.406   6.913
 1685    HG3  ARG 103           HG2      ARG 103   8.644   3.760   7.190
 1686    HD2  ARG 103           HD3      ARG 103  11.023   3.723   7.336
 1687    HD3  ARG 103           HD2      ARG 103  10.580   2.961   5.806
 1688    HE   ARG 103           HE       ARG 103  11.116   5.769   5.553
 1689   HH11  ARG 103          HH11      ARG 103  12.571   2.588   5.630
 1690   HH12  ARG 103          HH12      ARG 103  14.008   3.082   4.797
 1691   HH21  ARG 103          HH21      ARG 103  13.017   6.428   4.460
 1692   HH22  ARG 103          HH22      ARG 103  14.260   5.259   4.126
 1693    H    ILE 104           H        ILE 104   4.947   4.193   4.711
 1694    HA   ILE 104           HA       ILE 104   4.409   3.618   7.552
 1695    HB   ILE 104           HB       ILE 104   2.003   3.948   7.129
 1696   HG12  ILE 104          HG13      ILE 104   2.827   5.115   4.466
 1697   HG13  ILE 104          HG12      ILE 104   2.146   3.505   4.657
 1698   HG21  ILE 104          HG21      ILE 104   3.281   5.786   8.066
 1699   HG22  ILE 104          HG22      ILE 104   2.021   6.398   6.996
 1700   HG23  ILE 104          HG23      ILE 104   3.695   6.348   6.445
 1701   HD11  ILE 104          HD11      ILE 104   0.098   4.476   5.550
 1702   HD12  ILE 104          HD12      ILE 104   0.468   5.106   3.946
 1703   HD13  ILE 104          HD13      ILE 104   0.786   6.089   5.374
 1704    H    ASP 105           H        ASP 105   3.156   1.750   7.969
 1705    HA   ASP 105           HA       ASP 105   3.590  -0.476   6.258
 1706    HB2  ASP 105           HB3      ASP 105   1.688  -0.170   8.609
 1707    HB3  ASP 105           HB2      ASP 105   2.108  -1.701   7.840
 1708    H    THR 106           H        THR 106   2.622  -0.612   4.344
 1709    HA   THR 106           HA       THR 106   0.096   0.775   3.922
 1710    HB   THR 106           HB       THR 106   1.602  -0.659   1.765
 1711    HG1  THR 106           HG1      THR 106   2.573   1.296   3.418
 1712   HG21  THR 106          HG21      THR 106   0.873   1.256   0.435
 1713   HG22  THR 106          HG22      THR 106   0.176   2.005   1.870
 1714   HG23  THR 106          HG23      THR 106  -0.507   0.506   1.239
 1715    H    ALA 107           H        ALA 107   1.479  -2.455   3.401
 1716    HA   ALA 107           HA       ALA 107  -1.166  -3.619   3.658
 1717    HB1  ALA 107           HB1      ALA 107  -0.973  -4.897   1.584
 1718    HB2  ALA 107           HB2      ALA 107   0.535  -4.066   1.206
 1719    HB3  ALA 107           HB3      ALA 107  -0.978  -3.162   1.261
 1720    H    CYS 108           H        CYS 108  -1.124  -5.775   4.269
 1721    HA   CYS 108           HA       CYS 108   1.501  -6.765   5.120
 1722    HB2  CYS 108           HB3      CYS 108  -0.124  -6.546   6.925
 1723    HB3  CYS 108           HB2      CYS 108  -1.292  -7.518   6.026
 1724    H    VAL 109           H        VAL 109   2.398  -8.131   3.728
 1725    HA   VAL 109           HA       VAL 109   0.590  -9.732   2.039
 1726    HB   VAL 109           HB       VAL 109   2.323  -9.693   0.304
 1727   HG11  VAL 109          HG11      VAL 109   2.152  -7.317  -0.303
 1728   HG12  VAL 109          HG12      VAL 109   1.584  -6.954   1.326
 1729   HG13  VAL 109          HG13      VAL 109   0.614  -7.973   0.260
 1730   HG21  VAL 109          HG21      VAL 109   4.277  -8.231   0.510
 1731   HG22  VAL 109          HG22      VAL 109   4.297  -9.503   1.734
 1732   HG23  VAL 109          HG23      VAL 109   3.829  -7.860   2.174
 1733    H    CYS 110           H        CYS 110   0.974 -11.879   1.762
 1734    HA   CYS 110           HA       CYS 110   2.843 -13.199   3.507
 1735    HB2  CYS 110           HB3      CYS 110   0.961 -14.230   1.376
 1736    HB3  CYS 110           HB2      CYS 110   2.035 -15.274   2.293
 1737    H    VAL 111           H        VAL 111   4.941 -12.971   2.985
 1738    HA   VAL 111           HA       VAL 111   5.694 -13.024   0.166
 1739    HB   VAL 111           HB       VAL 111   7.959 -12.488   0.909
 1740   HG11  VAL 111          HG11      VAL 111   7.522 -10.283   1.894
 1741   HG12  VAL 111          HG12      VAL 111   5.863 -10.774   2.235
 1742   HG13  VAL 111          HG13      VAL 111   6.420 -10.644   0.565
 1743   HG21  VAL 111          HG21      VAL 111   7.964 -13.769   2.992
 1744   HG22  VAL 111          HG22      VAL 111   6.854 -12.599   3.710
 1745   HG23  VAL 111          HG23      VAL 111   8.482 -12.102   3.246
 1746    H    LEU 112           H        LEU 112   7.143 -14.556  -0.703
 1747    HA   LEU 112           HA       LEU 112   6.888 -17.137   0.666
 1748    HB2  LEU 112           HB3      LEU 112   7.442 -16.530  -2.242
 1749    HB3  LEU 112           HB2      LEU 112   7.257 -18.134  -1.558
 1750    HG   LEU 112           HG       LEU 112   5.099 -16.019  -1.704
 1751   HD11  LEU 112          HD11      LEU 112   4.055 -17.546  -3.309
 1752   HD12  LEU 112          HD12      LEU 112   5.467 -18.597  -3.224
 1753   HD13  LEU 112          HD13      LEU 112   5.619 -16.966  -3.878
 1754   HD21  LEU 112          HD21      LEU 112   4.833 -17.411   0.276
 1755   HD22  LEU 112          HD22      LEU 112   4.980 -18.865  -0.710
 1756   HD23  LEU 112          HD23      LEU 112   3.600 -17.792  -0.923
 1757    H    SER 113           H        SER 113   8.572 -18.378   1.137
 1758    HA   SER 113           HA       SER 113  11.251 -17.490   0.320
 1759    HB2  SER 113           HB3      SER 113  11.083 -16.826   2.600
 1760    HB3  SER 113           HB2      SER 113  10.277 -18.320   3.058
 1761    HG   SER 113           HG       SER 113  12.553 -18.182   3.622
 1762    H    ARG 114           H        ARG 114  12.831 -19.198   0.240
 1763    HA   ARG 114           HA       ARG 114  11.697 -21.537  -0.986
 1764    HB2  ARG 114           HB3      ARG 114  14.500 -20.510  -0.638
 1765    HB3  ARG 114           HB2      ARG 114  14.199 -22.129  -1.251
 1766    HG2  ARG 114           HG3      ARG 114  13.132 -19.598  -2.489
 1767    HG3  ARG 114           HG2      ARG 114  14.565 -20.473  -3.037
 1768    HD2  ARG 114           HD3      ARG 114  13.149 -22.470  -3.405
 1769    HD3  ARG 114           HD2      ARG 114  11.736 -21.517  -2.959
 1770    HE   ARG 114           HE       ARG 114  12.944 -20.117  -4.983
 1771   HH11  ARG 114          HH11      ARG 114  11.595 -23.314  -4.577
 1772   HH12  ARG 114          HH12      ARG 114  11.168 -23.491  -6.247
 1773   HH21  ARG 114          HH21      ARG 114  12.366 -20.333  -7.193
 1774   HH22  ARG 114          HH22      ARG 114  11.599 -21.792  -7.735
 1775    H    LYS 115           H        LYS 115  11.916 -20.910   2.099
 1776    HA   LYS 115           HA       LYS 115  11.862 -22.160   3.995
 1777    HB2  LYS 115           HB3      LYS 115  12.088 -24.546   2.135
 1778    HB3  LYS 115           HB2      LYS 115  11.679 -24.622   3.840
 1779    HG2  LYS 115           HG3      LYS 115   9.622 -23.368   3.398
 1780    HG3  LYS 115           HG2      LYS 115  10.047 -23.298   1.687
 1781    HD2  LYS 115           HD3      LYS 115   8.470 -25.078   2.016
 1782    HD3  LYS 115           HD2      LYS 115  10.042 -25.772   1.627
 1783    HE2  LYS 115           HE3      LYS 115   9.051 -27.041   3.406
 1784    HE3  LYS 115           HE2      LYS 115  10.428 -26.144   4.038
 1785    HZ1  LYS 115           HZ1      LYS 115   8.550 -26.034   5.541
 1786    HZ2  LYS 115           HZ2      LYS 115   7.572 -25.379   4.325
 1787    HZ3  LYS 115           HZ3      LYS 115   8.889 -24.495   4.924
 1788    H    ALA 116           H        ALA 116  14.244 -21.047   3.106
 1789    HA   ALA 116           HA       ALA 116  16.177 -22.854   4.372
 1790    HB1  ALA 116           HB1      ALA 116  17.887 -22.252   2.737
 1791    HB2  ALA 116           HB2      ALA 116  16.714 -21.277   1.854
 1792    HB3  ALA 116           HB3      ALA 116  16.514 -23.026   1.945
 1793    H    THR 117           H        THR 117  18.224 -21.562   4.925
 1794    HA   THR 117           HA       THR 117  17.693 -18.733   5.414
 1795    HB   THR 117           HB       THR 117  18.709 -19.108   7.774
 1796    HG1  THR 117           HG1      THR 117  17.542 -21.675   7.383
 1797   HG21  THR 117          HG21      THR 117  16.418 -18.337   7.409
 1798   HG22  THR 117          HG22      THR 117  16.486 -19.485   8.747
 1799   HG23  THR 117          HG23      THR 117  15.888 -20.003   7.171
 1800    H    ARG 118           H        ARG 118  19.856 -17.923   6.705
 1801    HA   ARG 118           HA       ARG 118  22.058 -18.812   4.977
 1802    HB2  ARG 118           HB3      ARG 118  21.666 -16.196   6.442
 1803    HB3  ARG 118           HB2      ARG 118  23.097 -16.610   5.517
 1804    HG2  ARG 118           HG3      ARG 118  20.302 -16.295   4.440
 1805    HG3  ARG 118           HG2      ARG 118  21.639 -15.165   4.240
 1806    HD2  ARG 118           HD3      ARG 118  21.498 -17.985   3.166
 1807    HD3  ARG 118           HD2      ARG 118  21.352 -16.498   2.229
 1808    HE   ARG 118           HE       ARG 118  23.770 -16.242   3.425
 1809   HH11  ARG 118          HH11      ARG 118  22.299 -18.750   1.486
 1810   HH12  ARG 118          HH12      ARG 118  23.806 -19.297   0.823
 1811   HH21  ARG 118          HH21      ARG 118  25.758 -16.946   2.537
 1812   HH22  ARG 118          HH22      ARG 118  25.771 -18.266   1.412
  Start of MODEL   12
    1    H1   SER   1           H1       SER   1  27.797   0.478   1.946
    2    H2   SER   1           H2       SER   1  26.815  -0.479   2.931
    3    H3   SER   1           H3       SER   1  27.421   0.988   3.512
    4    HA   SER   1           HA       SER   1  25.096   1.172   2.917
    5    HB2  SER   1           HB3      SER   1  26.654   3.114   2.712
    6    HB3  SER   1           HB2      SER   1  26.920   2.686   1.024
    7    HG   SER   1           HG       SER   1  25.277   3.973   0.715
    8    H    SER   2           H        SER   2  23.628   1.518   1.003
    9    HA   SER   2           HA       SER   2  22.585   0.832  -0.894
   10    HB2  SER   2           HB3      SER   2  24.725   1.642  -1.952
   11    HB3  SER   2           HB2      SER   2  25.315  -0.019  -1.892
   12    HG   SER   2           HG       SER   2  24.065  -0.532  -3.511
   13    H    THR   3           H        THR   3  23.158  -1.006   1.383
   14    HA   THR   3           HA       THR   3  23.423  -3.618   0.176
   15    HB   THR   3           HB       THR   3  22.888  -4.381   2.567
   16    HG1  THR   3           HG1      THR   3  22.112  -2.751   3.706
   17   HG21  THR   3          HG21      THR   3  25.155  -4.346   1.655
   18   HG22  THR   3          HG22      THR   3  25.156  -3.854   3.347
   19   HG23  THR   3          HG23      THR   3  25.310  -2.643   2.074
   20    H    HIS   4           H        HIS   4  21.826  -5.074  -0.200
   21    HA   HIS   4           HA       HIS   4  19.126  -4.528   0.693
   22    HB2  HIS   4           HB3      HIS   4  18.225  -4.776  -1.665
   23    HB3  HIS   4           HB2      HIS   4  19.031  -3.256  -1.314
   24    HD1  HIS   4           HD1      HIS   4  21.346  -2.850  -2.463
   25    HD2  HIS   4           HD2      HIS   4  19.395  -6.322  -3.660
   26    HE1  HIS   4           HE1      HIS   4  22.529  -3.606  -4.542
   27    HE2  HIS   4           HE2      HIS   4  21.389  -5.749  -5.207
   28    HA   PRO   5           HA       PRO   5  19.827  -9.012   0.684
   29    HB2  PRO   5           HB3      PRO   5  18.369  -9.547   2.871
   30    HB3  PRO   5           HB2      PRO   5  19.988  -8.849   2.998
   31    HG2  PRO   5           HG3      PRO   5  17.321  -7.502   3.197
   32    HG3  PRO   5           HG2      PRO   5  18.770  -7.254   4.186
   33    HD2  PRO   5           HD3      PRO   5  18.024  -5.621   2.104
   34    HD3  PRO   5           HD2      PRO   5  19.696  -5.807   2.668
   35    H    VAL   6           H        VAL   6  18.317  -8.262  -1.281
   36    HA   VAL   6           HA       VAL   6  16.463  -8.593  -2.556
   37    HB   VAL   6           HB       VAL   6  15.704 -10.808  -0.653
   38   HG11  VAL   6          HG11      VAL   6  15.304 -10.438  -3.618
   39   HG12  VAL   6          HG12      VAL   6  14.063 -10.322  -2.368
   40   HG13  VAL   6          HG13      VAL   6  14.840 -11.870  -2.699
   41   HG21  VAL   6          HG21      VAL   6  18.074 -11.053  -1.172
   42   HG22  VAL   6          HG22      VAL   6  17.714 -10.943  -2.895
   43   HG23  VAL   6          HG23      VAL   6  17.120 -12.313  -1.956
   44    H    PHE   7           H        PHE   7  16.328  -6.653  -0.582
   45    HA   PHE   7           HA       PHE   7  14.955  -5.331   0.652
   46    HB2  PHE   7           HB3      PHE   7  13.827  -5.287  -1.578
   47    HB3  PHE   7           HB2      PHE   7  12.794  -6.605  -1.045
   48    HD1  PHE   7           HD1      PHE   7  10.720  -6.075  -0.216
   49    HD2  PHE   7           HD2      PHE   7  13.837  -3.190   0.034
   50    HE1  PHE   7           HE1      PHE   7   9.130  -4.448   0.712
   51    HE2  PHE   7           HE2      PHE   7  12.254  -1.556   0.969
   52    HZ   PHE   7           HZ       PHE   7   9.899  -2.181   1.310
   53    H    HIS   8           H        HIS   8  15.678  -7.564   1.999
   54    HA   HIS   8           HA       HIS   8  15.187  -8.927   3.761
   55    HB2  HIS   8           HB3      HIS   8  14.289  -6.668   4.569
   56    HB3  HIS   8           HB2      HIS   8  12.695  -7.248   4.116
   57    HD1  HIS   8           HD1      HIS   8  15.472  -7.911   6.584
   58    HD2  HIS   8           HD2      HIS   8  11.494  -8.938   5.941
   59    HE1  HIS   8           HE1      HIS   8  14.725  -9.084   8.680
   60    HE2  HIS   8           HE2      HIS   8  12.339  -9.760   8.242
   61    H    MET   9           H        MET   9  14.470  -9.833   1.286
   62    HA   MET   9           HA       MET   9  13.137 -11.135   0.014
   63    HB2  MET   9           HB3      MET   9  12.385 -13.194   1.004
   64    HB3  MET   9           HB2      MET   9  13.930 -12.762   1.711
   65    HG2  MET   9           HG3      MET   9  12.839 -12.015   3.730
   66    HG3  MET   9           HG2      MET   9  11.258 -12.311   3.016
   67    HE1  MET   9           HE1      MET   9  14.440 -14.602   2.579
   68    HE2  MET   9           HE2      MET   9  14.278 -15.675   3.969
   69    HE3  MET   9           HE3      MET   9  14.614 -13.961   4.211
   70    H    GLY  10           H        GLY  10  11.899  -8.703   0.886
   71    HA2  GLY  10           HA3      GLY  10   9.090  -9.521   1.209
   72    HA3  GLY  10           HA2      GLY  10   9.737  -7.944   1.614
   73    H    GLU  11           H        GLU  11  11.063  -8.914  -1.272
   74    HA   GLU  11           HA       GLU  11   9.155  -7.226  -2.716
   75    HB2  GLU  11           HB3      GLU  11  10.886  -6.978  -4.427
   76    HB3  GLU  11           HB2      GLU  11  11.475  -6.507  -2.838
   77    HG2  GLU  11           HG3      GLU  11  12.707  -8.564  -2.626
   78    HG3  GLU  11           HG2      GLU  11  12.019  -9.170  -4.135
   79    H    PHE  12           H        PHE  12   9.113 -10.271  -2.066
   80    HA   PHE  12           HA       PHE  12   8.796 -11.330  -4.761
   81    HB2  PHE  12           HB3      PHE  12   8.399 -12.631  -2.057
   82    HB3  PHE  12           HB2      PHE  12   8.175 -13.455  -3.594
   83    HD1  PHE  12           HD1      PHE  12  10.402 -12.938  -0.983
   84    HD2  PHE  12           HD2      PHE  12  10.271 -13.198  -5.230
   85    HE1  PHE  12           HE1      PHE  12  12.788 -13.529  -1.019
   86    HE2  PHE  12           HE2      PHE  12  12.658 -13.790  -5.270
   87    HZ   PHE  12           HZ       PHE  12  13.918 -13.956  -3.162
   88    H    SER  13           H        SER  13   6.783 -12.075  -5.573
   89    HA   SER  13           HA       SER  13   4.424 -11.155  -4.113
   90    HB2  SER  13           HB3      SER  13   5.049 -10.410  -6.981
   91    HB3  SER  13           HB2      SER  13   3.576  -9.996  -6.111
   92    HG   SER  13           HG       SER  13   5.550  -9.182  -4.596
   93    H    VAL  14           H        VAL  14   2.833 -12.624  -4.166
   94    HA   VAL  14           HA       VAL  14   2.968 -14.948  -5.832
   95    HB   VAL  14           HB       VAL  14   0.721 -15.493  -4.898
   96   HG11  VAL  14          HG11      VAL  14   1.462 -15.796  -2.585
   97   HG12  VAL  14          HG12      VAL  14   2.790 -14.671  -2.867
   98   HG13  VAL  14          HG13      VAL  14   2.734 -16.204  -3.736
   99   HG21  VAL  14          HG21      VAL  14   1.037 -12.910  -3.368
  100   HG22  VAL  14          HG22      VAL  14  -0.252 -14.094  -3.164
  101   HG23  VAL  14          HG23      VAL  14  -0.114 -13.189  -4.674
  102    H    CYS  15           H        CYS  15   1.687 -11.825  -6.175
  103    HA   CYS  15           HA       CYS  15   0.373 -12.593  -8.687
  104    HB2  CYS  15           HB3      CYS  15  -0.467 -10.376  -6.794
  105    HB3  CYS  15           HB2      CYS  15  -1.226 -10.752  -8.341
  106    H    ASP  16           H        ASP  16   1.075 -11.492 -10.450
  107    HA   ASP  16           HA       ASP  16   3.350  -9.804 -10.254
  108    HB2  ASP  16           HB3      ASP  16   1.492 -10.326 -12.594
  109    HB3  ASP  16           HB2      ASP  16   3.002  -9.428 -12.706
  110    H    SER  17           H        SER  17   3.385  -7.757  -9.653
  111    HA   SER  17           HA       SER  17   1.001  -6.120 -10.152
  112    HB2  SER  17           HB3      SER  17   1.645  -4.995  -7.914
  113    HB3  SER  17           HB2      SER  17   0.850  -6.573  -7.857
  114    HG   SER  17           HG       SER  17   2.883  -7.527  -7.552
  115    H    VAL  18           H        VAL  18   1.318  -3.868 -10.320
  116    HA   VAL  18           HA       VAL  18   4.064  -3.080 -11.008
  117    HB   VAL  18           HB       VAL  18   2.844  -3.261 -13.064
  118   HG11  VAL  18          HG11      VAL  18   0.742  -1.510 -11.803
  119   HG12  VAL  18          HG12      VAL  18   0.577  -3.213 -12.229
  120   HG13  VAL  18          HG13      VAL  18   0.779  -2.004 -13.496
  121   HG21  VAL  18          HG21      VAL  18   3.075  -0.384 -12.208
  122   HG22  VAL  18          HG22      VAL  18   2.903  -0.932 -13.875
  123   HG23  VAL  18          HG23      VAL  18   4.334  -1.376 -12.944
  124    H    SER  19           H        SER  19   4.780  -1.630  -9.596
  125    HA   SER  19           HA       SER  19   2.846   0.140  -8.271
  126    HB2  SER  19           HB3      SER  19   4.378  -1.306  -6.860
  127    HB3  SER  19           HB2      SER  19   5.728  -0.349  -7.472
  128    HG   SER  19           HG       SER  19   3.510   0.551  -5.936
  129    H    VAL  20           H        VAL  20   2.680   2.131  -9.038
  130    HA   VAL  20           HA       VAL  20   5.005   3.287 -10.440
  131    HB   VAL  20           HB       VAL  20   2.078   3.769 -11.015
  132   HG11  VAL  20          HG11      VAL  20   3.363   5.738 -11.486
  133   HG12  VAL  20          HG12      VAL  20   2.903   4.968 -13.005
  134   HG13  VAL  20          HG13      VAL  20   4.547   4.796 -12.390
  135   HG21  VAL  20          HG21      VAL  20   2.740   1.553 -11.714
  136   HG22  VAL  20          HG22      VAL  20   4.129   2.213 -12.576
  137   HG23  VAL  20          HG23      VAL  20   2.493   2.586 -13.122
  138    H    TRP  21           H        TRP  21   5.647   5.284  -9.842
  139    HA   TRP  21           HA       TRP  21   3.989   6.733  -7.905
  140    HB2  TRP  21           HB3      TRP  21   6.907   7.042  -8.661
  141    HB3  TRP  21           HB2      TRP  21   6.055   8.149  -7.590
  142    HD1  TRP  21           HD1      TRP  21   7.357   4.534  -7.732
  143    HE1  TRP  21           HE1      TRP  21   7.539   3.631  -5.329
  144    HE3  TRP  21           HE3      TRP  21   5.159   8.426  -5.232
  145    HZ2  TRP  21           HZ2      TRP  21   6.846   4.461  -2.718
  146    HZ3  TRP  21           HZ3      TRP  21   4.962   8.291  -2.783
  147    HH2  TRP  21           HH2      TRP  21   5.786   6.351  -1.553
  148    H    VAL  22           H        VAL  22   2.511   7.734  -9.108
  149    HA   VAL  22           HA       VAL  22   3.119   8.794 -11.714
  150    HB   VAL  22           HB       VAL  22   0.569   9.024 -10.110
  151   HG11  VAL  22          HG11      VAL  22   0.650  10.634 -11.897
  152   HG12  VAL  22          HG12      VAL  22  -0.484   9.352 -12.314
  153   HG13  VAL  22          HG13      VAL  22   1.119   9.384 -13.047
  154   HG21  VAL  22          HG21      VAL  22   1.354   6.961 -12.164
  155   HG22  VAL  22          HG22      VAL  22  -0.229   7.109 -11.399
  156   HG23  VAL  22          HG23      VAL  22   1.182   6.687 -10.430
  157    H    GLY  23           H        GLY  23   4.148  10.677 -11.884
  158    HA2  GLY  23           HA3      GLY  23   3.762  12.726  -9.836
  159    HA3  GLY  23           HA2      GLY  23   4.981  12.741 -11.109
  160    H    ASP  24           H        ASP  24   1.923  11.913 -12.273
  161    HA   ASP  24           HA       ASP  24   0.969  14.605 -12.670
  162    HB2  ASP  24           HB3      ASP  24   2.750  14.339 -14.416
  163    HB3  ASP  24           HB2      ASP  24   1.824  12.999 -15.090
  164    H    LYS  25           H        LYS  25  -0.446  12.904 -11.335
  165    HA   LYS  25           HA       LYS  25  -2.238  11.381 -13.011
  166    HB2  LYS  25           HB3      LYS  25  -1.672  10.775 -10.626
  167    HB3  LYS  25           HB2      LYS  25  -2.592  12.181 -10.111
  168    HG2  LYS  25           HG3      LYS  25  -4.616  11.257 -10.990
  169    HG3  LYS  25           HG2      LYS  25  -3.740   9.910 -11.713
  170    HD2  LYS  25           HD3      LYS  25  -3.023   9.252  -9.407
  171    HD3  LYS  25           HD2      LYS  25  -4.108  10.495  -8.782
  172    HE2  LYS  25           HE3      LYS  25  -5.230   8.349  -8.720
  173    HE3  LYS  25           HE2      LYS  25  -5.993   9.378  -9.933
  174    HZ1  LYS  25           HZ1      LYS  25  -4.723   8.216 -11.645
  175    HZ2  LYS  25           HZ2      LYS  25  -5.693   7.147 -10.769
  176    HZ3  LYS  25           HZ3      LYS  25  -4.027   7.212 -10.472
  177    H    THR  26           H        THR  26  -4.183  12.092 -13.836
  178    HA   THR  26           HA       THR  26  -4.545  14.986 -13.582
  179    HB   THR  26           HB       THR  26  -4.038  14.217 -15.836
  180    HG1  THR  26           HG1      THR  26  -6.336  15.560 -15.158
  181   HG21  THR  26          HG21      THR  26  -5.702  12.896 -17.104
  182   HG22  THR  26          HG22      THR  26  -6.587  12.620 -15.605
  183   HG23  THR  26          HG23      THR  26  -4.954  11.984 -15.796
  184    H    THR  27           H        THR  27  -6.297  11.966 -13.203
  185    HA   THR  27           HA       THR  27  -8.456  13.469 -11.957
  186    HB   THR  27           HB       THR  27 -10.053  11.766 -13.191
  187    HG1  THR  27           HG1      THR  27  -8.717  12.187 -15.497
  188   HG21  THR  27          HG21      THR  27 -10.330  14.167 -13.264
  189   HG22  THR  27          HG22      THR  27 -10.501  13.505 -14.890
  190   HG23  THR  27          HG23      THR  27  -9.006  14.314 -14.419
  191    H    ALA  28           H        ALA  28  -9.577  12.382 -10.390
  192    HA   ALA  28           HA       ALA  28  -9.138   9.533 -10.014
  193    HB1  ALA  28           HB1      ALA  28  -8.356  11.493  -7.860
  194    HB2  ALA  28           HB2      ALA  28  -7.221  10.595  -8.869
  195    HB3  ALA  28           HB3      ALA  28  -8.291   9.732  -7.760
  196    H    THR  29           H        THR  29 -10.409   8.747  -8.101
  197    HA   THR  29           HA       THR  29 -12.951  10.191  -7.999
  198    HB   THR  29           HB       THR  29 -12.388   7.357  -7.114
  199    HG1  THR  29           HG1      THR  29 -12.398   8.264  -9.567
  200   HG21  THR  29          HG21      THR  29 -14.372   8.377  -6.097
  201   HG22  THR  29          HG22      THR  29 -14.822   7.104  -7.234
  202   HG23  THR  29          HG23      THR  29 -14.979   8.801  -7.699
  203    H    ASP  30           H        ASP  30 -13.364  11.361  -6.310
  204    HA   ASP  30           HA       ASP  30 -11.849  11.354  -3.900
  205    HB2  ASP  30           HB3      ASP  30 -12.911  13.392  -4.715
  206    HB3  ASP  30           HB2      ASP  30 -14.499  12.627  -4.645
  207    H    ILE  31           H        ILE  31 -12.760  10.980  -1.753
  208    HA   ILE  31           HA       ILE  31 -13.729   8.364  -1.482
  209    HB   ILE  31           HB       ILE  31 -12.343   9.491   0.213
  210   HG12  ILE  31          HG13      ILE  31 -15.018   8.625   1.342
  211   HG13  ILE  31          HG12      ILE  31 -13.729   7.529   0.847
  212   HG21  ILE  31          HG21      ILE  31 -13.347  11.100   1.772
  213   HG22  ILE  31          HG22      ILE  31 -14.823  11.101   0.808
  214   HG23  ILE  31          HG23      ILE  31 -13.320  11.708   0.117
  215   HD11  ILE  31          HD11      ILE  31 -13.577   9.561   3.061
  216   HD12  ILE  31          HD12      ILE  31 -12.273   8.487   2.561
  217   HD13  ILE  31          HD13      ILE  31 -13.751   7.817   3.250
  218    H    LYS  32           H        LYS  32 -15.425  11.348  -1.857
  219    HA   LYS  32           HA       LYS  32 -17.911  10.330  -0.783
  220    HB2  LYS  32           HB3      LYS  32 -17.291  12.860  -2.312
  221    HB3  LYS  32           HB2      LYS  32 -18.835  12.491  -1.552
  222    HG2  LYS  32           HG3      LYS  32 -17.803  12.508   0.633
  223    HG3  LYS  32           HG2      LYS  32 -16.214  12.742  -0.092
  224    HD2  LYS  32           HD3      LYS  32 -16.942  14.889  -0.987
  225    HD3  LYS  32           HD2      LYS  32 -18.530  14.667  -0.251
  226    HE2  LYS  32           HE3      LYS  32 -17.486  14.610   1.961
  227    HE3  LYS  32           HE2      LYS  32 -15.904  14.819   1.216
  228    HZ1  LYS  32           HZ1      LYS  32 -16.769  16.903   2.083
  229    HZ2  LYS  32           HZ2      LYS  32 -18.133  16.776   1.097
  230    HZ3  LYS  32           HZ3      LYS  32 -16.605  16.982   0.403
  231    H    GLY  33           H        GLY  33 -16.224   9.861  -3.585
  232    HA2  GLY  33           HA3      GLY  33 -16.963   8.439  -5.312
  233    HA3  GLY  33           HA2      GLY  33 -18.629   8.844  -4.906
  234    H    LYS  34           H        LYS  34 -16.215  11.312  -5.286
  235    HA   LYS  34           HA       LYS  34 -17.643  12.278  -7.657
  236    HB2  LYS  34           HB3      LYS  34 -15.681  13.732  -5.884
  237    HB3  LYS  34           HB2      LYS  34 -16.649  14.444  -7.164
  238    HG2  LYS  34           HG3      LYS  34 -17.712  13.226  -4.628
  239    HG3  LYS  34           HG2      LYS  34 -17.544  14.945  -4.955
  240    HD2  LYS  34           HD3      LYS  34 -19.088  14.677  -6.880
  241    HD3  LYS  34           HD2      LYS  34 -19.332  12.996  -6.402
  242    HE2  LYS  34           HE3      LYS  34 -20.196  13.744  -4.237
  243    HE3  LYS  34           HE2      LYS  34 -19.937  15.417  -4.714
  244    HZ1  LYS  34           HZ1      LYS  34 -21.536  15.112  -6.506
  245    HZ2  LYS  34           HZ2      LYS  34 -22.238  14.770  -5.007
  246    HZ3  LYS  34           HZ3      LYS  34 -21.786  13.507  -6.034
  247    H    GLU  35           H        GLU  35 -16.450  13.064  -9.462
  248    HA   GLU  35           HA       GLU  35 -13.787  11.861  -9.748
  249    HB2  GLU  35           HB3      GLU  35 -15.427  11.239 -11.474
  250    HB3  GLU  35           HB2      GLU  35 -15.679  12.935 -11.851
  251    HG2  GLU  35           HG3      GLU  35 -13.399  13.135 -12.628
  252    HG3  GLU  35           HG2      GLU  35 -13.074  11.463 -12.178
  253    H    VAL  36           H        VAL  36 -12.125  13.181  -9.438
  254    HA   VAL  36           HA       VAL  36 -12.543  16.051  -9.947
  255    HB   VAL  36           HB       VAL  36 -11.050  16.515  -8.008
  256   HG11  VAL  36          HG11      VAL  36 -12.733  16.054  -6.277
  257   HG12  VAL  36          HG12      VAL  36 -13.565  14.972  -7.396
  258   HG13  VAL  36          HG13      VAL  36 -13.454  16.698  -7.753
  259   HG21  VAL  36          HG21      VAL  36 -11.432  13.581  -7.425
  260   HG22  VAL  36          HG22      VAL  36 -10.665  14.756  -6.357
  261   HG23  VAL  36          HG23      VAL  36  -9.919  14.351  -7.903
  262    H    THR  37           H        THR  37 -10.766  17.261 -10.582
  263    HA   THR  37           HA       THR  37  -8.748  15.826 -12.058
  264    HB   THR  37           HB       THR  37  -9.080  18.800 -11.632
  265    HG1  THR  37           HG1      THR  37  -9.834  17.369 -13.959
  266   HG21  THR  37          HG21      THR  37  -7.534  17.265 -13.724
  267   HG22  THR  37          HG22      THR  37  -6.839  18.192 -12.394
  268   HG23  THR  37          HG23      THR  37  -7.733  19.016 -13.671
  269    H    VAL  38           H        VAL  38  -6.853  15.249 -11.237
  270    HA   VAL  38           HA       VAL  38  -6.174  16.106  -8.557
  271    HB   VAL  38           HB       VAL  38  -4.815  14.069 -10.326
  272   HG11  VAL  38          HG11      VAL  38  -4.559  14.572  -7.365
  273   HG12  VAL  38          HG12      VAL  38  -3.340  14.936  -8.588
  274   HG13  VAL  38          HG13      VAL  38  -3.792  13.262  -8.260
  275   HG21  VAL  38          HG21      VAL  38  -7.117  13.447  -9.827
  276   HG22  VAL  38          HG22      VAL  38  -6.816  13.685  -8.107
  277   HG23  VAL  38          HG23      VAL  38  -5.982  12.399  -8.977
  278    H    LEU  39           H        LEU  39  -4.524  17.409  -8.012
  279    HA   LEU  39           HA       LEU  39  -2.780  18.367 -10.177
  280    HB2  LEU  39           HB3      LEU  39  -3.342  19.658  -7.498
  281    HB3  LEU  39           HB2      LEU  39  -2.406  20.349  -8.812
  282    HG   LEU  39           HG       LEU  39  -5.358  19.737  -8.951
  283   HD11  LEU  39          HD11      LEU  39  -4.909  21.513  -7.352
  284   HD12  LEU  39          HD12      LEU  39  -5.676  22.151  -8.808
  285   HD13  LEU  39          HD13      LEU  39  -3.943  22.365  -8.557
  286   HD21  LEU  39          HD21      LEU  39  -3.531  21.234 -10.821
  287   HD22  LEU  39          HD22      LEU  39  -5.282  21.101 -10.983
  288   HD23  LEU  39          HD23      LEU  39  -4.273  19.663 -11.119
  289    H    ALA  40           H        ALA  40  -0.970  17.201 -10.182
  290    HA   ALA  40           HA       ALA  40   0.081  15.848  -7.922
  291    HB1  ALA  40           HB1      ALA  40   1.983  15.333  -9.343
  292    HB2  ALA  40           HB2      ALA  40   1.456  16.544 -10.512
  293    HB3  ALA  40           HB3      ALA  40   0.476  15.107 -10.230
  294    H    GLU  41           H        GLU  41   0.499  18.982  -9.273
  295    HA   GLU  41           HA       GLU  41   2.511  19.626  -7.240
  296    HB2  GLU  41           HB3      GLU  41   1.641  21.296  -9.608
  297    HB3  GLU  41           HB2      GLU  41   3.012  21.598  -8.550
  298    HG2  GLU  41           HG3      GLU  41   4.044  19.505  -9.361
  299    HG3  GLU  41           HG2      GLU  41   2.700  19.312 -10.479
  300    H    VAL  42           H        VAL  42   1.667  20.462  -5.442
  301    HA   VAL  42           HA       VAL  42  -1.038  21.529  -5.549
  302    HB   VAL  42           HB       VAL  42  -1.075  21.385  -3.130
  303   HG11  VAL  42          HG11      VAL  42  -0.783  18.974  -2.843
  304   HG12  VAL  42          HG12      VAL  42   0.121  18.907  -4.358
  305   HG13  VAL  42          HG13      VAL  42  -1.582  19.363  -4.368
  306   HG21  VAL  42          HG21      VAL  42   1.217  22.040  -2.625
  307   HG22  VAL  42          HG22      VAL  42   1.809  20.517  -3.289
  308   HG23  VAL  42          HG23      VAL  42   0.810  20.516  -1.836
  309    H    ASN  43           H        ASN  43  -1.444  23.608  -5.626
  310    HA   ASN  43           HA       ASN  43   0.715  25.482  -5.067
  311    HB2  ASN  43           HB3      ASN  43  -0.682  27.179  -6.161
  312    HB3  ASN  43           HB2      ASN  43  -0.470  25.778  -7.199
  313   HD21  ASN  43          HD21      ASN  43  -2.251  24.444  -7.624
  314   HD22  ASN  43          HD22      ASN  43  -3.870  24.982  -7.344
  315    H    ILE  44           H        ILE  44   0.907  25.970  -3.008
  316    HA   ILE  44           HA       ILE  44  -1.536  26.477  -1.456
  317    HB   ILE  44           HB       ILE  44   1.296  26.134  -0.442
  318   HG12  ILE  44          HG13      ILE  44  -1.026  24.189  -0.381
  319   HG13  ILE  44          HG12      ILE  44   0.376  24.060  -1.439
  320   HG21  ILE  44          HG21      ILE  44  -0.120  27.511   1.005
  321   HG22  ILE  44          HG22      ILE  44   0.266  25.965   1.760
  322   HG23  ILE  44          HG23      ILE  44  -1.325  26.223   1.046
  323   HD11  ILE  44          HD11      ILE  44   1.815  23.830   0.543
  324   HD12  ILE  44          HD12      ILE  44   0.601  22.556   0.430
  325   HD13  ILE  44          HD13      ILE  44   0.380  23.886   1.567
  326    H    ASN  45           H        ASN  45  -1.791  28.441  -2.657
  327    HA   ASN  45           HA       ASN  45  -1.818  30.690  -2.822
  328    HB2  ASN  45           HB3      ASN  45  -0.344  30.457  -0.202
  329    HB3  ASN  45           HB2      ASN  45  -0.659  32.021  -0.943
  330   HD21  ASN  45          HD21      ASN  45  -2.885  29.302  -1.140
  331   HD22  ASN  45          HD22      ASN  45  -4.108  30.006  -0.140
  332    H    ASN  46           H        ASN  46   1.421  30.518  -1.372
  333    HA   ASN  46           HA       ASN  46   2.503  31.379  -3.975
  334    HB2  ASN  46           HB3      ASN  46   3.209  32.445  -1.235
  335    HB3  ASN  46           HB2      ASN  46   4.155  32.771  -2.678
  336   HD21  ASN  46          HD21      ASN  46   1.746  32.943  -4.374
  337   HD22  ASN  46          HD22      ASN  46   1.035  34.473  -4.002
  338    H    SER  47           H        SER  47   2.383  28.712  -2.729
  339    HA   SER  47           HA       SER  47   5.216  28.108  -3.021
  340    HB2  SER  47           HB3      SER  47   3.614  27.119  -0.645
  341    HB3  SER  47           HB2      SER  47   5.298  26.733  -1.003
  342    HG   SER  47           HG       SER  47   5.245  29.313  -1.011
  343    H    VAL  48           H        VAL  48   5.276  26.651  -4.590
  344    HA   VAL  48           HA       VAL  48   3.043  24.769  -4.884
  345    HB   VAL  48           HB       VAL  48   5.242  25.436  -6.852
  346   HG11  VAL  48          HG11      VAL  48   3.857  24.239  -8.478
  347   HG12  VAL  48          HG12      VAL  48   2.723  23.814  -7.197
  348   HG13  VAL  48          HG13      VAL  48   4.370  23.185  -7.161
  349   HG21  VAL  48          HG21      VAL  48   3.764  27.338  -6.492
  350   HG22  VAL  48          HG22      VAL  48   2.358  26.317  -6.793
  351   HG23  VAL  48          HG23      VAL  48   3.506  26.642  -8.090
  352    H    PHE  49           H        PHE  49   3.293  22.769  -4.213
  353    HA   PHE  49           HA       PHE  49   6.012  21.623  -4.100
  354    HB2  PHE  49           HB3      PHE  49   3.692  21.268  -2.192
  355    HB3  PHE  49           HB2      PHE  49   5.053  20.153  -2.235
  356    HD1  PHE  49           HD1      PHE  49   3.941  23.516  -1.323
  357    HD2  PHE  49           HD2      PHE  49   7.227  20.814  -1.436
  358    HE1  PHE  49           HE1      PHE  49   5.187  24.965   0.235
  359    HE2  PHE  49           HE2      PHE  49   8.476  22.258   0.113
  360    HZ   PHE  49           HZ       PHE  49   7.457  24.334   0.949
  361    H    ARG  50           H        ARG  50   6.301  19.837  -5.306
  362    HA   ARG  50           HA       ARG  50   3.893  18.561  -6.398
  363    HB2  ARG  50           HB3      ARG  50   5.297  17.719  -8.211
  364    HB3  ARG  50           HB2      ARG  50   5.424  19.466  -8.083
  365    HG2  ARG  50           HG3      ARG  50   7.585  19.314  -7.109
  366    HG3  ARG  50           HG2      ARG  50   7.438  17.564  -6.922
  367    HD2  ARG  50           HD3      ARG  50   8.849  18.245  -8.850
  368    HD3  ARG  50           HD2      ARG  50   7.465  17.248  -9.297
  369    HE   ARG  50           HE       ARG  50   6.600  19.835  -9.585
  370   HH11  ARG  50          HH11      ARG  50   9.224  17.928 -10.899
  371   HH12  ARG  50          HH12      ARG  50   9.254  18.782 -12.409
  372   HH21  ARG  50          HH21      ARG  50   6.608  20.939 -11.566
  373   HH22  ARG  50          HH22      ARG  50   7.766  20.498 -12.793
  374    H    GLN  51           H        GLN  51   3.537  16.407  -6.239
  375    HA   GLN  51           HA       GLN  51   5.550  14.785  -4.839
  376    HB2  GLN  51           HB3      GLN  51   2.582  14.724  -4.224
  377    HB3  GLN  51           HB2      GLN  51   3.813  13.704  -3.495
  378    HG2  GLN  51           HG3      GLN  51   3.616  15.244  -1.855
  379    HG3  GLN  51           HG2      GLN  51   4.837  16.055  -2.836
  380   HE21  GLN  51          HE21      GLN  51   4.283  18.094  -2.159
  381   HE22  GLN  51          HE22      GLN  51   2.807  18.868  -2.635
  382    H    TYR  52           H        TYR  52   4.782  12.380  -4.942
  383    HA   TYR  52           HA       TYR  52   3.701  11.878  -7.636
  384    HB2  TYR  52           HB3      TYR  52   5.701  10.085  -6.248
  385    HB3  TYR  52           HB2      TYR  52   5.243  10.090  -7.948
  386    HD1  TYR  52           HD1      TYR  52   5.739  12.453  -9.155
  387    HD2  TYR  52           HD2      TYR  52   7.737  10.980  -5.698
  388    HE1  TYR  52           HE1      TYR  52   7.650  13.915  -9.643
  389    HE2  TYR  52           HE2      TYR  52   9.654  12.439  -6.179
  390    HH   TYR  52           HH       TYR  52  10.659  13.570  -8.130
  391    H    PHE  53           H        PHE  53   2.124  10.346  -7.784
  392    HA   PHE  53           HA       PHE  53   1.051   9.411  -5.231
  393    HB2  PHE  53           HB3      PHE  53  -0.212   9.377  -7.987
  394    HB3  PHE  53           HB2      PHE  53  -1.026   9.002  -6.469
  395    HD1  PHE  53           HD1      PHE  53  -1.227  10.824  -4.736
  396    HD2  PHE  53           HD2      PHE  53  -0.049  11.575  -8.754
  397    HE1  PHE  53           HE1      PHE  53  -1.781  13.203  -4.449
  398    HE2  PHE  53           HE2      PHE  53  -0.604  13.953  -8.478
  399    HZ   PHE  53           HZ       PHE  53  -1.467  14.772  -6.323
  400    H    PHE  54           H        PHE  54   1.322   7.395  -4.585
  401    HA   PHE  54           HA       PHE  54   2.596   5.508  -6.353
  402    HB2  PHE  54           HB3      PHE  54   2.624   4.069  -4.242
  403    HB3  PHE  54           HB2      PHE  54   3.544   5.566  -4.187
  404    HD1  PHE  54           HD1      PHE  54   0.798   3.681  -2.770
  405    HD2  PHE  54           HD2      PHE  54   2.664   7.506  -2.920
  406    HE1  PHE  54           HE1      PHE  54  -0.393   4.340  -0.723
  407    HE2  PHE  54           HE2      PHE  54   1.473   8.170  -0.874
  408    HZ   PHE  54           HZ       PHE  54  -0.055   6.587   0.227
  409    H    GLU  55           H        GLU  55   1.335   4.491  -7.735
  410    HA   GLU  55           HA       GLU  55  -1.151   3.281  -6.712
  411    HB2  GLU  55           HB3      GLU  55  -0.498   3.933  -9.599
  412    HB3  GLU  55           HB2      GLU  55  -2.023   3.316  -8.979
  413    HG2  GLU  55           HG3      GLU  55  -2.084   5.485  -7.580
  414    HG3  GLU  55           HG2      GLU  55  -0.846   6.059  -8.701
  415    H    THR  56           H        THR  56  -0.833   1.223  -6.283
  416    HA   THR  56           HA       THR  56   0.992  -0.310  -8.001
  417    HB   THR  56           HB       THR  56  -0.070  -1.109  -5.284
  418    HG1  THR  56           HG1      THR  56   1.364   0.265  -4.565
  419   HG21  THR  56          HG21      THR  56   0.644  -2.985  -6.695
  420   HG22  THR  56          HG22      THR  56   1.751  -2.752  -5.341
  421   HG23  THR  56          HG23      THR  56   2.203  -2.201  -6.954
  422    H    LYS  57           H        LYS  57  -0.092  -1.183  -9.614
  423    HA   LYS  57           HA       LYS  57  -2.828  -2.159  -9.151
  424    HB2  LYS  57           HB3      LYS  57  -1.403  -1.627 -11.771
  425    HB3  LYS  57           HB2      LYS  57  -3.101  -2.038 -11.576
  426    HG2  LYS  57           HG3      LYS  57  -3.447   0.071 -10.357
  427    HG3  LYS  57           HG2      LYS  57  -1.758   0.490 -10.633
  428    HD2  LYS  57           HD3      LYS  57  -3.001   1.607 -12.307
  429    HD3  LYS  57           HD2      LYS  57  -2.241   0.230 -13.100
  430    HE2  LYS  57           HE3      LYS  57  -4.489   0.344 -13.860
  431    HE3  LYS  57           HE2      LYS  57  -4.368  -1.029 -12.768
  432    HZ1  LYS  57           HZ1      LYS  57  -5.243   0.486 -10.993
  433    HZ2  LYS  57           HZ2      LYS  57  -6.342   0.121 -12.224
  434    HZ3  LYS  57           HZ3      LYS  57  -5.566   1.623 -12.207
  435    H    CYS  58           H        CYS  58  -3.357  -4.146 -10.577
  436    HA   CYS  58           HA       CYS  58  -1.147  -6.043 -10.205
  437    HB2  CYS  58           HB3      CYS  58  -3.511  -6.231  -9.021
  438    HB3  CYS  58           HB2      CYS  58  -3.956  -6.979 -10.548
  439    H    ARG  59           H        ARG  59  -0.143  -6.520 -12.008
  440    HA   ARG  59           HA       ARG  59  -1.207  -6.035 -14.596
  441    HB2  ARG  59           HB3      ARG  59   1.248  -7.495 -13.627
  442    HB3  ARG  59           HB2      ARG  59   0.859  -7.337 -15.333
  443    HG2  ARG  59           HG3      ARG  59   1.005  -4.922 -15.168
  444    HG3  ARG  59           HG2      ARG  59   1.311  -5.044 -13.437
  445    HD2  ARG  59           HD3      ARG  59   3.384  -6.207 -13.841
  446    HD3  ARG  59           HD2      ARG  59   3.068  -6.241 -15.573
  447    HE   ARG  59           HE       ARG  59   3.081  -3.648 -15.210
  448   HH11  ARG  59          HH11      ARG  59   5.195  -6.023 -13.736
  449   HH12  ARG  59          HH12      ARG  59   6.554  -4.949 -13.651
  450   HH21  ARG  59          HH21      ARG  59   4.880  -2.233 -15.104
  451   HH22  ARG  59          HH22      ARG  59   6.374  -2.792 -14.422
  452    H    ALA  60           H        ALA  60  -0.817  -8.892 -12.587
  453    HA   ALA  60           HA       ALA  60  -2.428 -10.393 -14.544
  454    HB1  ALA  60           HB1      ALA  60  -0.110 -11.227 -14.438
  455    HB2  ALA  60           HB2      ALA  60  -1.281 -12.426 -13.887
  456    HB3  ALA  60           HB3      ALA  60  -0.316 -11.532 -12.714
  457    H    SER  61           H        SER  61  -4.417 -10.365 -13.725
  458    HA   SER  61           HA       SER  61  -4.999 -10.398 -10.941
  459    HB2  SER  61           HB3      SER  61  -7.366 -10.880 -11.843
  460    HB3  SER  61           HB2      SER  61  -6.616  -9.349 -12.295
  461    HG   SER  61           HG       SER  61  -7.592 -11.101 -13.926
  462    H    ASN  62           H        ASN  62  -4.596 -12.780 -13.420
  463    HA   ASN  62           HA       ASN  62  -4.750 -14.897 -11.394
  464    HB2  ASN  62           HB3      ASN  62  -6.129 -14.947 -14.091
  465    HB3  ASN  62           HB2      ASN  62  -5.803 -16.400 -13.158
  466   HD21  ASN  62          HD21      ASN  62  -6.371 -15.276 -10.582
  467   HD22  ASN  62          HD22      ASN  62  -8.080 -15.037 -10.509
  468    HA   PRO  63           HA       PRO  63  -0.797 -14.859 -13.934
  469    HB2  PRO  63           HB3      PRO  63   0.634 -15.895 -11.772
  470    HB3  PRO  63           HB2      PRO  63   0.564 -14.191 -12.240
  471    HG2  PRO  63           HG3      PRO  63  -0.956 -15.652 -10.129
  472    HG3  PRO  63           HG2      PRO  63  -0.327 -13.996 -10.121
  473    HD2  PRO  63           HD3      PRO  63  -2.945 -14.502 -10.500
  474    HD3  PRO  63           HD2      PRO  63  -2.124 -13.167 -11.351
  475    H    VAL  64           H        VAL  64  -2.117 -17.252 -11.688
  476    HA   VAL  64           HA       VAL  64  -1.292 -19.357 -13.578
  477    HB   VAL  64           HB       VAL  64  -1.322 -20.948 -11.691
  478   HG11  VAL  64          HG11      VAL  64   0.476 -18.573 -11.242
  479   HG12  VAL  64          HG12      VAL  64   0.790 -19.931 -12.323
  480   HG13  VAL  64          HG13      VAL  64   0.724 -20.188 -10.579
  481   HG21  VAL  64          HG21      VAL  64  -1.747 -18.513  -9.969
  482   HG22  VAL  64          HG22      VAL  64  -1.412 -20.143  -9.387
  483   HG23  VAL  64          HG23      VAL  64  -2.912 -19.806 -10.246
  484    H    GLU  65           H        GLU  65  -2.810 -21.248 -13.598
  485    HA   GLU  65           HA       GLU  65  -5.488 -20.274 -13.980
  486    HB2  GLU  65           HB3      GLU  65  -4.348 -23.063 -14.238
  487    HB3  GLU  65           HB2      GLU  65  -5.966 -22.586 -14.733
  488    HG2  GLU  65           HG3      GLU  65  -5.017 -21.045 -16.363
  489    HG3  GLU  65           HG2      GLU  65  -3.393 -21.513 -15.862
  490    H    SER  66           H        SER  66  -5.083 -19.849 -11.450
  491    HA   SER  66           HA       SER  66  -7.036 -21.447 -10.091
  492    HB2  SER  66           HB3      SER  66  -4.213 -21.407  -8.969
  493    HB3  SER  66           HB2      SER  66  -5.623 -22.162  -8.226
  494    HG   SER  66           HG       SER  66  -5.396 -23.113 -10.691
  495    H    GLY  67           H        GLY  67  -4.781 -18.845 -10.317
  496    HA2  GLY  67           HA3      GLY  67  -5.957 -16.691  -9.544
  497    HA3  GLY  67           HA2      GLY  67  -5.912 -17.492  -7.976
  498    H    CYS  68           H        CYS  68  -4.225 -16.948  -6.724
  499    HA   CYS  68           HA       CYS  68  -1.867 -15.795  -7.994
  500    HB2  CYS  68           HB3      CYS  68  -1.217 -15.015  -5.848
  501    HB3  CYS  68           HB2      CYS  68  -2.965 -14.788  -5.921
  502    H    ARG  69           H        ARG  69   0.257 -16.615  -7.594
  503    HA   ARG  69           HA       ARG  69   0.352 -19.411  -8.034
  504    HB2  ARG  69           HB3      ARG  69   1.954 -17.836  -9.038
  505    HB3  ARG  69           HB2      ARG  69   2.606 -17.479  -7.441
  506    HG2  ARG  69           HG3      ARG  69   3.173 -19.946  -7.284
  507    HG3  ARG  69           HG2      ARG  69   2.803 -20.031  -9.008
  508    HD2  ARG  69           HD3      ARG  69   5.188 -19.715  -8.686
  509    HD3  ARG  69           HD2      ARG  69   4.474 -18.282  -9.436
  510    HE   ARG  69           HE       ARG  69   4.899 -18.348  -6.531
  511   HH11  ARG  69          HH11      ARG  69   5.643 -16.983  -9.662
  512   HH12  ARG  69          HH12      ARG  69   6.464 -15.602  -9.009
  513   HH21  ARG  69          HH21      ARG  69   5.978 -16.522  -5.668
  514   HH22  ARG  69          HH22      ARG  69   6.657 -15.341  -6.740
  515    H    GLY  70           H        GLY  70   0.215 -20.969  -6.549
  516    HA2  GLY  70           HA3      GLY  70   1.707 -21.908  -4.725
  517    HA3  GLY  70           HA2      GLY  70   1.328 -20.423  -3.867
  518    H    ILE  71           H        ILE  71  -1.446 -20.486  -4.920
  519    HA   ILE  71           HA       ILE  71  -2.607 -21.804  -2.688
  520    HB   ILE  71           HB       ILE  71  -3.917 -20.600  -5.129
  521   HG12  ILE  71          HG13      ILE  71  -2.594 -18.955  -3.952
  522   HG13  ILE  71          HG12      ILE  71  -4.298 -18.651  -3.642
  523   HG21  ILE  71          HG21      ILE  71  -5.431 -22.114  -3.998
  524   HG22  ILE  71          HG22      ILE  71  -5.930 -20.442  -3.739
  525   HG23  ILE  71          HG23      ILE  71  -5.102 -21.324  -2.454
  526   HD11  ILE  71          HD11      ILE  71  -2.334 -19.957  -1.772
  527   HD12  ILE  71          HD12      ILE  71  -4.059 -19.770  -1.454
  528   HD13  ILE  71          HD13      ILE  71  -3.033 -18.344  -1.622
  529    H    ASP  72           H        ASP  72  -3.805 -23.659  -2.558
  530    HA   ASP  72           HA       ASP  72  -3.420 -25.671  -4.552
  531    HB2  ASP  72           HB3      ASP  72  -3.521 -26.263  -2.169
  532    HB3  ASP  72           HB2      ASP  72  -5.187 -25.695  -2.092
  533    H    SER  73           H        SER  73  -4.629 -26.069  -6.247
  534    HA   SER  73           HA       SER  73  -6.747 -24.336  -6.952
  535    HB2  SER  73           HB3      SER  73  -6.026 -26.905  -8.356
  536    HB3  SER  73           HB2      SER  73  -6.671 -25.419  -9.059
  537    HG   SER  73           HG       SER  73  -4.736 -24.507  -8.989
  538    H    LYS  74           H        LYS  74  -6.723 -27.336  -5.284
  539    HA   LYS  74           HA       LYS  74  -9.355 -28.118  -6.236
  540    HB2  LYS  74           HB3      LYS  74  -7.614 -29.830  -5.949
  541    HB3  LYS  74           HB2      LYS  74  -7.518 -29.444  -4.239
  542    HG2  LYS  74           HG3      LYS  74  -9.802 -30.200  -3.915
  543    HG3  LYS  74           HG2      LYS  74  -9.948 -30.538  -5.642
  544    HD2  LYS  74           HD3      LYS  74  -9.497 -32.577  -4.385
  545    HD3  LYS  74           HD2      LYS  74  -8.159 -32.193  -5.463
  546    HE2  LYS  74           HE3      LYS  74  -6.899 -31.269  -3.620
  547    HE3  LYS  74           HE2      LYS  74  -8.250 -31.542  -2.524
  548    HZ1  LYS  74           HZ1      LYS  74  -6.567 -33.258  -2.314
  549    HZ2  LYS  74           HZ2      LYS  74  -6.726 -33.652  -3.949
  550    HZ3  LYS  74           HZ3      LYS  74  -8.014 -33.917  -2.887
  551    H    HIS  75           H        HIS  75  -7.807 -27.062  -3.230
  552    HA   HIS  75           HA       HIS  75 -10.348 -27.240  -1.811
  553    HB2  HIS  75           HB3      HIS  75  -7.576 -26.461  -0.889
  554    HB3  HIS  75           HB2      HIS  75  -8.989 -26.456   0.158
  555    HD1  HIS  75           HD1      HIS  75 -10.014 -28.782   0.778
  556    HD2  HIS  75           HD2      HIS  75  -6.468 -28.950  -1.386
  557    HE1  HIS  75           HE1      HIS  75  -9.183 -31.145   1.027
  558    HE2  HIS  75           HE2      HIS  75  -6.944 -31.165  -0.131
  559    H    TRP  76           H        TRP  76  -8.388 -24.818  -3.343
  560    HA   TRP  76           HA       TRP  76 -10.222 -22.765  -2.318
  561    HB2  TRP  76           HB3      TRP  76  -7.208 -22.537  -2.501
  562    HB3  TRP  76           HB2      TRP  76  -8.289 -21.182  -2.187
  563    HD1  TRP  76           HD1      TRP  76  -6.405 -23.905  -0.476
  564    HE1  TRP  76           HE1      TRP  76  -6.913 -23.877   2.046
  565    HE3  TRP  76           HE3      TRP  76 -10.396 -20.704  -0.481
  566    HZ2  TRP  76           HZ2      TRP  76  -8.752 -22.662   3.797
  567    HZ3  TRP  76           HZ3      TRP  76 -11.470 -20.161   1.665
  568    HH2  TRP  76           HH2      TRP  76 -10.664 -21.124   3.758
  569    H    ASN  77           H        ASN  77 -10.563 -21.000  -3.662
  570    HA   ASN  77           HA       ASN  77  -9.249 -21.061  -6.296
  571    HB2  ASN  77           HB3      ASN  77 -11.699 -21.522  -6.461
  572    HB3  ASN  77           HB2      ASN  77 -12.013 -19.981  -5.675
  573   HD21  ASN  77          HD21      ASN  77  -9.543 -20.669  -8.110
  574   HD22  ASN  77          HD22      ASN  77 -10.202 -19.616  -9.316
  575    H    SER  78           H        SER  78  -8.298 -19.164  -6.929
  576    HA   SER  78           HA       SER  78  -8.268 -17.083  -4.854
  577    HB2  SER  78           HB3      SER  78  -6.249 -18.298  -4.607
  578    HB3  SER  78           HB2      SER  78  -5.985 -18.376  -6.344
  579    HG   SER  78           HG       SER  78  -5.237 -16.480  -4.571
  580    H    TYR  79           H        TYR  79  -7.614 -14.977  -5.537
  581    HA   TYR  79           HA       TYR  79  -7.498 -14.369  -8.351
  582    HB2  TYR  79           HB3      TYR  79  -9.950 -14.476  -7.917
  583    HB3  TYR  79           HB2      TYR  79  -9.759 -13.252  -6.664
  584    HD1  TYR  79           HD1      TYR  79  -9.645 -10.942  -7.223
  585    HD2  TYR  79           HD2      TYR  79  -9.521 -13.872 -10.301
  586    HE1  TYR  79           HE1      TYR  79  -9.959  -9.179  -8.905
  587    HE2  TYR  79           HE2      TYR  79  -9.834 -12.117 -11.991
  588    HH   TYR  79           HH       TYR  79  -9.523  -8.803 -11.273
  589    H    CYS  80           H        CYS  80  -6.309 -12.552  -8.679
  590    HA   CYS  80           HA       CYS  80  -5.232 -11.271  -6.299
  591    HB2  CYS  80           HB3      CYS  80  -4.437 -10.982  -9.207
  592    HB3  CYS  80           HB2      CYS  80  -3.550 -10.344  -7.821
  593    H    THR  81           H        THR  81  -6.203  -9.535  -5.528
  594    HA   THR  81           HA       THR  81  -7.777  -7.859  -7.380
  595    HB   THR  81           HB       THR  81  -8.279  -8.279  -4.423
  596    HG1  THR  81           HG1      THR  81  -8.755 -10.199  -5.431
  597   HG21  THR  81          HG21      THR  81  -9.992  -7.030  -6.579
  598   HG22  THR  81          HG22      THR  81  -9.147  -6.159  -5.298
  599   HG23  THR  81          HG23      THR  81 -10.460  -7.265  -4.896
  600    H    THR  82           H        THR  82  -7.362  -5.709  -7.438
  601    HA   THR  82           HA       THR  82  -5.196  -4.650  -5.876
  602    HB   THR  82           HB       THR  82  -6.120  -2.478  -7.126
  603    HG1  THR  82           HG1      THR  82  -6.841  -3.396  -9.269
  604   HG21  THR  82          HG21      THR  82  -4.570  -4.716  -8.418
  605   HG22  THR  82          HG22      THR  82  -3.905  -3.417  -7.430
  606   HG23  THR  82          HG23      THR  82  -4.627  -3.055  -8.999
  607    H    THR  83           H        THR  83  -5.400  -3.790  -3.938
  608    HA   THR  83           HA       THR  83  -7.941  -2.948  -2.885
  609    HB   THR  83           HB       THR  83  -6.445  -2.118  -0.961
  610    HG1  THR  83           HG1      THR  83  -4.462  -3.799  -2.032
  611   HG21  THR  83          HG21      THR  83  -6.088  -4.393  -0.111
  612   HG22  THR  83          HG22      THR  83  -6.368  -5.040  -1.726
  613   HG23  THR  83          HG23      THR  83  -7.674  -4.228  -0.862
  614    H    HIS  84           H        HIS  84  -8.338  -0.738  -2.116
  615    HA   HIS  84           HA       HIS  84  -6.753   1.280  -3.533
  616    HB2  HIS  84           HB3      HIS  84  -8.899   2.545  -3.993
  617    HB3  HIS  84           HB2      HIS  84  -8.666   1.083  -4.939
  618    HD1  HIS  84           HD1      HIS  84 -10.548  -0.530  -4.953
  619    HD2  HIS  84           HD2      HIS  84 -10.807   2.140  -1.771
  620    HE1  HIS  84           HE1      HIS  84 -12.773  -0.972  -3.875
  621    HE2  HIS  84           HE2      HIS  84 -12.978   0.767  -2.066
  622    H    THR  85           H        THR  85  -6.277   3.064  -2.413
  623    HA   THR  85           HA       THR  85  -7.528   3.343   0.244
  624    HB   THR  85           HB       THR  85  -5.158   2.502   0.344
  625    HG1  THR  85           HG1      THR  85  -4.722   3.795   2.067
  626   HG21  THR  85          HG21      THR  85  -3.340   4.071  -0.146
  627   HG22  THR  85          HG22      THR  85  -4.507   5.238  -0.765
  628   HG23  THR  85          HG23      THR  85  -4.268   3.702  -1.599
  629    H    PHE  86           H        PHE  86  -7.105   5.658   1.117
  630    HA   PHE  86           HA       PHE  86  -7.733   7.497  -1.095
  631    HB2  PHE  86           HB3      PHE  86  -8.816   7.531   1.737
  632    HB3  PHE  86           HB2      PHE  86  -9.173   8.732   0.495
  633    HD1  PHE  86           HD1      PHE  86 -10.482   8.078  -1.510
  634    HD2  PHE  86           HD2      PHE  86  -9.948   5.455   1.799
  635    HE1  PHE  86           HE1      PHE  86 -12.374   6.716  -2.292
  636    HE2  PHE  86           HE2      PHE  86 -11.839   4.086   1.023
  637    HZ   PHE  86           HZ       PHE  86 -13.054   4.714  -1.024
  638    H    VAL  87           H        VAL  87  -6.263   8.992  -1.403
  639    HA   VAL  87           HA       VAL  87  -4.569   9.802   0.872
  640    HB   VAL  87           HB       VAL  87  -2.895  10.498  -0.855
  641   HG11  VAL  87          HG11      VAL  87  -2.647   8.380   0.294
  642   HG12  VAL  87          HG12      VAL  87  -2.141   8.220  -1.387
  643   HG13  VAL  87          HG13      VAL  87  -3.710   7.597  -0.875
  644   HG21  VAL  87          HG21      VAL  87  -4.416  10.756  -2.751
  645   HG22  VAL  87          HG22      VAL  87  -4.713   9.017  -2.751
  646   HG23  VAL  87          HG23      VAL  87  -3.106   9.636  -3.127
  647    H    LYS  88           H        LYS  88  -4.183  11.976   1.241
  648    HA   LYS  88           HA       LYS  88  -6.162  13.785   0.211
  649    HB2  LYS  88           HB3      LYS  88  -5.105  15.478   1.682
  650    HB3  LYS  88           HB2      LYS  88  -5.565  14.018   2.539
  651    HG2  LYS  88           HG3      LYS  88  -3.394  13.433   2.975
  652    HG3  LYS  88           HG2      LYS  88  -2.769  14.259   1.548
  653    HD2  LYS  88           HD3      LYS  88  -3.098  16.402   2.576
  654    HD3  LYS  88           HD2      LYS  88  -3.896  15.666   3.964
  655    HE2  LYS  88           HE3      LYS  88  -1.049  15.084   3.182
  656    HE3  LYS  88           HE2      LYS  88  -1.501  16.357   4.310
  657    HZ1  LYS  88           HZ1      LYS  88  -2.443  14.748   5.784
  658    HZ2  LYS  88           HZ2      LYS  88  -0.865  14.257   5.402
  659    HZ3  LYS  88           HZ3      LYS  88  -2.185  13.494   4.673
  660    H    ALA  89           H        ALA  89  -5.980  14.641  -1.696
  661    HA   ALA  89           HA       ALA  89  -3.372  15.748  -2.512
  662    HB1  ALA  89           HB1      ALA  89  -3.821  13.697  -3.787
  663    HB2  ALA  89           HB2      ALA  89  -3.841  15.125  -4.822
  664    HB3  ALA  89           HB3      ALA  89  -5.358  14.373  -4.327
  665    H    LEU  90           H        LEU  90  -3.477  17.706  -3.665
  666    HA   LEU  90           HA       LEU  90  -5.860  19.259  -3.276
  667    HB2  LEU  90           HB3      LEU  90  -3.497  20.184  -3.217
  668    HB3  LEU  90           HB2      LEU  90  -3.446  19.957  -4.959
  669    HG   LEU  90           HG       LEU  90  -5.493  21.482  -5.070
  670   HD11  LEU  90          HD11      LEU  90  -4.603  22.064  -2.252
  671   HD12  LEU  90          HD12      LEU  90  -6.158  21.399  -2.753
  672   HD13  LEU  90          HD13      LEU  90  -5.725  23.052  -3.188
  673   HD21  LEU  90          HD21      LEU  90  -2.866  22.601  -4.101
  674   HD22  LEU  90          HD22      LEU  90  -4.119  23.501  -4.959
  675   HD23  LEU  90          HD23      LEU  90  -3.269  22.182  -5.768
  676    H    THR  91           H        THR  91  -7.571  18.875  -4.526
  677    HA   THR  91           HA       THR  91  -7.102  18.307  -7.378
  678    HB   THR  91           HB       THR  91  -8.977  16.753  -7.371
  679    HG1  THR  91           HG1      THR  91  -9.120  17.396  -4.599
  680   HG21  THR  91          HG21      THR  91  -6.768  15.821  -6.837
  681   HG22  THR  91          HG22      THR  91  -8.050  14.949  -6.001
  682   HG23  THR  91          HG23      THR  91  -7.059  16.115  -5.124
  683    H    THR  92           H        THR  92  -8.905  18.904  -8.780
  684    HA   THR  92           HA       THR  92 -10.675  20.898  -7.548
  685    HB   THR  92           HB       THR  92  -8.967  22.095  -8.809
  686    HG1  THR  92           HG1      THR  92 -11.042  22.982  -8.859
  687   HG21  THR  92          HG21      THR  92  -8.738  21.861 -11.224
  688   HG22  THR  92          HG22      THR  92  -9.915  20.547 -11.219
  689   HG23  THR  92          HG23      THR  92  -8.360  20.341 -10.412
  690    H    ASP  93           H        ASP  93 -12.753  20.524  -7.839
  691    HA   ASP  93           HA       ASP  93 -13.598  18.337  -9.498
  692    HB2  ASP  93           HB3      ASP  93 -15.869  18.846  -8.610
  693    HB3  ASP  93           HB2      ASP  93 -14.669  18.605  -7.348
  694    H    GLU  94           H        GLU  94 -13.307  21.732  -9.863
  695    HA   GLU  94           HA       GLU  94 -13.910  21.481 -12.618
  696    HB2  GLU  94           HB3      GLU  94 -15.717  23.200 -12.718
  697    HB3  GLU  94           HB2      GLU  94 -16.201  21.673 -12.004
  698    HG2  GLU  94           HG3      GLU  94 -16.016  22.658  -9.779
  699    HG3  GLU  94           HG2      GLU  94 -15.544  24.193 -10.502
  700    H    LYS  95           H        LYS  95 -13.757  24.033 -10.089
  701    HA   LYS  95           HA       LYS  95 -11.746  25.352 -11.789
  702    HB2  LYS  95           HB3      LYS  95 -13.989  26.692 -10.277
  703    HB3  LYS  95           HB2      LYS  95 -12.684  27.539 -11.085
  704    HG2  LYS  95           HG3      LYS  95 -13.418  26.541 -13.227
  705    HG3  LYS  95           HG2      LYS  95 -14.780  25.812 -12.376
  706    HD2  LYS  95           HD3      LYS  95 -15.507  28.068 -11.691
  707    HD3  LYS  95           HD2      LYS  95 -14.199  28.756 -12.655
  708    HE2  LYS  95           HE3      LYS  95 -15.153  27.692 -14.658
  709    HE3  LYS  95           HE2      LYS  95 -16.475  27.063 -13.674
  710    HZ1  LYS  95           HZ1      LYS  95 -17.120  29.340 -13.163
  711    HZ2  LYS  95           HZ2      LYS  95 -17.130  29.068 -14.833
  712    HZ3  LYS  95           HZ3      LYS  95 -15.859  29.932 -14.126
  713    H    GLN  96           H        GLN  96 -13.114  25.290  -8.500
  714    HA   GLN  96           HA       GLN  96 -10.772  26.524  -7.373
  715    HB2  GLN  96           HB3      GLN  96 -13.017  26.890  -6.419
  716    HB3  GLN  96           HB2      GLN  96 -13.125  25.181  -6.022
  717    HG2  GLN  96           HG3      GLN  96 -12.570  26.512  -4.071
  718    HG3  GLN  96           HG2      GLN  96 -11.259  25.404  -4.478
  719   HE21  GLN  96          HE21      GLN  96  -9.712  26.631  -3.427
  720   HE22  GLN  96          HE22      GLN  96  -9.153  28.146  -4.042
  721    H    ALA  97           H        ALA  97  -9.048  25.571  -6.445
  722    HA   ALA  97           HA       ALA  97  -8.890  22.658  -6.506
  723    HB1  ALA  97           HB1      ALA  97  -6.755  24.697  -5.882
  724    HB2  ALA  97           HB2      ALA  97  -7.029  23.942  -7.451
  725    HB3  ALA  97           HB3      ALA  97  -6.510  22.963  -6.081
  726    H    ALA  98           H        ALA  98  -8.984  21.412  -4.729
  727    HA   ALA  98           HA       ALA  98  -8.693  22.631  -2.090
  728    HB1  ALA  98           HB1      ALA  98 -11.134  21.084  -2.956
  729    HB2  ALA  98           HB2      ALA  98 -11.066  22.813  -2.614
  730    HB3  ALA  98           HB3      ALA  98 -10.802  21.648  -1.318
  731    H    TRP  99           H        TRP  99  -8.320  21.114  -0.410
  732    HA   TRP  99           HA       TRP  99  -6.874  18.786  -1.264
  733    HB2  TRP  99           HB3      TRP  99  -7.583  19.812   1.496
  734    HB3  TRP  99           HB2      TRP  99  -6.563  18.411   1.204
  735    HD1  TRP  99           HD1      TRP  99  -6.543  22.230   0.947
  736    HE1  TRP  99           HE1      TRP  99  -4.110  23.018   0.654
  737    HE3  TRP  99           HE3      TRP  99  -4.293  17.687   0.323
  738    HZ2  TRP  99           HZ2      TRP  99  -1.571  21.862   0.213
  739    HZ3  TRP  99           HZ3      TRP  99  -1.859  17.614  -0.027
  740    HH2  TRP  99           HH2      TRP  99  -0.527  19.660  -0.081
  741    H    ARG 100           H        ARG 100  -7.886  17.015  -1.888
  742    HA   ARG 100           HA       ARG 100 -10.282  16.149  -0.401
  743    HB2  ARG 100           HB3      ARG 100  -9.722  15.843  -3.364
  744    HB3  ARG 100           HB2      ARG 100 -11.130  15.207  -2.526
  745    HG2  ARG 100           HG3      ARG 100 -10.459  18.137  -2.657
  746    HG3  ARG 100           HG2      ARG 100 -11.493  17.316  -3.825
  747    HD2  ARG 100           HD3      ARG 100 -11.990  17.454  -0.852
  748    HD3  ARG 100           HD2      ARG 100 -12.783  18.450  -2.066
  749    HE   ARG 100           HE       ARG 100 -13.036  15.502  -1.995
  750   HH11  ARG 100          HH11      ARG 100 -14.416  18.706  -2.367
  751   HH12  ARG 100          HH12      ARG 100 -16.017  18.117  -2.681
  752   HH21  ARG 100          HH21      ARG 100 -15.152  14.724  -2.385
  753   HH22  ARG 100          HH22      ARG 100 -16.433  15.863  -2.703
  754    H    PHE 101           H        PHE 101 -10.613  13.867  -0.323
  755    HA   PHE 101           HA       PHE 101  -8.109  12.356  -0.365
  756    HB2  PHE 101           HB3      PHE 101 -10.833  11.710   0.802
  757    HB3  PHE 101           HB2      PHE 101  -9.465  10.610   0.840
  758    HD1  PHE 101           HD1      PHE 101 -10.803  13.784   2.129
  759    HD2  PHE 101           HD2      PHE 101  -7.674  10.906   2.373
  760    HE1  PHE 101           HE1      PHE 101 -10.047  14.788   4.240
  761    HE2  PHE 101           HE2      PHE 101  -6.915  11.908   4.486
  762    HZ   PHE 101           HZ       PHE 101  -8.103  13.850   5.422
  763    H    ILE 102           H        ILE 102  -7.645  11.249  -2.157
  764    HA   ILE 102           HA       ILE 102  -9.898  10.313  -3.819
  765    HB   ILE 102           HB       ILE 102  -8.307  10.357  -5.738
  766   HG12  ILE 102          HG13      ILE 102  -6.524  11.929  -3.870
  767   HG13  ILE 102          HG12      ILE 102  -6.229  10.261  -4.349
  768   HG21  ILE 102          HG21      ILE 102  -8.371  12.783  -6.047
  769   HG22  ILE 102          HG22      ILE 102  -8.748  12.986  -4.336
  770   HG23  ILE 102          HG23      ILE 102  -9.888  12.162  -5.401
  771   HD11  ILE 102          HD11      ILE 102  -4.866  11.769  -5.645
  772   HD12  ILE 102          HD12      ILE 102  -6.299  12.656  -6.170
  773   HD13  ILE 102          HD13      ILE 102  -6.057  10.986  -6.687
  774    H    ARG 103           H        ARG 103  -9.778   8.272  -4.770
  775    HA   ARG 103           HA       ARG 103  -8.261   6.404  -3.143
  776    HB2  ARG 103           HB3      ARG 103  -9.652   4.657  -4.156
  777    HB3  ARG 103           HB2      ARG 103 -10.637   5.949  -3.486
  778    HG2  ARG 103           HG3      ARG 103 -11.010   6.849  -5.708
  779    HG3  ARG 103           HG2      ARG 103  -9.961   5.616  -6.400
  780    HD2  ARG 103           HD3      ARG 103 -11.503   3.875  -5.537
  781    HD3  ARG 103           HD2      ARG 103 -12.574   5.153  -4.961
  782    HE   ARG 103           HE       ARG 103 -12.055   5.531  -7.703
  783   HH11  ARG 103          HH11      ARG 103 -13.776   3.364  -5.560
  784   HH12  ARG 103          HH12      ARG 103 -14.993   2.968  -6.731
  785   HH21  ARG 103          HH21      ARG 103 -13.673   5.025  -9.240
  786   HH22  ARG 103          HH22      ARG 103 -14.932   3.905  -8.823
  787    H    ILE 104           H        ILE 104  -6.532   5.361  -3.742
  788    HA   ILE 104           HA       ILE 104  -5.894   5.110  -6.607
  789    HB   ILE 104           HB       ILE 104  -3.475   5.295  -5.993
  790   HG12  ILE 104          HG13      ILE 104  -4.548   6.318  -3.356
  791   HG13  ILE 104          HG12      ILE 104  -3.749   4.769  -3.586
  792   HG21  ILE 104          HG21      ILE 104  -4.629   7.193  -6.975
  793   HG22  ILE 104          HG22      ILE 104  -3.452   7.741  -5.781
  794   HG23  ILE 104          HG23      ILE 104  -5.168   7.711  -5.377
  795   HD11  ILE 104          HD11      ILE 104  -1.702   5.909  -4.225
  796   HD12  ILE 104          HD12      ILE 104  -2.253   6.430  -2.633
  797   HD13  ILE 104          HD13      ILE 104  -2.504   7.469  -4.035
  798    H    ASP 105           H        ASP 105  -4.634   3.241  -7.152
  799    HA   ASP 105           HA       ASP 105  -5.345   0.896  -5.728
  800    HB2  ASP 105           HB3      ASP 105  -3.346   1.359  -7.953
  801    HB3  ASP 105           HB2      ASP 105  -3.671  -0.235  -7.270
  802    H    THR 106           H        THR 106  -4.413  -0.055  -4.082
  803    HA   THR 106           HA       THR 106  -2.053   1.235  -2.950
  804    HB   THR 106           HB       THR 106  -3.731  -0.847  -1.566
  805    HG1  THR 106           HG1      THR 106  -4.603   1.475  -2.587
  806   HG21  THR 106          HG21      THR 106  -1.675  -0.018  -0.474
  807   HG22  THR 106          HG22      THR 106  -3.130   0.420   0.421
  808   HG23  THR 106          HG23      THR 106  -2.306   1.627  -0.568
  809    H    ALA 107           H        ALA 107  -3.289  -2.093  -3.357
  810    HA   ALA 107           HA       ALA 107  -0.745  -3.063  -4.246
  811    HB1  ALA 107           HB1      ALA 107  -0.336  -4.601  -2.396
  812    HB2  ALA 107           HB2      ALA 107  -1.721  -3.941  -1.529
  813    HB3  ALA 107           HB3      ALA 107  -0.311  -2.929  -1.836
  814    H    CYS 108           H        CYS 108  -0.844  -5.330  -4.847
  815    HA   CYS 108           HA       CYS 108  -3.587  -6.183  -5.399
  816    HB2  CYS 108           HB3      CYS 108  -2.072  -6.125  -7.335
  817    HB3  CYS 108           HB2      CYS 108  -0.959  -7.220  -6.509
  818    H    VAL 109           H        VAL 109  -4.509  -7.653  -4.167
  819    HA   VAL 109           HA       VAL 109  -2.797  -9.247  -2.383
  820    HB   VAL 109           HB       VAL 109  -4.671  -9.373  -0.848
  821   HG11  VAL 109          HG11      VAL 109  -3.226  -7.432  -0.647
  822   HG12  VAL 109          HG12      VAL 109  -4.888  -7.007  -0.236
  823   HG13  VAL 109          HG13      VAL 109  -4.224  -6.548  -1.802
  824   HG21  VAL 109          HG21      VAL 109  -6.505  -9.456  -2.449
  825   HG22  VAL 109          HG22      VAL 109  -6.217  -7.771  -2.887
  826   HG23  VAL 109          HG23      VAL 109  -6.772  -8.176  -1.263
  827    H    CYS 110           H        CYS 110  -3.315 -11.431  -2.010
  828    HA   CYS 110           HA       CYS 110  -4.764 -12.723  -4.193
  829    HB2  CYS 110           HB3      CYS 110  -2.559 -13.634  -3.756
  830    HB3  CYS 110           HB2      CYS 110  -2.930 -13.835  -2.052
  831    H    VAL 111           H        VAL 111  -6.887 -12.956  -3.850
  832    HA   VAL 111           HA       VAL 111  -7.860 -13.329  -1.115
  833    HB   VAL 111           HB       VAL 111 -10.074 -12.918  -1.966
  834   HG11  VAL 111          HG11      VAL 111  -8.828 -10.934  -1.520
  835   HG12  VAL 111          HG12      VAL 111  -9.766 -10.670  -2.990
  836   HG13  VAL 111          HG13      VAL 111  -8.040 -11.011  -3.096
  837   HG21  VAL 111          HG21      VAL 111 -10.557 -12.534  -4.318
  838   HG22  VAL 111          HG22      VAL 111  -9.908 -14.156  -4.066
  839   HG23  VAL 111          HG23      VAL 111  -8.879 -12.888  -4.729
  840    H    LEU 112           H        LEU 112  -9.336 -15.074  -0.593
  841    HA   LEU 112           HA       LEU 112  -9.038 -17.395  -2.373
  842    HB2  LEU 112           HB3      LEU 112  -8.758 -17.360   0.634
  843    HB3  LEU 112           HB2      LEU 112  -8.876 -18.821  -0.325
  844    HG   LEU 112           HG       LEU 112  -6.635 -16.796  -0.387
  845   HD11  LEU 112          HD11      LEU 112  -6.757 -19.680   0.494
  846   HD12  LEU 112          HD12      LEU 112  -6.556 -18.266   1.531
  847   HD13  LEU 112          HD13      LEU 112  -5.292 -18.705   0.384
  848   HD21  LEU 112          HD21      LEU 112  -7.081 -19.253  -2.076
  849   HD22  LEU 112          HD22      LEU 112  -5.559 -18.370  -1.965
  850   HD23  LEU 112          HD23      LEU 112  -6.987 -17.581  -2.631
  851    H    SER 113           H        SER 113 -10.761 -18.604  -2.696
  852    HA   SER 113           HA       SER 113 -13.072 -18.319  -0.901
  853    HB2  SER 113           HB3      SER 113 -14.470 -18.829  -2.987
  854    HB3  SER 113           HB2      SER 113 -13.745 -17.224  -2.914
  855    HG   SER 113           HG       SER 113 -11.972 -18.221  -4.179
  856    H    ARG 114           H        ARG 114 -14.162 -20.285  -0.437
  857    HA   ARG 114           HA       ARG 114 -12.339 -22.519  -0.587
  858    HB2  ARG 114           HB3      ARG 114 -13.886 -23.637   0.986
  859    HB3  ARG 114           HB2      ARG 114 -13.321 -22.078   1.554
  860    HG2  ARG 114           HG3      ARG 114 -15.542 -22.020   2.130
  861    HG3  ARG 114           HG2      ARG 114 -15.561 -21.201   0.567
  862    HD2  ARG 114           HD3      ARG 114 -16.271 -23.237  -0.528
  863    HD3  ARG 114           HD2      ARG 114 -16.152 -24.127   0.990
  864    HE   ARG 114           HE       ARG 114 -17.907 -21.980   1.367
  865   HH11  ARG 114          HH11      ARG 114 -17.720 -24.976  -0.423
  866   HH12  ARG 114          HH12      ARG 114 -19.439 -25.221  -0.449
  867   HH21  ARG 114          HH21      ARG 114 -20.174 -22.299   1.340
  868   HH22  ARG 114          HH22      ARG 114 -20.839 -23.686   0.540
  869    H    LYS 115           H        LYS 115 -14.410 -21.460  -2.748
  870    HA   LYS 115           HA       LYS 115 -15.171 -22.342  -4.689
  871    HB2  LYS 115           HB3      LYS 115 -13.973 -24.933  -3.673
  872    HB3  LYS 115           HB2      LYS 115 -14.574 -24.674  -5.303
  873    HG2  LYS 115           HG3      LYS 115 -12.868 -22.958  -5.658
  874    HG3  LYS 115           HG2      LYS 115 -12.279 -23.214  -4.013
  875    HD2  LYS 115           HD3      LYS 115 -10.862 -24.417  -5.535
  876    HD3  LYS 115           HD2      LYS 115 -11.803 -25.571  -4.592
  877    HE2  LYS 115           HE3      LYS 115 -13.367 -25.811  -6.453
  878    HE3  LYS 115           HE2      LYS 115 -12.421 -24.666  -7.399
  879    HZ1  LYS 115           HZ1      LYS 115 -10.530 -26.205  -7.233
  880    HZ2  LYS 115           HZ2      LYS 115 -11.855 -26.903  -8.021
  881    HZ3  LYS 115           HZ3      LYS 115 -11.514 -27.317  -6.419
  882    H    ALA 116           H        ALA 116 -16.526 -24.392  -5.488
  883    HA   ALA 116           HA       ALA 116 -18.466 -25.536  -5.459
  884    HB1  ALA 116           HB1      ALA 116 -17.562 -26.673  -3.480
  885    HB2  ALA 116           HB2      ALA 116 -19.316 -26.498  -3.416
  886    HB3  ALA 116           HB3      ALA 116 -18.291 -25.434  -2.455
  887    H    THR 117           H        THR 117 -18.967 -23.558  -2.540
  888    HA   THR 117           HA       THR 117 -20.967 -21.991  -3.979
  889    HB   THR 117           HB       THR 117 -22.399 -22.327  -1.772
  890    HG1  THR 117           HG1      THR 117 -21.630 -24.978  -1.949
  891   HG21  THR 117          HG21      THR 117 -23.245 -22.777  -3.992
  892   HG22  THR 117          HG22      THR 117 -23.647 -24.128  -2.933
  893   HG23  THR 117          HG23      THR 117 -22.315 -24.273  -4.077
  894    H    ARG 118           H        ARG 118 -21.881 -20.259  -2.425
  895    HA   ARG 118           HA       ARG 118 -19.641 -19.192  -0.841
  896    HB2  ARG 118           HB3      ARG 118 -21.711 -17.753  -2.516
  897    HB3  ARG 118           HB2      ARG 118 -20.750 -16.929  -1.307
  898    HG2  ARG 118           HG3      ARG 118 -19.764 -16.551  -3.440
  899    HG3  ARG 118           HG2      ARG 118 -18.700 -17.616  -2.528
  900    HD2  ARG 118           HD3      ARG 118 -18.902 -18.320  -4.865
  901    HD3  ARG 118           HD2      ARG 118 -19.541 -19.541  -3.767
  902    HE   ARG 118           HE       ARG 118 -21.565 -17.755  -4.727
  903   HH11  ARG 118          HH11      ARG 118 -19.701 -20.611  -5.546
  904   HH12  ARG 118          HH12      ARG 118 -20.900 -21.232  -6.634
  905   HH21  ARG 118          HH21      ARG 118 -23.140 -18.577  -6.147
  906   HH22  ARG 118          HH22      ARG 118 -22.864 -20.082  -6.969
  907    H1   SER   1           H1       SER   1 -29.601   0.827  -1.629
  908    H2   SER   1           H2       SER   1 -28.610   0.081  -2.773
  909    H3   SER   1           H3       SER   1 -29.219   1.628  -3.069
  910    HA   SER   1           HA       SER   1 -26.895   1.692  -2.436
  911    HB2  SER   1           HB3      SER   1 -28.445   3.571  -1.895
  912    HB3  SER   1           HB2      SER   1 -28.740   2.840  -0.322
  913    HG   SER   1           HG       SER   1 -27.118   4.084   0.215
  914    H    SER   2           H        SER   2 -25.440   1.674  -0.501
  915    HA   SER   2           HA       SER   2 -24.404   0.657   1.240
  916    HB2  SER   2           HB3      SER   2 -26.550   1.260   2.419
  917    HB3  SER   2           HB2      SER   2 -27.136  -0.362   2.059
  918    HG   SER   2           HG       SER   2 -25.846  -1.179   3.533
  919    H    THR   3           H        THR   3 -24.967  -0.732  -1.339
  920    HA   THR   3           HA       THR   3 -25.239  -3.521  -0.634
  921    HB   THR   3           HB       THR   3 -24.707  -3.832  -3.126
  922    HG1  THR   3           HG1      THR   3 -23.898  -1.983  -3.882
  923   HG21  THR   3          HG21      THR   3 -26.970  -3.974  -2.218
  924   HG22  THR   3          HG22      THR   3 -26.977  -3.180  -3.792
  925   HG23  THR   3          HG23      THR   3 -27.132  -2.222  -2.321
  926    H    HIS   4           H        HIS   4 -23.643  -5.019  -0.522
  927    HA   HIS   4           HA       HIS   4 -20.946  -4.319  -1.311
  928    HB2  HIS   4           HB3      HIS   4 -20.045  -5.001   0.958
  929    HB3  HIS   4           HB2      HIS   4 -20.846  -3.442   0.892
  930    HD1  HIS   4           HD1      HIS   4 -23.158  -3.249   2.102
  931    HD2  HIS   4           HD2      HIS   4 -21.209  -6.883   2.638
  932    HE1  HIS   4           HE1      HIS   4 -24.337  -4.374   4.018
  933    HE2  HIS   4           HE2      HIS   4 -23.206  -6.614   4.257
  934    HA   PRO   5           HA       PRO   5 -21.630  -8.728  -2.125
  935    HB2  PRO   5           HB3      PRO   5 -20.176  -8.851  -4.377
  936    HB3  PRO   5           HB2      PRO   5 -21.798  -8.142  -4.370
  937    HG2  PRO   5           HG3      PRO   5 -19.129  -6.779  -4.317
  938    HG3  PRO   5           HG2      PRO   5 -20.581  -6.353  -5.243
  939    HD2  PRO   5           HD3      PRO   5 -19.834  -5.133  -2.896
  940    HD3  PRO   5           HD2      PRO   5 -21.507  -5.213  -3.485
  941    H    VAL   6           H        VAL   6 -20.128  -8.353  -0.059
  942    HA   VAL   6           HA       VAL   6 -18.277  -8.914   1.137
  943    HB   VAL   6           HB       VAL   6 -17.518 -10.739  -1.142
  944   HG11  VAL   6          HG11      VAL   6 -17.112 -10.923   1.841
  945   HG12  VAL   6          HG12      VAL   6 -15.875 -10.573   0.632
  946   HG13  VAL   6          HG13      VAL   6 -16.646 -12.158   0.672
  947   HG21  VAL   6          HG21      VAL   6 -19.887 -11.074  -0.672
  948   HG22  VAL   6          HG22      VAL   6 -19.525 -11.282   1.041
  949   HG23  VAL   6          HG23      VAL   6 -18.934 -12.457  -0.133
  950    H    PHE   7           H        PHE   7 -18.142  -6.645  -0.455
  951    HA   PHE   7           HA       PHE   7 -16.770  -5.114  -1.417
  952    HB2  PHE   7           HB3      PHE   7 -15.638  -5.481   0.783
  953    HB3  PHE   7           HB2      PHE   7 -14.605  -6.679   0.015
  954    HD1  PHE   7           HD1      PHE   7 -12.534  -6.006  -0.705
  955    HD2  PHE   7           HD2      PHE   7 -15.649  -3.124  -0.417
  956    HE1  PHE   7           HE1      PHE   7 -10.944  -4.236  -1.319
  957    HE2  PHE   7           HE2      PHE   7 -14.066  -1.345  -1.035
  958    HZ   PHE   7           HZ       PHE   7 -11.712  -1.899  -1.487
  959    H    HIS   8           H        HIS   8 -17.490  -7.075  -3.150
  960    HA   HIS   8           HA       HIS   8 -16.997  -8.077  -5.134
  961    HB2  HIS   8           HB3      HIS   8 -16.105  -5.710  -5.518
  962    HB3  HIS   8           HB2      HIS   8 -14.508  -6.356  -5.173
  963    HD1  HIS   8           HD1      HIS   8 -17.272  -6.558  -7.725
  964    HD2  HIS   8           HD2      HIS   8 -13.302  -7.704  -7.272
  965    HE1  HIS   8           HE1      HIS   8 -16.527  -7.325  -9.999
  966    HE2  HIS   8           HE2      HIS   8 -14.147  -8.090  -9.686
  967    H    MET   9           H        MET   9 -16.290  -9.438  -2.882
  968    HA   MET   9           HA       MET   9 -14.949 -10.939  -1.863
  969    HB2  MET   9           HB3      MET   9 -14.190 -12.778  -3.216
  970    HB3  MET   9           HB2      MET   9 -15.737 -12.225  -3.829
  971    HG2  MET   9           HG3      MET   9 -14.647 -11.116  -5.677
  972    HG3  MET   9           HG2      MET   9 -13.064 -11.537  -5.033
  973    HE1  MET   9           HE1      MET   9 -16.237 -13.878  -5.010
  974    HE2  MET   9           HE2      MET   9 -16.083 -14.676  -6.576
  975    HE3  MET   9           HE3      MET   9 -16.425 -12.947  -6.496
  976    H    GLY  10           H        GLY  10 -13.707  -8.385  -2.277
  977    HA2  GLY  10           HA3      GLY  10 -10.896  -9.134  -2.733
  978    HA3  GLY  10           HA2      GLY  10 -11.543  -7.510  -2.847
  979    H    GLU  11           H        GLU  11 -12.875  -8.987  -0.184
  980    HA   GLU  11           HA       GLU  11 -10.960  -7.602   1.549
  981    HB2  GLU  11           HB3      GLU  11 -12.693  -7.669   3.278
  982    HB3  GLU  11           HB2      GLU  11 -13.281  -6.913   1.801
  983    HG2  GLU  11           HG3      GLU  11 -14.510  -8.896   1.210
  984    HG3  GLU  11           HG2      GLU  11 -13.826  -9.769   2.585
  985    H    PHE  12           H        PHE  12 -10.921 -10.468   0.344
  986    HA   PHE  12           HA       PHE  12 -10.605 -12.007   2.795
  987    HB2  PHE  12           HB3      PHE  12 -10.211 -12.785  -0.104
  988    HB3  PHE  12           HB2      PHE  12  -9.984 -13.879   1.254
  989    HD1  PHE  12           HD1      PHE  12 -12.214 -12.893  -1.211
  990    HD2  PHE  12           HD2      PHE  12 -12.079 -13.929   2.913
  991    HE1  PHE  12           HE1      PHE  12 -14.598 -13.482  -1.284
  992    HE2  PHE  12           HE2      PHE  12 -14.466 -14.520   2.848
  993    HZ   PHE  12           HZ       PHE  12 -15.728 -14.298   0.746
  994    H    SER  13           H        SER  13  -8.587 -12.897   3.452
  995    HA   SER  13           HA       SER  13  -6.229 -11.716   2.190
  996    HB2  SER  13           HB3      SER  13  -6.869 -11.495   5.142
  997    HB3  SER  13           HB2      SER  13  -5.386 -10.942   4.375
  998    HG   SER  13           HG       SER  13  -7.362  -9.874   3.014
  999    H    VAL  14           H        VAL  14  -4.638 -13.169   1.975
 1000    HA   VAL  14           HA       VAL  14  -4.777 -15.761   3.184
 1001    HB   VAL  14           HB       VAL  14  -2.529 -16.123   2.168
 1002   HG11  VAL  14          HG11      VAL  14  -3.270 -15.997  -0.160
 1003   HG12  VAL  14          HG12      VAL  14  -4.596 -14.940   0.324
 1004   HG13  VAL  14          HG13      VAL  14  -4.544 -16.606   0.896
 1005   HG21  VAL  14          HG21      VAL  14  -2.849 -13.305   1.137
 1006   HG22  VAL  14          HG22      VAL  14  -1.558 -14.430   0.721
 1007   HG23  VAL  14          HG23      VAL  14  -1.696 -13.818   2.368
 1008    H    CYS  15           H        CYS  15  -3.494 -12.751   4.095
 1009    HA   CYS  15           HA       CYS  15  -2.182 -13.968   6.426
 1010    HB2  CYS  15           HB3      CYS  15  -1.341 -11.443   4.971
 1011    HB3  CYS  15           HB2      CYS  15  -0.582 -12.097   6.422
 1012    H    ASP  16           H        ASP  16  -2.885 -13.213   8.355
 1013    HA   ASP  16           HA       ASP  16  -5.157 -11.519   8.477
 1014    HB2  ASP  16           HB3      ASP  16  -3.297 -12.450  10.683
 1015    HB3  ASP  16           HB2      ASP  16  -4.815 -11.602  10.954
 1016    H    SER  17           H        SER  17  -5.193  -9.396   8.267
 1017    HA   SER  17           HA       SER  17  -2.807  -7.876   9.054
 1018    HB2  SER  17           HB3      SER  17  -3.457  -6.357   7.061
 1019    HB3  SER  17           HB2      SER  17  -2.665  -7.898   6.711
 1020    HG   SER  17           HG       SER  17  -4.697  -8.779   6.243
 1021    H    VAL  18           H        VAL  18  -3.127  -5.695   9.637
 1022    HA   VAL  18           HA       VAL  18  -5.874  -5.048  10.456
 1023    HB   VAL  18           HB       VAL  18  -4.654  -5.603  12.443
 1024   HG11  VAL  18          HG11      VAL  18  -2.555  -3.650  11.522
 1025   HG12  VAL  18          HG12      VAL  18  -2.390  -5.403  11.633
 1026   HG13  VAL  18          HG13      VAL  18  -2.589  -4.442  13.097
 1027   HG21  VAL  18          HG21      VAL  18  -4.888  -2.617  12.139
 1028   HG22  VAL  18          HG22      VAL  18  -4.714  -3.466  13.674
 1029   HG23  VAL  18          HG23      VAL  18  -6.144  -3.728  12.679
 1030    H    SER  19           H        SER  19  -6.594  -3.354   9.346
 1031    HA   SER  19           HA       SER  19  -4.659  -1.379   8.358
 1032    HB2  SER  19           HB3      SER  19  -6.188  -2.544   6.708
 1033    HB3  SER  19           HB2      SER  19  -7.541  -1.723   7.486
 1034    HG   SER  19           HG       SER  19  -5.331  -0.541   6.147
 1035    H    VAL  20           H        VAL  20  -4.490   0.433   9.484
 1036    HA   VAL  20           HA       VAL  20  -6.815   1.316  11.072
 1037    HB   VAL  20           HB       VAL  20  -3.888   1.683  11.722
 1038   HG11  VAL  20          HG11      VAL  20  -5.167   3.535  12.546
 1039   HG12  VAL  20          HG12      VAL  20  -4.713   2.497  13.899
 1040   HG13  VAL  20          HG13      VAL  20  -6.356   2.447  13.260
 1041   HG21  VAL  20          HG21      VAL  20  -4.549  -0.624  12.005
 1042   HG22  VAL  20          HG22      VAL  20  -5.942  -0.132  12.970
 1043   HG23  VAL  20          HG23      VAL  20  -4.306   0.135  13.578
 1044    H    TRP  21           H        TRP  21  -7.459   3.390  10.852
 1045    HA   TRP  21           HA       TRP  21  -5.802   5.171   9.213
 1046    HB2  TRP  21           HB3      TRP  21  -8.720   5.332  10.016
 1047    HB3  TRP  21           HB2      TRP  21  -7.871   6.618   9.168
 1048    HD1  TRP  21           HD1      TRP  21  -9.171   3.040   8.639
 1049    HE1  TRP  21           HE1      TRP  21  -9.349   2.597   6.110
 1050    HE3  TRP  21           HE3      TRP  21  -6.972   7.326   6.898
 1051    HZ2  TRP  21           HZ2      TRP  21  -8.657   3.891   3.698
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.774   7.644   4.465
 1053    HH2  TRP  21           HH2      TRP  21  -7.598   5.962   2.901
 1054    H    VAL  22           H        VAL  22  -4.322   5.928  10.582
 1055    HA   VAL  22           HA       VAL  22  -4.930   6.493  13.337
 1056    HB   VAL  22           HB       VAL  22  -2.379   7.012  11.799
 1057   HG11  VAL  22          HG11      VAL  22  -2.455   8.269  13.852
 1058   HG12  VAL  22          HG12      VAL  22  -1.321   6.930  14.025
 1059   HG13  VAL  22          HG13      VAL  22  -2.923   6.828  14.754
 1060   HG21  VAL  22          HG21      VAL  22  -3.163   4.608  13.441
 1061   HG22  VAL  22          HG22      VAL  22  -1.580   4.893  12.717
 1062   HG23  VAL  22          HG23      VAL  22  -2.991   4.656  11.686
 1063    H    GLY  23           H        GLY  23  -5.965   8.314  13.848
 1064    HA2  GLY  23           HA3      GLY  23  -5.584  10.706  12.214
 1065    HA3  GLY  23           HA2      GLY  23  -6.792  10.486  13.478
 1066    H    ASP  24           H        ASP  24  -3.742   9.455  14.471
 1067    HA   ASP  24           HA       ASP  24  -2.782  12.028  15.353
 1068    HB2  ASP  24           HB3      ASP  24  -4.566  11.430  17.015
 1069    HB3  ASP  24           HB2      ASP  24  -3.627   9.996  17.434
 1070    H    LYS  25           H        LYS  25  -1.369  10.603  13.721
 1071    HA   LYS  25           HA       LYS  25   0.423   8.795  15.086
 1072    HB2  LYS  25           HB3      LYS  25  -0.146   8.641  12.632
 1073    HB3  LYS  25           HB2      LYS  25   0.776  10.117  12.385
 1074    HG2  LYS  25           HG3      LYS  25   2.800   9.047  13.079
 1075    HG3  LYS  25           HG2      LYS  25   1.923   7.588  13.542
 1076    HD2  LYS  25           HD3      LYS  25   1.211   7.370  11.149
 1077    HD3  LYS  25           HD2      LYS  25   2.300   8.706  10.770
 1078    HE2  LYS  25           HE3      LYS  25   3.415   6.604  10.311
 1079    HE3  LYS  25           HE2      LYS  25   4.180   7.391  11.693
 1080    HZ1  LYS  25           HZ1      LYS  25   2.902   5.933  13.160
 1081    HZ2  LYS  25           HZ2      LYS  25   3.881   5.046  12.105
 1082    HZ3  LYS  25           HZ3      LYS  25   2.217   5.159  11.818
 1083    H    THR  26           H        THR  26   2.364   9.344  16.038
 1084    HA   THR  26           HA       THR  26   2.730  12.235  16.315
 1085    HB   THR  26           HB       THR  26   2.232  11.077  18.396
 1086    HG1  THR  26           HG1      THR  26   4.511  12.527  17.950
 1087   HG21  THR  26          HG21      THR  26   3.887   9.531  19.394
 1088   HG22  THR  26          HG22      THR  26   4.771   9.528  17.868
 1089   HG23  THR  26          HG23      THR  26   3.134   8.878  17.941
 1090    H    THR  27           H        THR  27   4.479   9.340  15.378
 1091    HA   THR  27           HA       THR  27   6.637  11.052  14.435
 1092    HB   THR  27           HB       THR  27   8.233   9.146  15.341
 1093    HG1  THR  27           HG1      THR  27   6.918   9.157  17.689
 1094   HG21  THR  27          HG21      THR  27   8.518  11.498  15.842
 1095   HG22  THR  27          HG22      THR  27   8.695  10.552  17.320
 1096   HG23  THR  27          HG23      THR  27   7.200  11.437  17.013
 1097    H    ALA  28           H        ALA  28   7.758  10.272  12.695
 1098    HA   ALA  28           HA       ALA  28   7.326   7.537  11.805
 1099    HB1  ALA  28           HB1      ALA  28   6.536   9.855  10.045
 1100    HB2  ALA  28           HB2      ALA  28   5.408   8.783  10.872
 1101    HB3  ALA  28           HB3      ALA  28   6.478   8.142   9.624
 1102    H    THR  29           H        THR  29   8.602   7.107   9.783
 1103    HA   THR  29           HA       THR  29  11.138   8.556   9.942
 1104    HB   THR  29           HB       THR  29  10.583   5.927   8.558
 1105    HG1  THR  29           HG1      THR  29  10.592   6.354  11.128
 1106   HG21  THR  29          HG21      THR  29  12.556   7.128   7.731
 1107   HG22  THR  29          HG22      THR  29  13.016   5.670   8.610
 1108   HG23  THR  29          HG23      THR  29  13.172   7.250   9.381
 1109    H    ASP  30           H        ASP  30  11.550  10.015   8.498
 1110    HA   ASP  30           HA       ASP  30  10.035  10.448   6.126
 1111    HB2  ASP  30           HB3      ASP  30  11.096  12.300   7.305
 1112    HB3  ASP  30           HB2      ASP  30  12.685  11.567   7.092
 1113    H    ILE  31           H        ILE  31  10.948  10.478   3.948
 1114    HA   ILE  31           HA       ILE  31  11.921   7.958   3.197
 1115    HB   ILE  31           HB       ILE  31  10.527   9.377   1.743
 1116   HG12  ILE  31          HG13      ILE  31  13.202   8.733   0.473
 1117   HG13  ILE  31          HG12      ILE  31  11.914   7.566   0.757
 1118   HG21  ILE  31          HG21      ILE  31  11.534  11.244   0.503
 1119   HG22  ILE  31          HG22      ILE  31  13.009  11.066   1.452
 1120   HG23  ILE  31          HG23      ILE  31  11.505  11.538   2.241
 1121   HD11  ILE  31          HD11      ILE  31  11.760   9.970  -1.045
 1122   HD12  ILE  31          HD12      ILE  31  10.456   8.820  -0.755
 1123   HD13  ILE  31          HD13      ILE  31  11.937   8.291  -1.553
 1124    H    LYS  32           H        LYS  32  13.612  10.824   4.120
 1125    HA   LYS  32           HA       LYS  32  16.099  10.028   2.871
 1126    HB2  LYS  32           HB3      LYS  32  15.476  12.230   4.841
 1127    HB3  LYS  32           HB2      LYS  32  17.021  12.009   4.028
 1128    HG2  LYS  32           HG3      LYS  32  15.993  12.423   1.881
 1129    HG3  LYS  32           HG2      LYS  32  14.403  12.517   2.634
 1130    HD2  LYS  32           HD3      LYS  32  15.125  14.461   3.910
 1131    HD3  LYS  32           HD2      LYS  32  16.714  14.383   3.147
 1132    HE2  LYS  32           HE3      LYS  32  15.671  14.733   0.962
 1133    HE3  LYS  32           HE2      LYS  32  14.087  14.801   1.731
 1134    HZ1  LYS  32           HZ1      LYS  32  14.972  17.006   1.261
 1135    HZ2  LYS  32           HZ2      LYS  32  16.316  16.696   2.233
 1136    HZ3  LYS  32           HZ3      LYS  32  14.775  16.776   2.921
 1137    H    GLY  33           H        GLY  33  14.416   9.048   5.540
 1138    HA2  GLY  33           HA3      GLY  33  15.151   7.331   6.975
 1139    HA3  GLY  33           HA2      GLY  33  16.818   7.801   6.650
 1140    H    LYS  34           H        LYS  34  14.399  10.158   7.482
 1141    HA   LYS  34           HA       LYS  34  15.830  10.669   9.992
 1142    HB2  LYS  34           HB3      LYS  34  13.870  12.429   8.515
 1143    HB3  LYS  34           HB2      LYS  34  14.837  12.889   9.907
 1144    HG2  LYS  34           HG3      LYS  34  15.898  12.165   7.187
 1145    HG3  LYS  34           HG2      LYS  34  15.733  13.793   7.832
 1146    HD2  LYS  34           HD3      LYS  34  17.277  13.172   9.666
 1147    HD3  LYS  34           HD2      LYS  34  17.514  11.605   8.889
 1148    HE2  LYS  34           HE3      LYS  34  18.376  12.731   6.893
 1149    HE3  LYS  34           HE2      LYS  34  18.120  14.291   7.665
 1150    HZ1  LYS  34           HZ1      LYS  34  19.720  13.669   9.365
 1151    HZ2  LYS  34           HZ2      LYS  34  20.421  13.598   7.829
 1152    HZ3  LYS  34           HZ3      LYS  34  19.968  12.174   8.617
 1153    H    GLU  35           H        GLU  35  14.645  11.085  11.912
 1154    HA   GLU  35           HA       GLU  35  11.974   9.872  11.968
 1155    HB2  GLU  35           HB3      GLU  35  13.612   8.941  13.553
 1156    HB3  GLU  35           HB2      GLU  35  13.868  10.541  14.232
 1157    HG2  GLU  35           HG3      GLU  35  11.589  10.604  15.036
 1158    HG3  GLU  35           HG2      GLU  35  11.258   9.047  14.287
 1159    H    VAL  36           H        VAL  36  10.310  11.225  11.918
 1160    HA   VAL  36           HA       VAL  36  10.730  13.956  12.934
 1161    HB   VAL  36           HB       VAL  36   9.237  14.768  11.114
 1162   HG11  VAL  36          HG11      VAL  36  10.922  14.637   9.328
 1163   HG12  VAL  36          HG12      VAL  36  11.756  13.371  10.229
 1164   HG13  VAL  36          HG13      VAL  36  11.639  14.998  10.899
 1165   HG21  VAL  36          HG21      VAL  36   9.615  11.990  10.004
 1166   HG22  VAL  36          HG22      VAL  36   8.852  13.342   9.168
 1167   HG23  VAL  36          HG23      VAL  36   8.103  12.663  10.614
 1168    H    THR  37           H        THR  37   8.948  15.030  13.772
 1169    HA   THR  37           HA       THR  37   6.934  13.347  14.965
 1170    HB   THR  37           HB       THR  37   7.262  16.348  15.092
 1171    HG1  THR  37           HG1      THR  37   8.014  14.554  17.140
 1172   HG21  THR  37          HG21      THR  37   5.725  14.452  16.870
 1173   HG22  THR  37          HG22      THR  37   5.026  15.611  15.739
 1174   HG23  THR  37          HG23      THR  37   5.925  16.183  17.145
 1175    H    VAL  38           H        VAL  38   5.038  12.932  14.055
 1176    HA   VAL  38           HA       VAL  38   4.362  14.268  11.578
 1177    HB   VAL  38           HB       VAL  38   3.002  11.939  12.942
 1178   HG11  VAL  38          HG11      VAL  38   2.742  12.980  10.124
 1179   HG12  VAL  38          HG12      VAL  38   1.525  13.109  11.394
 1180   HG13  VAL  38          HG13      VAL  38   1.977  11.527  10.762
 1181   HG21  VAL  38          HG21      VAL  38   5.303  11.417  12.337
 1182   HG22  VAL  38          HG22      VAL  38   5.003  11.966  10.688
 1183   HG23  VAL  38          HG23      VAL  38   4.166  10.543  11.311
 1184    H    LEU  39           H        LEU  39   2.705  15.645  11.283
 1185    HA   LEU  39           HA       LEU  39   0.962  16.187  13.586
 1186    HB2  LEU  39           HB3      LEU  39   1.524  17.948  11.191
 1187    HB3  LEU  39           HB2      LEU  39   0.590  18.387  12.610
 1188    HG   LEU  39           HG       LEU  39   3.540  17.761  12.634
 1189   HD11  LEU  39          HD11      LEU  39   3.092  19.803  11.392
 1190   HD12  LEU  39          HD12      LEU  39   3.857  20.160  12.940
 1191   HD13  LEU  39          HD13      LEU  39   2.122  20.414  12.734
 1192   HD21  LEU  39          HD21      LEU  39   1.717  18.887  14.750
 1193   HD22  LEU  39          HD22      LEU  39   3.469  18.725  14.883
 1194   HD23  LEU  39          HD23      LEU  39   2.457  17.286  14.751
 1195    H    ALA  40           H        ALA  40  -0.854  15.060  13.381
 1196    HA   ALA  40           HA       ALA  40  -1.892  14.128  10.909
 1197    HB1  ALA  40           HB1      ALA  40  -3.793  13.359  12.211
 1198    HB2  ALA  40           HB2      ALA  40  -3.271  14.338  13.582
 1199    HB3  ALA  40           HB3      ALA  40  -2.287  12.976  13.042
 1200    H    GLU  41           H        GLU  41  -2.318  16.957  12.821
 1201    HA   GLU  41           HA       GLU  41  -4.323  17.968  10.934
 1202    HB2  GLU  41           HB3      GLU  41  -3.458  19.174  13.567
 1203    HB3  GLU  41           HB2      GLU  41  -4.829  19.663  12.582
 1204    HG2  GLU  41           HG3      GLU  41  -5.856  17.452  12.993
 1205    HG3  GLU  41           HG2      GLU  41  -4.512  17.063  14.061
 1206    H    VAL  42           H        VAL  42  -3.479  19.116   9.322
 1207    HA   VAL  42           HA       VAL  42  -0.776  20.150   9.621
 1208    HB   VAL  42           HB       VAL  42  -0.742  20.451   7.216
 1209   HG11  VAL  42          HG11      VAL  42  -1.033  18.134   6.493
 1210   HG12  VAL  42          HG12      VAL  42  -1.936  17.790   7.969
 1211   HG13  VAL  42          HG13      VAL  42  -0.233  18.236   8.061
 1212   HG21  VAL  42          HG21      VAL  42  -3.034  21.187   6.843
 1213   HG22  VAL  42          HG22      VAL  42  -3.624  19.567   7.213
 1214   HG23  VAL  42          HG23      VAL  42  -2.624  19.836   5.786
 1215    H    ASN  43           H        ASN  43  -0.375  22.178  10.077
 1216    HA   ASN  43           HA       ASN  43  -2.534  24.121   9.871
 1217    HB2  ASN  43           HB3      ASN  43  -1.133  25.594  11.252
 1218    HB3  ASN  43           HB2      ASN  43  -1.352  24.030  12.021
 1219   HD21  ASN  43          HD21      ASN  43   0.422  22.637  12.210
 1220   HD22  ASN  43          HD22      ASN  43   2.044  23.201  12.007
 1221    H    ILE  44           H        ILE  44  -2.727  24.989   7.944
 1222    HA   ILE  44           HA       ILE  44  -0.285  25.763   6.507
 1223    HB   ILE  44           HB       ILE  44  -3.116  25.612   5.447
 1224   HG12  ILE  44          HG13      ILE  44  -0.791  23.715   5.030
 1225   HG13  ILE  44          HG12      ILE  44  -2.193  23.390   6.048
 1226   HG21  ILE  44          HG21      ILE  44  -1.698  27.233   4.280
 1227   HG22  ILE  44          HG22      ILE  44  -2.086  25.854   3.253
 1228   HG23  ILE  44          HG23      ILE  44  -0.494  25.975   4.002
 1229   HD11  ILE  44          HD11      ILE  44  -3.634  23.529   4.058
 1230   HD12  ILE  44          HD12      ILE  44  -2.419  22.257   3.935
 1231   HD13  ILE  44          HD13      ILE  44  -2.199  23.774   3.061
 1232    H    ASN  45           H        ASN  45  -0.026  27.476   8.041
 1233    HA   ASN  45           HA       ASN  45   0.003  29.655   8.623
 1234    HB2  ASN  45           HB3      ASN  45  -1.475  29.910   6.007
 1235    HB3  ASN  45           HB2      ASN  45  -1.163  31.310   7.023
 1236   HD21  ASN  45          HD21      ASN  45   1.072  28.610   6.720
 1237   HD22  ASN  45          HD22      ASN  45   2.289  29.481   5.853
 1238    H    ASN  46           H        ASN  46  -3.234  29.761   7.173
 1239    HA   ASN  46           HA       ASN  46  -4.316  30.117   9.891
 1240    HB2  ASN  46           HB3      ASN  46  -5.036  31.666   7.396
 1241    HB3  ASN  46           HB2      ASN  46  -5.971  31.719   8.883
 1242   HD21  ASN  46          HD21      ASN  46  -3.571  31.587  10.573
 1243   HD22  ASN  46          HD22      ASN  46  -2.854  33.156  10.481
 1244    H    SER  47           H        SER  47  -4.200  27.720   8.181
 1245    HA   SER  47           HA       SER  47  -7.031  27.082   8.354
 1246    HB2  SER  47           HB3      SER  47  -5.435  26.546   5.834
 1247    HB3  SER  47           HB2      SER  47  -7.116  26.096   6.119
 1248    HG   SER  47           HG       SER  47  -7.061  28.635   6.600
 1249    H    VAL  48           H        VAL  48  -7.100  25.356   9.627
 1250    HA   VAL  48           HA       VAL  48  -4.864  23.457   9.566
 1251    HB   VAL  48           HB       VAL  48  -7.062  23.740  11.625
 1252   HG11  VAL  48          HG11      VAL  48  -5.675  22.265  13.000
 1253   HG12  VAL  48          HG12      VAL  48  -4.541  22.084  11.663
 1254   HG13  VAL  48          HG13      VAL  48  -6.188  21.473  11.510
 1255   HG21  VAL  48          HG21      VAL  48  -5.588  25.677  11.615
 1256   HG22  VAL  48          HG22      VAL  48  -4.181  24.621  11.725
 1257   HG23  VAL  48          HG23      VAL  48  -5.329  24.702  13.060
 1258    H    PHE  49           H        PHE  49  -5.109  21.612   8.538
 1259    HA   PHE  49           HA       PHE  49  -7.827  20.504   8.214
 1260    HB2  PHE  49           HB3      PHE  49  -5.507  20.510   6.275
 1261    HB3  PHE  49           HB2      PHE  49  -6.866  19.405   6.112
 1262    HD1  PHE  49           HD1      PHE  49  -5.759  22.878   5.833
 1263    HD2  PHE  49           HD2      PHE  49  -9.044  20.200   5.453
 1264    HE1  PHE  49           HE1      PHE  49  -7.004  24.586   4.570
 1265    HE2  PHE  49           HE2      PHE  49 -10.293  21.902   4.196
 1266    HZ   PHE  49           HZ       PHE  49  -9.274  24.097   3.752
 1267    H    ARG  50           H        ARG  50  -8.114  18.532   9.077
 1268    HA   ARG  50           HA       ARG  50  -5.708  17.071   9.913
 1269    HB2  ARG  50           HB3      ARG  50  -7.113  15.914  11.540
 1270    HB3  ARG  50           HB2      ARG  50  -7.244  17.654  11.735
 1271    HG2  ARG  50           HG3      ARG  50  -9.405  17.676  10.744
 1272    HG3  ARG  50           HG2      ARG  50  -9.252  15.990  10.242
 1273    HD2  ARG  50           HD3      ARG  50 -10.667  16.306  12.260
 1274    HD3  ARG  50           HD2      ARG  50  -9.280  15.248  12.520
 1275    HE   ARG  50           HE       ARG  50  -8.425  17.745  13.270
 1276   HH11  ARG  50          HH11      ARG  50 -11.034  15.620  14.225
 1277   HH12  ARG  50          HH12      ARG  50 -11.055  16.178  15.866
 1278   HH21  ARG  50          HH21      ARG  50  -8.426  18.470  15.422
 1279   HH22  ARG  50          HH22      ARG  50  -9.574  17.809  16.550
 1280    H    GLN  51           H        GLN  51  -5.348  14.991   9.350
 1281    HA   GLN  51           HA       GLN  51  -7.365  13.652   7.684
 1282    HB2  GLN  51           HB3      GLN  51  -4.398  13.702   7.063
 1283    HB3  GLN  51           HB2      GLN  51  -5.630  12.833   6.161
 1284    HG2  GLN  51           HG3      GLN  51  -5.440  14.649   4.831
 1285    HG3  GLN  51           HG2      GLN  51  -6.656  15.268   5.946
 1286   HE21  GLN  51          HE21      GLN  51  -6.107  17.399   5.670
 1287   HE22  GLN  51          HE22      GLN  51  -4.624  18.070   6.273
 1288    H    TYR  52           H        TYR  52  -6.601  11.271   7.345
 1289    HA   TYR  52           HA       TYR  52  -5.513  10.277   9.896
 1290    HB2  TYR  52           HB3      TYR  52  -7.514   8.769   8.204
 1291    HB3  TYR  52           HB2      TYR  52  -7.056   8.462   9.875
 1292    HD1  TYR  52           HD1      TYR  52  -7.554  10.563  11.495
 1293    HD2  TYR  52           HD2      TYR  52  -9.551   9.744   7.828
 1294    HE1  TYR  52           HE1      TYR  52  -9.470  11.905  12.244
 1295    HE2  TYR  52           HE2      TYR  52 -11.472  11.083   8.568
 1296    HH   TYR  52           HH       TYR  52 -12.478  11.819  10.719
 1297    H    PHE  53           H        PHE  53  -3.938   8.744   9.757
 1298    HA   PHE  53           HA       PHE  53  -2.863   8.294   7.077
 1299    HB2  PHE  53           HB3      PHE  53  -1.605   7.754   9.780
 1300    HB3  PHE  53           HB2      PHE  53  -0.789   7.665   8.218
 1301    HD1  PHE  53           HD1      PHE  53  -0.588   9.777   6.852
 1302    HD2  PHE  53           HD2      PHE  53  -1.766   9.773  10.937
 1303    HE1  PHE  53           HE1      PHE  53  -0.032  12.167   7.006
 1304    HE2  PHE  53           HE2      PHE  53  -1.211  12.162  11.105
 1305    HZ   PHE  53           HZ       PHE  53  -0.346  13.364   9.138
 1306    H    PHE  54           H        PHE  54  -3.134   6.432   6.074
 1307    HA   PHE  54           HA       PHE  54  -4.408   4.252   7.465
 1308    HB2  PHE  54           HB3      PHE  54  -4.434   3.224   5.125
 1309    HB3  PHE  54           HB2      PHE  54  -5.356   4.704   5.346
 1310    HD1  PHE  54           HD1      PHE  54  -2.610   3.115   3.605
 1311    HD2  PHE  54           HD2      PHE  54  -4.479   6.845   4.456
 1312    HE1  PHE  54           HE1      PHE  54  -1.421   4.139   1.714
 1313    HE2  PHE  54           HE2      PHE  54  -3.290   7.874   2.566
 1314    HZ   PHE  54           HZ       PHE  54  -1.760   6.522   1.193
 1315    H    GLU  55           H        GLU  55  -3.147   2.996   8.636
 1316    HA   GLU  55           HA       GLU  55  -0.662   1.998   7.403
 1317    HB2  GLU  55           HB3      GLU  55  -1.311   2.109  10.362
 1318    HB3  GLU  55           HB2      GLU  55   0.215   1.615   9.640
 1319    HG2  GLU  55           HG3      GLU  55   0.279   4.002   8.662
 1320    HG3  GLU  55           HG2      GLU  55  -0.966   4.363   9.860
 1321    H    THR  56           H        THR  56  -0.979   0.054   6.603
 1322    HA   THR  56           HA       THR  56  -2.802  -1.770   8.009
 1323    HB   THR  56           HB       THR  56  -1.741  -2.055   5.191
 1324    HG1  THR  56           HG1      THR  56  -3.171  -0.571   4.740
 1325   HG21  THR  56          HG21      THR  56  -2.454  -4.159   6.234
 1326   HG22  THR  56          HG22      THR  56  -3.561  -3.683   4.946
 1327   HG23  THR  56          HG23      THR  56  -4.013  -3.439   6.633
 1328    H    LYS  57           H        LYS  57  -1.723  -2.927   9.433
 1329    HA   LYS  57           HA       LYS  57   1.013  -3.799   8.799
 1330    HB2  LYS  57           HB3      LYS  57  -0.407  -3.758  11.475
 1331    HB3  LYS  57           HB2      LYS  57   1.292  -4.120  11.204
 1332    HG2  LYS  57           HG3      LYS  57   1.631  -1.824  10.394
 1333    HG3  LYS  57           HG2      LYS  57  -0.060  -1.467  10.747
 1334    HD2  LYS  57           HD3      LYS  57   1.186  -0.678  12.598
 1335    HD3  LYS  57           HD2      LYS  57   0.423  -2.179  13.121
 1336    HE2  LYS  57           HE3      LYS  57   2.673  -2.204  13.892
 1337    HE3  LYS  57           HE2      LYS  57   2.550  -3.355  12.568
 1338    HZ1  LYS  57           HZ1      LYS  57   3.426  -1.542  11.099
 1339    HZ2  LYS  57           HZ2      LYS  57   4.521  -2.123  12.250
 1340    HZ3  LYS  57           HZ3      LYS  57   3.744  -0.644  12.500
 1341    H    CYS  58           H        CYS  58   1.544  -6.009   9.851
 1342    HA   CYS  58           HA       CYS  58  -0.659  -7.809   9.122
 1343    HB2  CYS  58           HB3      CYS  58   1.703  -7.774   7.921
 1344    HB3  CYS  58           HB2      CYS  58   2.152  -8.786   9.287
 1345    H    ARG  59           H        ARG  59  -1.666  -8.606  10.806
 1346    HA   ARG  59           HA       ARG  59  -0.605  -8.615  13.439
 1347    HB2  ARG  59           HB3      ARG  59  -3.058  -9.874  12.215
 1348    HB3  ARG  59           HB2      ARG  59  -2.669 -10.033  13.919
 1349    HG2  ARG  59           HG3      ARG  59  -2.813  -7.632  14.205
 1350    HG3  ARG  59           HG2      ARG  59  -3.118  -7.428  12.481
 1351    HD2  ARG  59           HD3      ARG  59  -5.193  -8.641  12.660
 1352    HD3  ARG  59           HD2      ARG  59  -4.881  -8.998  14.355
 1353    HE   ARG  59           HE       ARG  59  -4.887  -6.383  14.479
 1354   HH11  ARG  59          HH11      ARG  59  -7.002  -8.439  12.595
 1355   HH12  ARG  59          HH12      ARG  59  -8.364  -7.373  12.716
 1356   HH21  ARG  59          HH21      ARG  59  -6.684  -4.968  14.645
 1357   HH22  ARG  59          HH22      ARG  59  -8.181  -5.393  13.880
 1358    H    ALA  60           H        ALA  60  -0.994 -11.053  10.937
 1359    HA   ALA  60           HA       ALA  60   0.616 -12.885  12.589
 1360    HB1  ALA  60           HB1      ALA  60  -1.700 -13.688  12.332
 1361    HB2  ALA  60           HB2      ALA  60  -0.531 -14.765  11.567
 1362    HB3  ALA  60           HB3      ALA  60  -1.497 -13.669  10.579
 1363    H    SER  61           H        SER  61   2.608 -12.701  11.790
 1364    HA   SER  61           HA       SER  61   3.185 -12.226   9.046
 1365    HB2  SER  61           HB3      SER  61   5.559 -12.870   9.846
 1366    HB3  SER  61           HB2      SER  61   4.809 -11.436  10.554
 1367    HG   SER  61           HG       SER  61   5.759 -13.503  11.839
 1368    H    ASN  62           H        ASN  62   2.787 -15.028  11.037
 1369    HA   ASN  62           HA       ASN  62   2.941 -16.733   8.658
 1370    HB2  ASN  62           HB3      ASN  62   4.319 -17.282  11.300
 1371    HB3  ASN  62           HB2      ASN  62   3.991 -18.536  10.113
 1372   HD21  ASN  62          HD21      ASN  62   4.560 -16.952   7.794
 1373   HD22  ASN  62          HD22      ASN  62   6.267 -16.703   7.766
 1374    HA   PRO  63           HA       PRO  63  -1.014 -17.161  11.167
 1375    HB2  PRO  63           HB3      PRO  63  -2.440 -17.784   8.848
 1376    HB3  PRO  63           HB2      PRO  63  -2.374 -16.195   9.622
 1377    HG2  PRO  63           HG3      PRO  63  -0.851 -17.239   7.280
 1378    HG3  PRO  63           HG2      PRO  63  -1.478 -15.609   7.576
 1379    HD2  PRO  63           HD3      PRO  63   1.138 -16.182   7.858
 1380    HD3  PRO  63           HD2      PRO  63   0.319 -15.024   8.938
 1381    H    VAL  64           H        VAL  64   0.309 -19.098   8.516
 1382    HA   VAL  64           HA       VAL  64  -0.517 -21.516   9.988
 1383    HB   VAL  64           HB       VAL  64  -0.487 -22.735   7.841
 1384   HG11  VAL  64          HG11      VAL  64  -2.286 -20.318   7.835
 1385   HG12  VAL  64          HG12      VAL  64  -2.601 -21.851   8.647
 1386   HG13  VAL  64          HG13      VAL  64  -2.535 -21.783   6.885
 1387   HG21  VAL  64          HG21      VAL  64  -0.062 -20.024   6.597
 1388   HG22  VAL  64          HG22      VAL  64  -0.397 -21.520   5.725
 1389   HG23  VAL  64          HG23      VAL  64   1.104 -21.346   6.632
 1390    H    GLU  65           H        GLU  65   1.001 -23.384   9.647
 1391    HA   GLU  65           HA       GLU  65   3.674 -22.491  10.212
 1392    HB2  GLU  65           HB3      GLU  65   2.535 -25.277   9.958
 1393    HB3  GLU  65           HB2      GLU  65   4.154 -24.904  10.525
 1394    HG2  GLU  65           HG3      GLU  65   3.209 -23.678  12.412
 1395    HG3  GLU  65           HG2      GLU  65   1.585 -24.055  11.842
 1396    H    SER  66           H        SER  66   3.274 -21.609   7.805
 1397    HA   SER  66           HA       SER  66   5.225 -22.931   6.173
 1398    HB2  SER  66           HB3      SER  66   2.406 -22.672   5.072
 1399    HB3  SER  66           HB2      SER  66   3.813 -23.305   4.216
 1400    HG   SER  66           HG       SER  66   3.619 -24.695   6.435
 1401    H    GLY  67           H        GLY  67   2.979 -20.411   6.884
 1402    HA2  GLY  67           HA3      GLY  67   4.151 -18.152   6.512
 1403    HA3  GLY  67           HA2      GLY  67   4.102 -18.654   4.824
 1404    H    CYS  68           H        CYS  68   2.418 -17.887   3.695
 1405    HA   CYS  68           HA       CYS  68   0.060 -16.985   5.156
 1406    HB2  CYS  68           HB3      CYS  68  -0.588 -15.825   3.186
 1407    HB3  CYS  68           HB2      CYS  68   1.158 -15.614   3.302
 1408    H    ARG  69           H        ARG  69  -2.066 -17.714   4.600
 1409    HA   ARG  69           HA       ARG  69  -2.156 -20.545   4.530
 1410    HB2  ARG  69           HB3      ARG  69  -3.756 -19.186   5.808
 1411    HB3  ARG  69           HB2      ARG  69  -4.411 -18.537   4.308
 1412    HG2  ARG  69           HG3      ARG  69  -4.981 -20.929   3.689
 1413    HG3  ARG  69           HG2      ARG  69  -4.611 -21.342   5.364
 1414    HD2  ARG  69           HD3      ARG  69  -6.993 -20.971   5.112
 1415    HD3  ARG  69           HD2      ARG  69  -6.284 -19.702   6.116
 1416    HE   ARG  69           HE       ARG  69  -6.716 -19.230   3.251
 1417   HH11  ARG  69          HH11      ARG  69  -7.451 -18.466   6.585
 1418   HH12  ARG  69          HH12      ARG  69  -8.258 -16.981   6.201
 1419   HH21  ARG  69          HH21      ARG  69  -7.795 -17.276   2.741
 1420   HH22  ARG  69          HH22      ARG  69  -8.458 -16.308   4.016
 1421    H    GLY  70           H        GLY  70  -2.023 -21.806   2.784
 1422    HA2  GLY  70           HA3      GLY  70  -3.512 -22.402   0.820
 1423    HA3  GLY  70           HA2      GLY  70  -3.137 -20.784   0.246
 1424    H    ILE  71           H        ILE  71  -0.362 -21.030   1.269
 1425    HA   ILE  71           HA       ILE  71   0.800 -21.917  -1.168
 1426    HB   ILE  71           HB       ILE  71   2.110 -21.181   1.455
 1427   HG12  ILE  71          HG13      ILE  71   0.786 -19.348   0.600
 1428   HG13  ILE  71          HG12      ILE  71   2.489 -18.993   0.347
 1429   HG21  ILE  71          HG21      ILE  71   3.625 -22.462   0.065
 1430   HG22  ILE  71          HG22      ILE  71   4.122 -20.770   0.114
 1431   HG23  ILE  71          HG23      ILE  71   3.294 -21.404  -1.308
 1432   HD11  ILE  71          HD11      ILE  71   0.524 -19.936  -1.725
 1433   HD12  ILE  71          HD12      ILE  71   2.247 -19.693  -2.007
 1434   HD13  ILE  71          HD13      ILE  71   1.221 -18.324  -1.579
 1435    H    ASP  72           H        ASP  72   1.991 -23.718  -1.638
 1436    HA   ASP  72           HA       ASP  72   1.610 -26.065  -0.049
 1437    HB2  ASP  72           HB3      ASP  72   1.714 -26.201  -2.498
 1438    HB3  ASP  72           HB2      ASP  72   3.377 -25.621  -2.469
 1439    H    SER  73           H        SER  73   2.822 -26.763   1.543
 1440    HA   SER  73           HA       SER  73   4.941 -25.192   2.558
 1441    HB2  SER  73           HB3      SER  73   4.230 -27.982   3.464
 1442    HB3  SER  73           HB2      SER  73   4.872 -26.647   4.428
 1443    HG   SER  73           HG       SER  73   2.928 -25.735   4.516
 1444    H    LYS  74           H        LYS  74   4.915 -27.835   0.362
 1445    HA   LYS  74           HA       LYS  74   7.546 -28.773   1.156
 1446    HB2  LYS  74           HB3      LYS  74   5.806 -30.406   0.565
 1447    HB3  LYS  74           HB2      LYS  74   5.708 -29.719  -1.048
 1448    HG2  LYS  74           HG3      LYS  74   7.997 -30.396  -1.495
 1449    HG3  LYS  74           HG2      LYS  74   8.135 -31.050   0.138
 1450    HD2  LYS  74           HD3      LYS  74   7.692 -32.817  -1.485
 1451    HD3  LYS  74           HD2      LYS  74   6.351 -32.643  -0.355
 1452    HE2  LYS  74           HE3      LYS  74   5.091 -31.393  -1.991
 1453    HE3  LYS  74           HE2      LYS  74   6.444 -31.444  -3.116
 1454    HZ1  LYS  74           HZ1      LYS  74   4.775 -33.098  -3.661
 1455    HZ2  LYS  74           HZ2      LYS  74   4.925 -33.796  -2.129
 1456    HZ3  LYS  74           HZ3      LYS  74   6.224 -33.846  -3.211
 1457    H    HIS  75           H        HIS  75   6.000 -27.185  -1.604
 1458    HA   HIS  75           HA       HIS  75   8.539 -27.100  -3.032
 1459    HB2  HIS  75           HB3      HIS  75   5.768 -26.161  -3.793
 1460    HB3  HIS  75           HB2      HIS  75   7.181 -25.967  -4.823
 1461    HD1  HIS  75           HD1      HIS  75   8.189 -28.136  -5.872
 1462    HD2  HIS  75           HD2      HIS  75   4.661 -28.704  -3.754
 1463    HE1  HIS  75           HE1      HIS  75   7.370 -30.418  -6.532
 1464    HE2  HIS  75           HE2      HIS  75   5.128 -30.642  -5.402
 1465    H    TRP  76           H        TRP  76   6.582 -25.003  -1.078
 1466    HA   TRP  76           HA       TRP  76   8.412 -22.793  -1.706
 1467    HB2  TRP  76           HB3      TRP  76   5.398 -22.603  -1.488
 1468    HB3  TRP  76           HB2      TRP  76   6.480 -21.213  -1.547
 1469    HD1  TRP  76           HD1      TRP  76   4.596 -23.572  -3.729
 1470    HE1  TRP  76           HE1      TRP  76   5.105 -23.080  -6.204
 1471    HE3  TRP  76           HE3      TRP  76   8.587 -20.428  -3.133
 1472    HZ2  TRP  76           HZ2      TRP  76   6.950 -21.564  -7.700
 1473    HZ3  TRP  76           HZ3      TRP  76   9.664 -19.502  -5.140
 1474    HH2  TRP  76           HH2      TRP  76   8.863 -20.060  -7.375
 1475    H    ASN  77           H        ASN  77   8.755 -21.309  -0.064
 1476    HA   ASN  77           HA       ASN  77   7.441 -21.850   2.516
 1477    HB2  ASN  77           HB3      ASN  77   9.893 -22.332   2.587
 1478    HB3  ASN  77           HB2      ASN  77  10.203 -20.672   2.099
 1479   HD21  ASN  77          HD21      ASN  77   7.739 -21.798   4.369
 1480   HD22  ASN  77          HD22      ASN  77   8.401 -20.982   5.746
 1481    H    SER  78           H        SER  78   6.493 -20.105   3.489
 1482    HA   SER  78           HA       SER  78   6.462 -17.675   1.834
 1483    HB2  SER  78           HB3      SER  78   4.443 -18.823   1.365
 1484    HB3  SER  78           HB2      SER  78   4.175 -19.219   3.059
 1485    HG   SER  78           HG       SER  78   3.424 -17.032   1.664
 1486    H    TYR  79           H        TYR  79   5.809 -15.735   2.894
 1487    HA   TYR  79           HA       TYR  79   5.690 -15.651   5.769
 1488    HB2  TYR  79           HB3      TYR  79   8.140 -15.682   5.325
 1489    HB3  TYR  79           HB2      TYR  79   7.956 -14.245   4.319
 1490    HD1  TYR  79           HD1      TYR  79   7.830 -12.080   5.293
 1491    HD2  TYR  79           HD2      TYR  79   7.716 -15.529   7.779
 1492    HE1  TYR  79           HE1      TYR  79   8.133 -10.656   7.273
 1493    HE2  TYR  79           HE2      TYR  79   8.017 -14.113   9.765
 1494    HH   TYR  79           HH       TYR  79   7.731 -10.700   9.642
 1495    H    CYS  80           H        CYS  80   4.503 -13.923   6.425
 1496    HA   CYS  80           HA       CYS  80   3.422 -12.229   4.320
 1497    HB2  CYS  80           HB3      CYS  80   2.627 -12.481   7.232
 1498    HB3  CYS  80           HB2      CYS  80   1.739 -11.598   5.988
 1499    H    THR  81           H        THR  81   4.402 -10.387   3.880
 1500    HA   THR  81           HA       THR  81   5.971  -9.079   6.011
 1501    HB   THR  81           HB       THR  81   6.466  -8.933   3.026
 1502    HG1  THR  81           HG1      THR  81   6.927 -11.019   3.677
 1503   HG21  THR  81          HG21      THR  81   8.183  -8.112   5.375
 1504   HG22  THR  81          HG22      THR  81   7.338  -7.020   4.278
 1505   HG23  THR  81          HG23      THR  81   8.650  -8.032   3.676
 1506    H    THR  82           H        THR  82   5.557  -6.971   6.467
 1507    HA   THR  82           HA       THR  82   3.389  -5.642   5.125
 1508    HB   THR  82           HB       THR  82   4.307  -3.734   6.744
 1509    HG1  THR  82           HG1      THR  82   5.035  -5.048   8.684
 1510   HG21  THR  82          HG21      THR  82   2.775  -6.180   7.609
 1511   HG22  THR  82          HG22      THR  82   2.101  -4.723   6.880
 1512   HG23  THR  82          HG23      THR  82   2.824  -4.655   8.488
 1513    H    THR  83           H        THR  83   3.591  -4.442   3.380
 1514    HA   THR  83           HA       THR  83   6.131  -3.419   2.494
 1515    HB   THR  83           HB       THR  83   4.631  -2.251   0.758
 1516    HG1  THR  83           HG1      THR  83   2.650  -4.101   1.498
 1517   HG21  THR  83          HG21      THR  83   4.276  -4.329  -0.499
 1518   HG22  THR  83          HG22      THR  83   4.554  -5.265   0.970
 1519   HG23  THR  83          HG23      THR  83   5.862  -4.307   0.273
 1520    H    HIS  84           H        HIS  84   6.521  -1.106   2.138
 1521    HA   HIS  84           HA       HIS  84   4.940   0.617   3.907
 1522    HB2  HIS  84           HB3      HIS  84   7.085   1.776   4.590
 1523    HB3  HIS  84           HB2      HIS  84   6.852   0.165   5.250
 1524    HD1  HIS  84           HD1      HIS  84   8.738  -1.418   4.969
 1525    HD2  HIS  84           HD2      HIS  84   8.997   1.793   2.338
 1526    HE1  HIS  84           HE1      HIS  84  10.955  -1.662   3.818
 1527    HE2  HIS  84           HE2      HIS  84  11.163   0.384   2.366
 1528    H    THR  85           H        THR  85   4.464   2.573   3.138
 1529    HA   THR  85           HA       THR  85   5.716   3.339   0.580
 1530    HB   THR  85           HB       THR  85   3.347   2.530   0.328
 1531    HG1  THR  85           HG1      THR  85   2.902   4.124  -1.122
 1532   HG21  THR  85          HG21      THR  85   1.527   3.985   1.094
 1533   HG22  THR  85          HG22      THR  85   2.695   5.017   1.920
 1534   HG23  THR  85          HG23      THR  85   2.452   3.355   2.457
 1535    H    PHE  86           H        PHE  86   5.290   5.775   0.148
 1536    HA   PHE  86           HA       PHE  86   5.919   7.177   2.659
 1537    HB2  PHE  86           HB3      PHE  86   7.003   7.732  -0.119
 1538    HB3  PHE  86           HB2      PHE  86   7.359   8.682   1.323
 1539    HD1  PHE  86           HD1      PHE  86   8.665   7.670   3.173
 1540    HD2  PHE  86           HD2      PHE  86   8.135   5.705  -0.563
 1541    HE1  PHE  86           HE1      PHE  86  10.556   6.189   3.691
 1542    HE2  PHE  86           HE2      PHE  86  10.027   4.216  -0.052
 1543    HZ   PHE  86           HZ       PHE  86  11.239   4.456   2.076
 1544    H    VAL  87           H        VAL  87   4.450   8.591   3.234
 1545    HA   VAL  87           HA       VAL  87   2.752   9.804   1.150
 1546    HB   VAL  87           HB       VAL  87   1.080  10.168   2.975
 1547   HG11  VAL  87          HG11      VAL  87   0.835   8.301   1.455
 1548   HG12  VAL  87          HG12      VAL  87   0.327   7.832   3.078
 1549   HG13  VAL  87          HG13      VAL  87   1.895   7.314   2.462
 1550   HG21  VAL  87          HG21      VAL  87   2.601  10.073   4.888
 1551   HG22  VAL  87          HG22      VAL  87   2.897   8.363   4.571
 1552   HG23  VAL  87          HG23      VAL  87   1.291   8.906   5.051
 1553    H    LYS  88           H        LYS  88   2.371  12.009   1.185
 1554    HA   LYS  88           HA       LYS  88   4.346  13.598   2.535
 1555    HB2  LYS  88           HB3      LYS  88   3.293  15.532   1.399
 1556    HB3  LYS  88           HB2      LYS  88   3.749  14.251   0.288
 1557    HG2  LYS  88           HG3      LYS  88   1.579  13.759  -0.247
 1558    HG3  LYS  88           HG2      LYS  88   0.956  14.310   1.307
 1559    HD2  LYS  88           HD3      LYS  88   1.285  16.605   0.688
 1560    HD3  LYS  88           HD2      LYS  88   2.082  16.134  -0.809
 1561    HE2  LYS  88           HE3      LYS  88  -0.765  15.417  -0.150
 1562    HE3  LYS  88           HE2      LYS  88  -0.314  16.879  -1.024
 1563    HZ1  LYS  88           HZ1      LYS  88   0.633  15.569  -2.766
 1564    HZ2  LYS  88           HZ2      LYS  88  -0.945  15.017  -2.484
 1565    HZ3  LYS  88           HZ3      LYS  88   0.376  14.132  -1.907
 1566    H    ALA  89           H        ALA  89   4.164  14.090   4.564
 1567    HA   ALA  89           HA       ALA  89   1.559  15.027   5.571
 1568    HB1  ALA  89           HB1      ALA  89   2.003  12.775   6.447
 1569    HB2  ALA  89           HB2      ALA  89   2.027  13.990   7.727
 1570    HB3  ALA  89           HB3      ALA  89   3.542  13.340   7.101
 1571    H    LEU  90           H        LEU  90   1.663  16.739   7.060
 1572    HA   LEU  90           HA       LEU  90   4.046  18.336   6.969
 1573    HB2  LEU  90           HB3      LEU  90   1.685  19.255   7.078
 1574    HB3  LEU  90           HB2      LEU  90   1.629  18.712   8.749
 1575    HG   LEU  90           HG       LEU  90   3.678  20.189   9.140
 1576   HD11  LEU  90          HD11      LEU  90   2.784  21.279   6.479
 1577   HD12  LEU  90          HD12      LEU  90   4.341  20.537   6.848
 1578   HD13  LEU  90          HD13      LEU  90   3.905  22.080   7.579
 1579   HD21  LEU  90          HD21      LEU  90   1.053  21.471   8.396
 1580   HD22  LEU  90          HD22      LEU  90   2.306  22.195   9.405
 1581   HD23  LEU  90          HD23      LEU  90   1.454  20.752   9.955
 1582    H    THR  91           H        THR  91   5.756  17.733   8.127
 1583    HA   THR  91           HA       THR  91   5.287  16.645  10.824
 1584    HB   THR  91           HB       THR  91   7.160  15.114  10.531
 1585    HG1  THR  91           HG1      THR  91   7.311  16.276   7.934
 1586   HG21  THR  91          HG21      THR  91   4.949  14.302   9.831
 1587   HG22  THR  91          HG22      THR  91   6.232  13.597   8.852
 1588   HG23  THR  91          HG23      THR  91   5.245  14.906   8.204
 1589    H    THR  92           H        THR  92   7.087  16.975  12.312
 1590    HA   THR  92           HA       THR  92   8.856  19.160  11.471
 1591    HB   THR  92           HB       THR  92   7.153  20.105  12.930
 1592    HG1  THR  92           HG1      THR  92   9.211  20.979  13.148
 1593   HG21  THR  92          HG21      THR  92   6.925  19.425  15.260
 1594   HG22  THR  92          HG22      THR  92   8.098  18.134  15.013
 1595   HG23  THR  92          HG23      THR  92   6.543  18.084  14.181
 1596    H    ASP  93           H        ASP  93  10.931  18.736  11.674
 1597    HA   ASP  93           HA       ASP  93  11.779  16.285  12.911
 1598    HB2  ASP  93           HB3      ASP  93  14.045  16.950  12.132
 1599    HB3  ASP  93           HB2      ASP  93  12.845  16.947  10.845
 1600    H    GLU  94           H        GLU  94  11.493  19.559  13.891
 1601    HA   GLU  94           HA       GLU  94  12.095  18.800  16.555
 1602    HB2  GLU  94           HB3      GLU  94  13.895  20.482  16.966
 1603    HB3  GLU  94           HB2      GLU  94  14.388  19.106  15.998
 1604    HG2  GLU  94           HG3      GLU  94  14.196  20.488  13.981
 1605    HG3  GLU  94           HG2      GLU  94  13.740  21.861  14.985
 1606    H    LYS  95           H        LYS  95  11.954  21.784  14.553
 1607    HA   LYS  95           HA       LYS  95   9.926  22.755  16.454
 1608    HB2  LYS  95           HB3      LYS  95  12.165  24.364  15.226
 1609    HB3  LYS  95           HB2      LYS  95  10.854  25.038  16.178
 1610    HG2  LYS  95           HG3      LYS  95  11.599  23.672  18.094
 1611    HG3  LYS  95           HG2      LYS  95  12.957  23.104  17.121
 1612    HD2  LYS  95           HD3      LYS  95  13.688  25.455  16.860
 1613    HD3  LYS  95           HD2      LYS  95  12.383  25.945  17.938
 1614    HE2  LYS  95           HE3      LYS  95  13.331  24.540  19.708
 1615    HE3  LYS  95           HE2      LYS  95  14.649  24.090  18.633
 1616    HZ1  LYS  95           HZ1      LYS  95  15.314  26.414  18.541
 1617    HZ2  LYS  95           HZ2      LYS  95  15.322  25.842  20.131
 1618    HZ3  LYS  95           HZ3      LYS  95  14.062  26.832  19.596
 1619    H    GLN  96           H        GLN  96  11.301  23.295  13.211
 1620    HA   GLN  96           HA       GLN  96   8.961  24.723  12.334
 1621    HB2  GLN  96           HB3      GLN  96  11.205  25.258  11.460
 1622    HB3  GLN  96           HB2      GLN  96  11.312  23.655  10.755
 1623    HG2  GLN  96           HG3      GLN  96  10.755  25.320   9.085
 1624    HG3  GLN  96           HG2      GLN  96   9.444  24.159   9.284
 1625   HE21  GLN  96          HE21      GLN  96   7.897  25.550   8.477
 1626   HE22  GLN  96          HE22      GLN  96   7.339  26.933   9.353
 1627    H    ALA  97           H        ALA  97   7.240  23.960  11.236
 1628    HA   ALA  97           HA       ALA  97   7.077  21.082  10.770
 1629    HB1  ALA  97           HB1      ALA  97   4.940  23.200  10.534
 1630    HB2  ALA  97           HB2      ALA  97   5.219  22.175  11.940
 1631    HB3  ALA  97           HB3      ALA  97   4.695  21.459  10.418
 1632    H    ALA  98           H        ALA  98   7.167  20.184   8.794
 1633    HA   ALA  98           HA       ALA  98   6.879  21.868   6.420
 1634    HB1  ALA  98           HB1      ALA  98   9.322  20.191   6.993
 1635    HB2  ALA  98           HB2      ALA  98   9.255  21.952   6.971
 1636    HB3  ALA  98           HB3      ALA  98   8.990  21.042   5.486
 1637    H    TRP  99           H        TRP  99   6.504  20.684   4.492
 1638    HA   TRP  99           HA       TRP  99   5.059  18.239   4.898
 1639    HB2  TRP  99           HB3      TRP  99   5.768  19.765   2.382
 1640    HB3  TRP  99           HB2      TRP  99   4.752  18.331   2.410
 1641    HD1  TRP  99           HD1      TRP  99   4.726  22.033   3.362
 1642    HE1  TRP  99           HE1      TRP  99   2.294  22.754   3.801
 1643    HE3  TRP  99           HE3      TRP  99   2.478  17.455   3.142
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.247  21.537   4.019
 1645    HZ3  TRP  99           HZ3      TRP  99   0.043  17.317   3.473
 1646    HH2  TRP  99           HH2      TRP  99  -1.289  19.316   3.903
 1647    H    ARG 100           H        ARG 100   6.074  16.391   5.192
 1648    HA   ARG 100           HA       ARG 100   8.468  15.808   3.571
 1649    HB2  ARG 100           HB3      ARG 100   7.906  14.960   6.425
 1650    HB3  ARG 100           HB2      ARG 100   9.316  14.492   5.487
 1651    HG2  ARG 100           HG3      ARG 100   8.644  17.347   6.153
 1652    HG3  ARG 100           HG2      ARG 100   9.675  16.323   7.155
 1653    HD2  ARG 100           HD3      ARG 100  10.178  17.011   4.260
 1654    HD3  ARG 100           HD2      ARG 100  10.968  17.765   5.641
 1655    HE   ARG 100           HE       ARG 100  11.228  14.880   5.037
 1656   HH11  ARG 100          HH11      ARG 100  12.611  17.968   5.960
 1657   HH12  ARG 100          HH12      ARG 100  14.211  17.337   6.165
 1658   HH21  ARG 100          HH21      ARG 100  13.349  14.048   5.265
 1659   HH22  ARG 100          HH22      ARG 100  14.633  15.111   5.768
 1660    H    PHE 101           H        PHE 101   8.795  13.581   3.067
 1661    HA   PHE 101           HA       PHE 101   6.293  12.086   2.834
 1662    HB2  PHE 101           HB3      PHE 101   9.017  11.666   1.571
 1663    HB3  PHE 101           HB2      PHE 101   7.648  10.592   1.330
 1664    HD1  PHE 101           HD1      PHE 101   8.987  13.948   0.647
 1665    HD2  PHE 101           HD2      PHE 101   5.862  11.165  -0.125
 1666    HE1  PHE 101           HE1      PHE 101   8.234  15.326  -1.244
 1667    HE2  PHE 101           HE2      PHE 101   5.102  12.540  -2.017
 1668    HZ   PHE 101           HZ       PHE 101   6.290  14.620  -2.578
 1669    H    ILE 102           H        ILE 102   5.830  10.670   4.393
 1670    HA   ILE 102           HA       ILE 102   8.085   9.443   5.855
 1671    HB   ILE 102           HB       ILE 102   6.493   9.133   7.749
 1672   HG12  ILE 102          HG13      ILE 102   4.709  11.019   6.202
 1673   HG13  ILE 102          HG12      ILE 102   4.415   9.295   6.369
 1674   HG21  ILE 102          HG21      ILE 102   6.556  11.461   8.499
 1675   HG22  ILE 102          HG22      ILE 102   6.932  11.975   6.855
 1676   HG23  ILE 102          HG23      ILE 102   8.074  10.970   7.749
 1677   HD11  ILE 102          HD11      ILE 102   3.051  10.538   7.918
 1678   HD12  ILE 102          HD12      ILE 102   4.483  11.316   8.595
 1679   HD13  ILE 102          HD13      ILE 102   4.243   9.581   8.799
 1680    H    ARG 103           H        ARG 103   7.965   7.264   6.417
 1681    HA   ARG 103           HA       ARG 103   6.445   5.723   4.478
 1682    HB2  ARG 103           HB3      ARG 103   7.842   3.824   5.146
 1683    HB3  ARG 103           HB2      ARG 103   8.824   5.219   4.726
 1684    HG2  ARG 103           HG3      ARG 103   9.203   5.689   7.075
 1685    HG3  ARG 103           HG2      ARG 103   8.152   4.351   7.529
 1686    HD2  ARG 103           HD3      ARG 103   9.689   2.799   6.353
 1687    HD3  ARG 103           HD2      ARG 103  10.763   4.161   6.028
 1688    HE   ARG 103           HE       ARG 103  10.239   4.012   8.794
 1689   HH11  ARG 103          HH11      ARG 103  11.964   2.298   6.279
 1690   HH12  ARG 103          HH12      ARG 103  13.181   1.690   7.352
 1691   HH21  ARG 103          HH21      ARG 103  11.847   3.227  10.207
 1692   HH22  ARG 103          HH22      ARG 103  13.121   2.224   9.590
 1693    H    ILE 104           H        ILE 104   4.720   4.596   4.874
 1694    HA   ILE 104           HA       ILE 104   4.078   3.817   7.641
 1695    HB   ILE 104           HB       ILE 104   1.663   4.112   7.070
 1696   HG12  ILE 104          HG13      ILE 104   2.732   5.599   4.664
 1697   HG13  ILE 104          HG12      ILE 104   1.934   4.034   4.608
 1698   HG21  ILE 104          HG21      ILE 104   2.816   5.796   8.381
 1699   HG22  ILE 104          HG22      ILE 104   1.637   6.554   7.308
 1700   HG23  ILE 104          HG23      ILE 104   3.353   6.602   6.907
 1701   HD11  ILE 104          HD11      ILE 104  -0.114   5.038   5.441
 1702   HD12  ILE 104          HD12      ILE 104   0.441   5.847   3.974
 1703   HD13  ILE 104          HD13      ILE 104   0.691   6.604   5.548
 1704    H    ASP 105           H        ASP 105   2.825   1.877   7.831
 1705    HA   ASP 105           HA       ASP 105   3.538  -0.163   5.997
 1706    HB2  ASP 105           HB3      ASP 105   1.536  -0.121   8.271
 1707    HB3  ASP 105           HB2      ASP 105   1.873  -1.563   7.310
 1708    H    THR 106           H        THR 106   2.603  -0.796   4.204
 1709    HA   THR 106           HA       THR 106   0.241   0.677   3.329
 1710    HB   THR 106           HB       THR 106   1.922  -1.112   1.589
 1711    HG1  THR 106           HG1      THR 106   2.790   0.986   3.018
 1712   HG21  THR 106          HG21      THR 106  -0.135  -0.097   0.669
 1713   HG22  THR 106          HG22      THR 106   1.318   0.499  -0.131
 1714   HG23  THR 106          HG23      THR 106   0.496   1.502   1.065
 1715    H    ALA 107           H        ALA 107   1.478  -2.667   3.115
 1716    HA   ALA 107           HA       ALA 107  -1.065  -3.782   3.813
 1717    HB1  ALA 107           HB1      ALA 107  -1.475  -4.958   1.713
 1718    HB2  ALA 107           HB2      ALA 107  -0.090  -4.149   0.980
 1719    HB3  ALA 107           HB3      ALA 107  -1.501  -3.211   1.468
 1720    H    CYS 108           H        CYS 108  -0.967  -6.122   3.987
 1721    HA   CYS 108           HA       CYS 108   1.776  -7.065   4.371
 1722    HB2  CYS 108           HB3      CYS 108   0.264  -7.362   6.288
 1723    HB3  CYS 108           HB2      CYS 108  -0.850  -8.288   5.277
 1724    H    VAL 109           H        VAL 109   2.697  -8.279   2.889
 1725    HA   VAL 109           HA       VAL 109   0.987  -9.520   0.842
 1726    HB   VAL 109           HB       VAL 109   2.862  -9.360  -0.690
 1727   HG11  VAL 109          HG11      VAL 109   1.417  -7.417  -0.528
 1728   HG12  VAL 109          HG12      VAL 109   3.077  -6.922  -0.853
 1729   HG13  VAL 109          HG13      VAL 109   2.412  -6.762   0.773
 1730   HG21  VAL 109          HG21      VAL 109   4.697  -9.739   0.867
 1731   HG22  VAL 109          HG22      VAL 109   4.408  -8.164   1.610
 1732   HG23  VAL 109          HG23      VAL 109   4.965  -8.262  -0.060
 1733    H    CYS 110           H        CYS 110   1.507 -11.595   0.073
 1734    HA   CYS 110           HA       CYS 110   2.956 -13.270   1.981
 1735    HB2  CYS 110           HB3      CYS 110   0.749 -14.087   1.387
 1736    HB3  CYS 110           HB2      CYS 110   1.119 -13.970  -0.327
 1737    H    VAL 111           H        VAL 111   5.077 -13.435   1.603
 1738    HA   VAL 111           HA       VAL 111   6.051 -13.301  -1.153
 1739    HB   VAL 111           HB       VAL 111   8.264 -13.050  -0.240
 1740   HG11  VAL 111          HG11      VAL 111   7.018 -11.019  -0.313
 1741   HG12  VAL 111          HG12      VAL 111   7.954 -11.030   1.181
 1742   HG13  VAL 111          HG13      VAL 111   6.229 -11.385   1.222
 1743   HG21  VAL 111          HG21      VAL 111   8.748 -13.104   2.140
 1744   HG22  VAL 111          HG22      VAL 111   8.099 -14.653   1.597
 1745   HG23  VAL 111          HG23      VAL 111   7.070 -13.527   2.482
 1746    H    LEU 112           H        LEU 112   7.528 -14.918  -1.983
 1747    HA   LEU 112           HA       LEU 112   7.228 -17.528  -0.666
 1748    HB2  LEU 112           HB3      LEU 112   6.951 -16.930  -3.613
 1749    HB3  LEU 112           HB2      LEU 112   7.071 -18.546  -2.945
 1750    HG   LEU 112           HG       LEU 112   4.826 -16.572  -2.510
 1751   HD11  LEU 112          HD11      LEU 112   4.951 -19.245  -3.900
 1752   HD12  LEU 112          HD12      LEU 112   4.752 -17.668  -4.667
 1753   HD13  LEU 112          HD13      LEU 112   3.484 -18.307  -3.618
 1754   HD21  LEU 112          HD21      LEU 112   5.270 -19.298  -1.303
 1755   HD22  LEU 112          HD22      LEU 112   3.752 -18.405  -1.245
 1756   HD23  LEU 112          HD23      LEU 112   5.183 -17.758  -0.448
 1757    H    SER 113           H        SER 113   8.956 -18.776  -0.572
 1758    HA   SER 113           HA       SER 113  11.262 -18.161  -2.291
 1759    HB2  SER 113           HB3      SER 113  12.669 -19.043  -0.346
 1760    HB3  SER 113           HB2      SER 113  11.931 -17.459  -0.104
 1761    HG   SER 113           HG       SER 113  10.186 -18.658   0.973
 1762    H    ARG 114           H        ARG 114  12.345 -20.004  -3.123
 1763    HA   ARG 114           HA       ARG 114  10.533 -22.232  -3.373
 1764    HB2  ARG 114           HB3      ARG 114  12.082 -23.043  -5.119
 1765    HB3  ARG 114           HB2      ARG 114  11.517 -21.406  -5.393
 1766    HG2  ARG 114           HG3      ARG 114  13.739 -21.242  -5.944
 1767    HG3  ARG 114           HG2      ARG 114  13.756 -20.726  -4.259
 1768    HD2  ARG 114           HD3      ARG 114  14.466 -22.931  -3.558
 1769    HD3  ARG 114           HD2      ARG 114  14.352 -23.523  -5.214
 1770    HE   ARG 114           HE       ARG 114  16.100 -21.337  -5.177
 1771   HH11  ARG 114          HH11      ARG 114  15.924 -24.618  -3.979
 1772   HH12  ARG 114          HH12      ARG 114  17.642 -24.856  -4.013
 1773   HH21  ARG 114          HH21      ARG 114  18.359 -21.644  -5.218
 1774   HH22  ARG 114          HH22      ARG 114  19.033 -23.156  -4.691
 1775    H    LYS 115           H        LYS 115  12.599 -21.591  -1.048
 1776    HA   LYS 115           HA       LYS 115  13.362 -22.814   0.697
 1777    HB2  LYS 115           HB3      LYS 115  12.166 -25.175  -0.776
 1778    HB3  LYS 115           HB2      LYS 115  12.768 -25.218   0.874
 1779    HG2  LYS 115           HG3      LYS 115  11.060 -23.597   1.538
 1780    HG3  LYS 115           HG2      LYS 115  10.471 -23.549  -0.129
 1781    HD2  LYS 115           HD3      LYS 115   9.055 -25.014   1.146
 1782    HD3  LYS 115           HD2      LYS 115   9.999 -25.974   0.009
 1783    HE2  LYS 115           HE3      LYS 115  11.556 -26.557   1.795
 1784    HE3  LYS 115           HE2      LYS 115  10.615 -25.597   2.934
 1785    HZ1  LYS 115           HZ1      LYS 115   8.716 -27.070   2.498
 1786    HZ2  LYS 115           HZ2      LYS 115  10.040 -27.905   3.142
 1787    HZ3  LYS 115           HZ3      LYS 115   9.693 -28.020   1.492
 1788    H    ALA 116           H        ALA 116  14.720 -24.974   1.108
 1789    HA   ALA 116           HA       ALA 116  16.665 -26.089   0.869
 1790    HB1  ALA 116           HB1      ALA 116  15.759 -26.839  -1.284
 1791    HB2  ALA 116           HB2      ALA 116  17.512 -26.659  -1.317
 1792    HB3  ALA 116           HB3      ALA 116  16.488 -25.434  -2.063
 1793    H    THR 117           H        THR 117  17.164 -23.609  -1.638
 1794    HA   THR 117           HA       THR 117  19.163 -22.335   0.069
 1795    HB   THR 117           HB       THR 117  20.594 -22.260  -2.170
 1796    HG1  THR 117           HG1      THR 117  19.829 -24.905  -2.461
 1797   HG21  THR 117          HG21      THR 117  21.446 -23.100  -0.066
 1798   HG22  THR 117          HG22      THR 117  21.852 -24.235  -1.351
 1799   HG23  THR 117          HG23      THR 117  20.522 -24.588  -0.251
 1800    H    ARG 118           H        ARG 118  20.072 -20.341  -1.132
 1801    HA   ARG 118           HA       ARG 118  17.830 -19.010  -2.496
 1802    HB2  ARG 118           HB3      ARG 118  19.898 -17.897  -0.592
 1803    HB3  ARG 118           HB2      ARG 118  18.937 -16.868  -1.631
 1804    HG2  ARG 118           HG3      ARG 118  17.954 -16.885   0.536
 1805    HG3  ARG 118           HG2      ARG 118  16.889 -17.763  -0.556
 1806    HD2  ARG 118           HD3      ARG 118  17.089 -18.888   1.609
 1807    HD3  ARG 118           HD2      ARG 118  17.733 -19.885   0.308
 1808    HE   ARG 118           HE       ARG 118  19.746 -18.300   1.585
 1809   HH11  ARG 118          HH11      ARG 118  17.891 -21.262   1.859
 1810   HH12  ARG 118          HH12      ARG 118  19.100 -22.077   2.794
 1811   HH21  ARG 118          HH21      ARG 118  21.328 -19.373   2.827
 1812   HH22  ARG 118          HH22      ARG 118  21.051 -21.004   3.347
  Start of MODEL   13
    1    H1   SER   1           H1       SER   1  23.217  -4.977 -12.711
    2    H2   SER   1           H2       SER   1  22.448  -3.616 -13.352
    3    H3   SER   1           H3       SER   1  22.047  -5.160 -13.915
    4    HA   SER   1           HA       SER   1  21.588  -4.158 -11.175
    5    HB2  SER   1           HB3      SER   1  20.125  -3.130 -12.928
    6    HB3  SER   1           HB2      SER   1  19.585  -4.746 -13.375
    7    HG   SER   1           HG       SER   1  19.334  -3.685 -10.752
    8    H    SER   2           H        SER   2  22.550  -6.027 -10.297
    9    HA   SER   2           HA       SER   2  20.826  -8.392 -10.491
   10    HB2  SER   2           HB3      SER   2  22.917  -9.813 -10.317
   11    HB3  SER   2           HB2      SER   2  22.712  -8.973 -11.855
   12    HG   SER   2           HG       SER   2  24.347  -7.665 -11.393
   13    H    THR   3           H        THR   3  21.716  -6.031  -8.591
   14    HA   THR   3           HA       THR   3  22.499  -7.552  -6.239
   15    HB   THR   3           HB       THR   3  22.362  -5.202  -5.169
   16    HG1  THR   3           HG1      THR   3  22.808  -3.645  -7.060
   17   HG21  THR   3          HG21      THR   3  24.369  -5.765  -7.355
   18   HG22  THR   3          HG22      THR   3  24.468  -6.326  -5.687
   19   HG23  THR   3          HG23      THR   3  24.576  -4.603  -6.046
   20    H    HIS   4           H        HIS   4  20.755  -8.748  -5.629
   21    HA   HIS   4           HA       HIS   4  18.482  -7.225  -4.608
   22    HB2  HIS   4           HB3      HIS   4  16.993  -9.187  -5.380
   23    HB3  HIS   4           HB2      HIS   4  17.483  -7.998  -6.575
   24    HD1  HIS   4           HD1      HIS   4  18.573  -8.869  -8.633
   25    HD2  HIS   4           HD2      HIS   4  18.537 -11.681  -5.571
   26    HE1  HIS   4           HE1      HIS   4  19.408 -11.003  -9.661
   27    HE2  HIS   4           HE2      HIS   4  19.211 -12.725  -7.837
   28    HA   PRO   5           HA       PRO   5  19.791  -9.917  -1.231
   29    HB2  PRO   5           HB3      PRO   5  18.847  -8.381   0.761
   30    HB3  PRO   5           HB2      PRO   5  20.326  -7.953  -0.111
   31    HG2  PRO   5           HG3      PRO   5  17.547  -6.886  -0.446
   32    HG3  PRO   5           HG2      PRO   5  19.085  -6.003  -0.432
   33    HD2  PRO   5           HD3      PRO   5  17.741  -6.699  -2.717
   34    HD3  PRO   5           HD2      PRO   5  19.496  -6.455  -2.643
   35    H    VAL   6           H        VAL   6  17.891 -11.077  -2.501
   36    HA   VAL   6           HA       VAL   6  15.974 -12.303  -2.435
   37    HB   VAL   6           HB       VAL   6  15.954 -11.915   0.555
   38   HG11  VAL   6          HG11      VAL   6  15.082 -14.211   0.555
   39   HG12  VAL   6          HG12      VAL   6  15.135 -14.221  -1.208
   40   HG13  VAL   6          HG13      VAL   6  14.054 -13.113  -0.362
   41   HG21  VAL   6          HG21      VAL   6  18.240 -12.453  -0.094
   42   HG22  VAL   6          HG22      VAL   6  17.661 -13.848  -1.006
   43   HG23  VAL   6          HG23      VAL   6  17.486 -13.806   0.749
   44    H    PHE   7           H        PHE   7  15.775  -9.497  -2.827
   45    HA   PHE   7           HA       PHE   7  14.356  -7.725  -2.830
   46    HB2  PHE   7           HB3      PHE   7  12.378  -9.991  -2.559
   47    HB3  PHE   7           HB2      PHE   7  11.899  -8.323  -2.844
   48    HD1  PHE   7           HD1      PHE   7  13.348 -11.323  -4.307
   49    HD2  PHE   7           HD2      PHE   7  12.401  -7.226  -4.962
   50    HE1  PHE   7           HE1      PHE   7  13.633 -11.648  -6.724
   51    HE2  PHE   7           HE2      PHE   7  12.683  -7.543  -7.384
   52    HZ   PHE   7           HZ       PHE   7  13.299  -9.757  -8.271
   53    H    HIS   8           H        HIS   8  15.552  -8.238  -0.357
   54    HA   HIS   8           HA       HIS   8  15.502  -7.470   1.783
   55    HB2  HIS   8           HB3      HIS   8  14.424  -5.476   0.730
   56    HB3  HIS   8           HB2      HIS   8  12.854  -6.216   0.996
   57    HD1  HIS   8           HD1      HIS   8  11.851  -4.650   2.652
   58    HD2  HIS   8           HD2      HIS   8  15.686  -5.842   3.731
   59    HE1  HIS   8           HE1      HIS   8  12.216  -3.741   4.971
   60    HE2  HIS   8           HE2      HIS   8  14.582  -4.379   5.554
   61    H    MET   9           H        MET   9  13.996  -9.910   0.723
   62    HA   MET   9           HA       MET   9  12.450 -11.469   1.279
   63    HB2  MET   9           HB3      MET   9  12.799 -12.472   3.493
   64    HB3  MET   9           HB2      MET   9  14.312 -12.124   2.679
   65    HG2  MET   9           HG3      MET   9  14.536 -10.088   4.068
   66    HG3  MET   9           HG2      MET   9  13.078 -10.558   4.932
   67    HE1  MET   9           HE1      MET   9  16.782 -11.525   4.065
   68    HE2  MET   9           HE2      MET   9  15.878 -12.948   3.547
   69    HE3  MET   9           HE3      MET   9  16.965 -13.050   4.931
   70    H    GLY  10           H        GLY  10  11.236  -9.077   1.091
   71    HA2  GLY  10           HA3      GLY  10   8.959  -9.411   2.849
   72    HA3  GLY  10           HA2      GLY  10   9.843  -7.914   3.079
   73    H    GLU  11           H        GLU  11  10.575  -7.700   0.262
   74    HA   GLU  11           HA       GLU  11   8.116  -6.438  -0.610
   75    HB2  GLU  11           HB3      GLU  11  10.539  -5.464  -0.701
   76    HB3  GLU  11           HB2      GLU  11  10.690  -6.438  -2.163
   77    HG2  GLU  11           HG3      GLU  11  10.079  -4.190  -2.753
   78    HG3  GLU  11           HG2      GLU  11   8.729  -5.271  -3.104
   79    H    PHE  12           H        PHE  12   7.128  -8.621  -0.869
   80    HA   PHE  12           HA       PHE  12   7.698  -9.669  -3.561
   81    HB2  PHE  12           HB3      PHE  12   7.228 -11.176  -1.010
   82    HB3  PHE  12           HB2      PHE  12   6.772 -11.896  -2.551
   83    HD1  PHE  12           HD1      PHE  12   9.497 -11.025  -0.332
   84    HD2  PHE  12           HD2      PHE  12   8.493 -12.392  -4.233
   85    HE1  PHE  12           HE1      PHE  12  11.799 -11.814  -0.646
   86    HE2  PHE  12           HE2      PHE  12  10.799 -13.184  -4.554
   87    HZ   PHE  12           HZ       PHE  12  12.456 -12.898  -2.757
   88    H    SER  13           H        SER  13   5.868 -10.804  -4.537
   89    HA   SER  13           HA       SER  13   3.250 -10.396  -3.379
   90    HB2  SER  13           HB3      SER  13   3.673  -8.329  -4.736
   91    HB3  SER  13           HB2      SER  13   3.894  -9.347  -6.154
   92    HG   SER  13           HG       SER  13   1.750  -8.513  -5.976
   93    H    VAL  14           H        VAL  14   1.756 -11.915  -4.152
   94    HA   VAL  14           HA       VAL  14   2.997 -14.201  -5.457
   95    HB   VAL  14           HB       VAL  14   0.839 -15.370  -4.902
   96   HG11  VAL  14          HG11      VAL  14   2.789 -15.561  -3.463
   97   HG12  VAL  14          HG12      VAL  14   1.315 -15.516  -2.496
   98   HG13  VAL  14          HG13      VAL  14   2.333 -14.082  -2.621
   99   HG21  VAL  14          HG21      VAL  14  -0.691 -14.333  -3.338
  100   HG22  VAL  14          HG22      VAL  14  -0.584 -13.362  -4.806
  101   HG23  VAL  14          HG23      VAL  14   0.263 -12.851  -3.346
  102    H    CYS  15           H        CYS  15   1.664 -11.530  -6.579
  103    HA   CYS  15           HA       CYS  15   0.863 -12.831  -9.063
  104    HB2  CYS  15           HB3      CYS  15  -1.217 -12.329  -7.736
  105    HB3  CYS  15           HB2      CYS  15  -0.785 -10.619  -7.806
  106    H    ASP  16           H        ASP  16   1.092 -11.445 -10.907
  107    HA   ASP  16           HA       ASP  16   3.383  -9.821 -10.813
  108    HB2  ASP  16           HB3      ASP  16   1.220  -9.996 -12.930
  109    HB3  ASP  16           HB2      ASP  16   2.757  -9.166 -13.146
  110    H    SER  17           H        SER  17   3.584  -7.886  -9.958
  111    HA   SER  17           HA       SER  17   1.307  -6.024 -10.077
  112    HB2  SER  17           HB3      SER  17   3.245  -6.329  -7.763
  113    HB3  SER  17           HB2      SER  17   1.824  -5.279  -7.820
  114    HG   SER  17           HG       SER  17   1.651  -8.096  -8.127
  115    H    VAL  18           H        VAL  18   1.836  -3.814 -10.254
  116    HA   VAL  18           HA       VAL  18   4.686  -3.205 -10.646
  117    HB   VAL  18           HB       VAL  18   3.684  -3.276 -12.843
  118   HG11  VAL  18          HG11      VAL  18   1.692  -1.256 -11.827
  119   HG12  VAL  18          HG12      VAL  18   1.354  -2.935 -12.250
  120   HG13  VAL  18          HG13      VAL  18   1.852  -1.794 -13.500
  121   HG21  VAL  18          HG21      VAL  18   5.375  -1.611 -12.528
  122   HG22  VAL  18          HG22      VAL  18   4.193  -0.470 -11.888
  123   HG23  VAL  18          HG23      VAL  18   4.121  -0.955 -13.581
  124    H    SER  19           H        SER  19   5.355  -1.736  -9.237
  125    HA   SER  19           HA       SER  19   3.379  -0.007  -7.945
  126    HB2  SER  19           HB3      SER  19   6.265  -0.569  -7.203
  127    HB3  SER  19           HB2      SER  19   5.139   0.419  -6.270
  128    HG   SER  19           HG       SER  19   3.907  -1.379  -5.850
  129    H    VAL  20           H        VAL  20   3.079   1.903  -8.850
  130    HA   VAL  20           HA       VAL  20   5.387   3.250 -10.103
  131    HB   VAL  20           HB       VAL  20   2.476   3.485 -10.875
  132   HG11  VAL  20          HG11      VAL  20   4.947   4.648 -12.133
  133   HG12  VAL  20          HG12      VAL  20   3.667   5.533 -11.301
  134   HG13  VAL  20          HG13      VAL  20   3.325   4.713 -12.824
  135   HG21  VAL  20          HG21      VAL  20   4.734   2.040 -12.244
  136   HG22  VAL  20          HG22      VAL  20   3.130   2.301 -12.930
  137   HG23  VAL  20          HG23      VAL  20   3.320   1.311 -11.482
  138    H    TRP  21           H        TRP  21   5.814   5.299  -9.471
  139    HA   TRP  21           HA       TRP  21   3.954   6.586  -7.616
  140    HB2  TRP  21           HB3      TRP  21   6.794   7.261  -8.429
  141    HB3  TRP  21           HB2      TRP  21   5.814   8.292  -7.392
  142    HD1  TRP  21           HD1      TRP  21   7.753   4.998  -7.375
  143    HE1  TRP  21           HE1      TRP  21   8.022   4.203  -4.937
  144    HE3  TRP  21           HE3      TRP  21   4.685   8.387  -5.068
  145    HZ2  TRP  21           HZ2      TRP  21   7.057   4.917  -2.386
  146    HZ3  TRP  21           HZ3      TRP  21   4.414   8.260  -2.625
  147    HH2  TRP  21           HH2      TRP  21   5.577   6.562  -1.315
  148    H    VAL  22           H        VAL  22   2.330   7.330  -8.851
  149    HA   VAL  22           HA       VAL  22   2.803   8.518 -11.434
  150    HB   VAL  22           HB       VAL  22   0.235   8.360  -9.844
  151   HG11  VAL  22          HG11      VAL  22   0.130  10.056 -11.566
  152   HG12  VAL  22          HG12      VAL  22  -0.860   8.669 -12.024
  153   HG13  VAL  22          HG13      VAL  22   0.721   8.908 -12.767
  154   HG21  VAL  22          HG21      VAL  22   1.282   6.515 -11.988
  155   HG22  VAL  22          HG22      VAL  22  -0.303   6.416 -11.219
  156   HG23  VAL  22          HG23      VAL  22   1.157   6.140 -10.270
  157    H    GLY  23           H        GLY  23   3.329  10.580 -11.724
  158    HA2  GLY  23           HA3      GLY  23   2.528  12.524  -9.644
  159    HA3  GLY  23           HA2      GLY  23   3.997  12.660 -10.609
  160    H    ASP  24           H        ASP  24   1.219  11.550 -12.258
  161    HA   ASP  24           HA       ASP  24   0.536  14.231 -13.208
  162    HB2  ASP  24           HB3      ASP  24   1.606  11.990 -14.897
  163    HB3  ASP  24           HB2      ASP  24   0.456  13.133 -15.587
  164    H    LYS  25           H        LYS  25  -0.891  12.475 -11.489
  165    HA   LYS  25           HA       LYS  25  -2.922  11.113 -12.977
  166    HB2  LYS  25           HB3      LYS  25  -2.128  10.688 -10.549
  167    HB3  LYS  25           HB2      LYS  25  -3.177  12.028 -10.118
  168    HG2  LYS  25           HG3      LYS  25  -5.104  10.851 -10.946
  169    HG3  LYS  25           HG2      LYS  25  -4.088   9.531 -11.531
  170    HD2  LYS  25           HD3      LYS  25  -3.334   9.197  -9.159
  171    HD3  LYS  25           HD2      LYS  25  -4.568  10.360  -8.676
  172    HE2  LYS  25           HE3      LYS  25  -5.429   8.117  -8.391
  173    HE3  LYS  25           HE2      LYS  25  -6.288   8.914  -9.712
  174    HZ1  LYS  25           HZ1      LYS  25  -4.954   7.713 -11.296
  175    HZ2  LYS  25           HZ2      LYS  25  -5.666   6.616 -10.230
  176    HZ3  LYS  25           HZ3      LYS  25  -4.025   7.011 -10.065
  177    H    THR  26           H        THR  26  -4.835  11.928 -13.733
  178    HA   THR  26           HA       THR  26  -5.096  14.836 -13.529
  179    HB   THR  26           HB       THR  26  -6.528  14.591 -15.579
  180    HG1  THR  26           HG1      THR  26  -5.685  12.260 -16.454
  181   HG21  THR  26          HG21      THR  26  -4.182  15.211 -15.773
  182   HG22  THR  26          HG22      THR  26  -4.632  14.129 -17.091
  183   HG23  THR  26          HG23      THR  26  -3.709  13.514 -15.720
  184    H    THR  27           H        THR  27  -6.981  11.876 -13.168
  185    HA   THR  27           HA       THR  27  -8.983  13.407 -11.696
  186    HB   THR  27           HB       THR  27 -10.717  11.842 -12.931
  187    HG1  THR  27           HG1      THR  27  -8.589  12.156 -14.800
  188   HG21  THR  27          HG21      THR  27 -10.849  14.272 -12.887
  189   HG22  THR  27          HG22      THR  27 -11.175  13.673 -14.514
  190   HG23  THR  27          HG23      THR  27  -9.605  14.379 -14.132
  191    H    ALA  28           H        ALA  28  -9.906  12.338 -10.033
  192    HA   ALA  28           HA       ALA  28  -9.558   9.449  -9.825
  193    HB1  ALA  28           HB1      ALA  28  -7.513  10.410  -8.850
  194    HB2  ALA  28           HB2      ALA  28  -8.490   9.548  -7.662
  195    HB3  ALA  28           HB3      ALA  28  -8.506  11.311  -7.703
  196    H    THR  29           H        THR  29 -10.711   8.569  -7.919
  197    HA   THR  29           HA       THR  29 -13.207  10.036  -7.538
  198    HB   THR  29           HB       THR  29 -12.714   7.230  -6.586
  199    HG1  THR  29           HG1      THR  29 -12.878   8.150  -9.212
  200   HG21  THR  29          HG21      THR  29 -15.107   6.997  -7.034
  201   HG22  THR  29          HG22      THR  29 -15.161   8.655  -7.634
  202   HG23  THR  29          HG23      THR  29 -14.795   8.342  -5.937
  203    H    ASP  30           H        ASP  30 -13.543  11.119  -5.735
  204    HA   ASP  30           HA       ASP  30 -11.847  10.924  -3.441
  205    HB2  ASP  30           HB3      ASP  30 -12.890  13.053  -4.033
  206    HB3  ASP  30           HB2      ASP  30 -14.496  12.342  -3.875
  207    H    ILE  31           H        ILE  31 -12.789  10.541  -1.214
  208    HA   ILE  31           HA       ILE  31 -13.775   7.928  -1.025
  209    HB   ILE  31           HB       ILE  31 -12.479   8.972   0.765
  210   HG12  ILE  31          HG13      ILE  31 -15.247   8.224   1.737
  211   HG13  ILE  31          HG12      ILE  31 -13.987   7.073   1.302
  212   HG21  ILE  31          HG21      ILE  31 -13.355  11.231   0.622
  213   HG22  ILE  31          HG22      ILE  31 -13.476  10.621   2.271
  214   HG23  ILE  31          HG23      ILE  31 -14.910  10.686   1.248
  215   HD11  ILE  31          HD11      ILE  31 -13.860   9.082   3.538
  216   HD12  ILE  31          HD12      ILE  31 -12.580   7.949   3.101
  217   HD13  ILE  31          HD13      ILE  31 -14.125   7.348   3.704
  218    H    LYS  32           H        LYS  32 -15.437  10.977  -1.276
  219    HA   LYS  32           HA       LYS  32 -17.983   9.941  -0.404
  220    HB2  LYS  32           HB3      LYS  32 -17.273  12.504  -1.837
  221    HB3  LYS  32           HB2      LYS  32 -18.846  12.132  -1.141
  222    HG2  LYS  32           HG3      LYS  32 -17.838  12.017   1.079
  223    HG3  LYS  32           HG2      LYS  32 -16.261  12.382   0.379
  224    HD2  LYS  32           HD3      LYS  32 -17.112  14.527  -0.408
  225    HD3  LYS  32           HD2      LYS  32 -18.687  14.171   0.308
  226    HE2  LYS  32           HE3      LYS  32 -16.074  14.432   1.783
  227    HE3  LYS  32           HE2      LYS  32 -17.364  15.631   1.750
  228    HZ1  LYS  32           HZ1      LYS  32 -17.417  14.294   3.767
  229    HZ2  LYS  32           HZ2      LYS  32 -17.601  12.883   2.857
  230    HZ3  LYS  32           HZ3      LYS  32 -18.818  14.058   2.850
  231    H    GLY  33           H        GLY  33 -16.192   9.499  -3.146
  232    HA2  GLY  33           HA3      GLY  33 -16.889   8.109  -4.916
  233    HA3  GLY  33           HA2      GLY  33 -18.560   8.536  -4.564
  234    H    LYS  34           H        LYS  34 -16.542  11.221  -4.605
  235    HA   LYS  34           HA       LYS  34 -17.783  12.154  -7.049
  236    HB2  LYS  34           HB3      LYS  34 -15.956  13.512  -5.069
  237    HB3  LYS  34           HB2      LYS  34 -16.676  14.309  -6.456
  238    HG2  LYS  34           HG3      LYS  34 -18.184  13.074  -4.168
  239    HG3  LYS  34           HG2      LYS  34 -17.875  14.790  -4.394
  240    HD2  LYS  34           HD3      LYS  34 -19.052  14.572  -6.622
  241    HD3  LYS  34           HD2      LYS  34 -19.578  12.978  -6.076
  242    HE2  LYS  34           HE3      LYS  34 -21.315  14.563  -5.589
  243    HE3  LYS  34           HE2      LYS  34 -20.570  14.052  -4.077
  244    HZ1  LYS  34           HZ1      LYS  34 -20.928  16.446  -4.145
  245    HZ2  LYS  34           HZ2      LYS  34 -19.951  16.572  -5.518
  246    HZ3  LYS  34           HZ3      LYS  34 -19.281  16.080  -4.047
  247    H    GLU  35           H        GLU  35 -16.798  12.444  -8.960
  248    HA   GLU  35           HA       GLU  35 -14.030  11.639  -9.262
  249    HB2  GLU  35           HB3      GLU  35 -15.623  10.955 -10.976
  250    HB3  GLU  35           HB2      GLU  35 -16.079  12.629 -11.257
  251    HG2  GLU  35           HG3      GLU  35 -13.900  13.125 -12.146
  252    HG3  GLU  35           HG2      GLU  35 -13.334  11.508 -11.749
  253    H    VAL  36           H        VAL  36 -12.466  13.043  -8.869
  254    HA   VAL  36           HA       VAL  36 -13.021  15.894  -9.330
  255    HB   VAL  36           HB       VAL  36 -11.410  16.374  -7.469
  256   HG11  VAL  36          HG11      VAL  36 -13.894  14.823  -6.762
  257   HG12  VAL  36          HG12      VAL  36 -13.798  16.549  -7.109
  258   HG13  VAL  36          HG13      VAL  36 -13.018  15.893  -5.670
  259   HG21  VAL  36          HG21      VAL  36 -11.751  13.434  -6.893
  260   HG22  VAL  36          HG22      VAL  36 -10.953  14.607  -5.845
  261   HG23  VAL  36          HG23      VAL  36 -10.263  14.221  -7.422
  262    H    THR  37           H        THR  37 -11.256  17.210  -9.911
  263    HA   THR  37           HA       THR  37  -9.432  15.827 -11.686
  264    HB   THR  37           HB       THR  37  -9.740  18.797 -11.272
  265    HG1  THR  37           HG1      THR  37 -11.708  18.274 -12.005
  266   HG21  THR  37          HG21      THR  37  -8.813  18.944 -13.532
  267   HG22  THR  37          HG22      THR  37  -8.671  17.188 -13.594
  268   HG23  THR  37          HG23      THR  37  -7.702  18.113 -12.445
  269    H    VAL  38           H        VAL  38  -7.510  15.231 -10.995
  270    HA   VAL  38           HA       VAL  38  -6.438  16.272  -8.530
  271    HB   VAL  38           HB       VAL  38  -5.270  14.222 -10.421
  272   HG11  VAL  38          HG11      VAL  38  -4.579  14.895  -7.566
  273   HG12  VAL  38          HG12      VAL  38  -3.579  15.200  -8.986
  274   HG13  VAL  38          HG13      VAL  38  -3.918  13.544  -8.486
  275   HG21  VAL  38          HG21      VAL  38  -7.436  13.510  -9.549
  276   HG22  VAL  38          HG22      VAL  38  -6.883  13.824  -7.903
  277   HG23  VAL  38          HG23      VAL  38  -6.127  12.550  -8.859
  278    H    LEU  39           H        LEU  39  -4.731  17.608  -8.306
  279    HA   LEU  39           HA       LEU  39  -3.657  18.808 -10.747
  280    HB2  LEU  39           HB3      LEU  39  -3.396  19.733  -7.881
  281    HB3  LEU  39           HB2      LEU  39  -2.917  20.629  -9.312
  282    HG   LEU  39           HG       LEU  39  -5.751  19.887  -8.596
  283   HD11  LEU  39          HD11      LEU  39  -6.051  22.243  -8.116
  284   HD12  LEU  39          HD12      LEU  39  -4.353  22.548  -8.476
  285   HD13  LEU  39          HD13      LEU  39  -4.796  21.559  -7.084
  286   HD21  LEU  39          HD21      LEU  39  -6.351  21.414 -10.417
  287   HD22  LEU  39          HD22      LEU  39  -5.433  20.023 -10.992
  288   HD23  LEU  39          HD23      LEU  39  -4.642  21.590 -10.816
  289    H    ALA  40           H        ALA  40  -1.837  17.930 -11.451
  290    HA   ALA  40           HA       ALA  40  -0.158  16.260  -9.906
  291    HB1  ALA  40           HB1      ALA  40   0.440  17.656 -12.515
  292    HB2  ALA  40           HB2      ALA  40  -0.349  16.088 -12.351
  293    HB3  ALA  40           HB3      ALA  40   1.327  16.291 -11.838
  294    H    GLU  41           H        GLU  41  -0.098  19.622 -10.815
  295    HA   GLU  41           HA       GLU  41   2.177  20.074  -8.998
  296    HB2  GLU  41           HB3      GLU  41   1.190  21.769 -11.309
  297    HB3  GLU  41           HB2      GLU  41   2.567  22.144 -10.284
  298    HG2  GLU  41           HG3      GLU  41   2.510  19.565 -11.768
  299    HG3  GLU  41           HG2      GLU  41   2.897  21.052 -12.630
  300    H    VAL  42           H        VAL  42   1.497  20.899  -7.095
  301    HA   VAL  42           HA       VAL  42  -1.089  22.284  -7.076
  302    HB   VAL  42           HB       VAL  42  -1.223  21.777  -4.682
  303   HG11  VAL  42          HG11      VAL  42  -1.492  19.334  -4.883
  304   HG12  VAL  42          HG12      VAL  42  -0.668  19.401  -6.442
  305   HG13  VAL  42          HG13      VAL  42  -2.213  20.223  -6.224
  306   HG21  VAL  42          HG21      VAL  42   0.361  20.280  -3.608
  307   HG22  VAL  42          HG22      VAL  42   1.171  21.746  -4.166
  308   HG23  VAL  42          HG23      VAL  42   1.342  20.243  -5.073
  309    H    ASN  43           H        ASN  43  -1.263  24.338  -6.507
  310    HA   ASN  43           HA       ASN  43   1.164  25.760  -5.701
  311    HB2  ASN  43           HB3      ASN  43  -1.536  26.801  -6.611
  312    HB3  ASN  43           HB2      ASN  43  -0.161  27.816  -6.185
  313   HD21  ASN  43          HD21      ASN  43  -1.554  25.728  -8.561
  314   HD22  ASN  43          HD22      ASN  43  -0.393  26.029  -9.808
  315    H    ILE  44           H        ILE  44   1.421  25.457  -3.553
  316    HA   ILE  44           HA       ILE  44  -0.856  26.199  -1.826
  317    HB   ILE  44           HB       ILE  44   1.489  24.420  -1.112
  318   HG12  ILE  44          HG13      ILE  44  -1.409  23.658  -1.571
  319   HG13  ILE  44          HG12      ILE  44  -0.116  23.402  -2.742
  320   HG21  ILE  44          HG21      ILE  44   0.208  23.947   0.927
  321   HG22  ILE  44          HG22      ILE  44  -1.021  25.104   0.422
  322   HG23  ILE  44          HG23      ILE  44   0.611  25.658   0.796
  323   HD11  ILE  44          HD11      ILE  44   1.007  21.903  -1.191
  324   HD12  ILE  44          HD12      ILE  44  -0.645  21.369  -1.500
  325   HD13  ILE  44          HD13      ILE  44  -0.249  22.188   0.010
  326    H    ASN  45           H        ASN  45  -0.528  28.314  -1.483
  327    HA   ASN  45           HA       ASN  45   0.384  30.255  -0.751
  328    HB2  ASN  45           HB3      ASN  45   0.584  28.813   1.337
  329    HB3  ASN  45           HB2      ASN  45   2.270  28.556   0.894
  330   HD21  ASN  45          HD21      ASN  45  -0.102  30.917   1.884
  331   HD22  ASN  45          HD22      ASN  45   1.027  32.097   2.455
  332    H    ASN  46           H        ASN  46   1.217  29.620  -3.159
  333    HA   ASN  46           HA       ASN  46   2.748  30.116  -4.751
  334    HB2  ASN  46           HB3      ASN  46   4.057  31.569  -2.451
  335    HB3  ASN  46           HB2      ASN  46   4.653  31.644  -4.106
  336   HD21  ASN  46          HD21      ASN  46   3.539  33.724  -2.327
  337   HD22  ASN  46          HD22      ASN  46   2.231  34.430  -3.214
  338    H    SER  47           H        SER  47   3.077  27.743  -2.870
  339    HA   SER  47           HA       SER  47   5.810  27.080  -3.737
  340    HB2  SER  47           HB3      SER  47   5.545  27.130  -1.256
  341    HB3  SER  47           HB2      SER  47   4.278  25.913  -1.389
  342    HG   SER  47           HG       SER  47   6.902  25.502  -2.379
  343    H    VAL  48           H        VAL  48   5.892  25.581  -5.287
  344    HA   VAL  48           HA       VAL  48   3.415  24.136  -5.899
  345    HB   VAL  48           HB       VAL  48   5.779  24.657  -7.705
  346   HG11  VAL  48          HG11      VAL  48   4.541  22.650  -8.315
  347   HG12  VAL  48          HG12      VAL  48   4.288  23.930  -9.501
  348   HG13  VAL  48          HG13      VAL  48   3.035  23.568  -8.315
  349   HG21  VAL  48          HG21      VAL  48   3.092  26.021  -7.600
  350   HG22  VAL  48          HG22      VAL  48   4.344  26.298  -8.811
  351   HG23  VAL  48          HG23      VAL  48   4.635  26.729  -7.125
  352    H    PHE  49           H        PHE  49   3.400  22.171  -5.058
  353    HA   PHE  49           HA       PHE  49   5.835  20.525  -5.286
  354    HB2  PHE  49           HB3      PHE  49   3.480  20.335  -3.397
  355    HB3  PHE  49           HB2      PHE  49   4.627  19.016  -3.610
  356    HD1  PHE  49           HD1      PHE  49   3.896  22.005  -1.844
  357    HD2  PHE  49           HD2      PHE  49   7.102  19.553  -3.191
  358    HE1  PHE  49           HE1      PHE  49   5.372  23.008  -0.148
  359    HE2  PHE  49           HE2      PHE  49   8.584  20.553  -1.502
  360    HZ   PHE  49           HZ       PHE  49   7.720  22.282   0.022
  361    H    ARG  50           H        ARG  50   5.657  18.421  -6.148
  362    HA   ARG  50           HA       ARG  50   3.311  18.062  -7.854
  363    HB2  ARG  50           HB3      ARG  50   5.500  17.943  -8.966
  364    HB3  ARG  50           HB2      ARG  50   5.971  16.618  -7.909
  365    HG2  ARG  50           HG3      ARG  50   4.482  15.129  -8.907
  366    HG3  ARG  50           HG2      ARG  50   3.548  16.424  -9.655
  367    HD2  ARG  50           HD3      ARG  50   6.387  15.710 -10.364
  368    HD3  ARG  50           HD2      ARG  50   4.962  15.189 -11.262
  369    HE   ARG  50           HE       ARG  50   5.270  18.062 -10.896
  370   HH11  ARG  50          HH11      ARG  50   5.684  15.281 -12.992
  371   HH12  ARG  50          HH12      ARG  50   5.862  16.232 -14.430
  372   HH21  ARG  50          HH21      ARG  50   5.525  19.312 -12.784
  373   HH22  ARG  50          HH22      ARG  50   5.771  18.530 -14.314
  374    H    GLN  51           H        GLN  51   1.967  16.370  -7.697
  375    HA   GLN  51           HA       GLN  51   1.981  14.990  -5.149
  376    HB2  GLN  51           HB3      GLN  51  -0.046  15.046  -7.394
  377    HB3  GLN  51           HB2      GLN  51  -0.282  14.242  -5.847
  378    HG2  GLN  51           HG3      GLN  51   0.134  17.195  -6.270
  379    HG3  GLN  51           HG2      GLN  51  -1.393  16.394  -5.886
  380   HE21  GLN  51          HE21      GLN  51   0.138  18.452  -4.429
  381   HE22  GLN  51          HE22      GLN  51   0.412  17.798  -2.850
  382    H    TYR  52           H        TYR  52   3.215  13.220  -5.038
  383    HA   TYR  52           HA       TYR  52   3.290  11.348  -7.276
  384    HB2  TYR  52           HB3      TYR  52   4.694  11.119  -4.599
  385    HB3  TYR  52           HB2      TYR  52   5.041  10.205  -6.060
  386    HD1  TYR  52           HD1      TYR  52   5.949  11.503  -8.083
  387    HD2  TYR  52           HD2      TYR  52   5.811  13.110  -4.145
  388    HE1  TYR  52           HE1      TYR  52   7.657  13.159  -8.701
  389    HE2  TYR  52           HE2      TYR  52   7.514  14.773  -4.755
  390    HH   TYR  52           HH       TYR  52   8.420  15.401  -7.950
  391    H    PHE  53           H        PHE  53   1.905   9.696  -7.369
  392    HA   PHE  53           HA       PHE  53   0.665   8.785  -4.854
  393    HB2  PHE  53           HB3      PHE  53  -0.422   8.564  -7.674
  394    HB3  PHE  53           HB2      PHE  53  -1.240   8.033  -6.206
  395    HD1  PHE  53           HD1      PHE  53  -1.532   9.894  -4.382
  396    HD2  PHE  53           HD2      PHE  53  -0.915  10.640  -8.521
  397    HE1  PHE  53           HE1      PHE  53  -2.530  12.125  -4.118
  398    HE2  PHE  53           HE2      PHE  53  -1.905  12.876  -8.269
  399    HZ   PHE  53           HZ       PHE  53  -2.712  13.621  -6.066
  400    H    PHE  54           H        PHE  54   1.134   6.812  -4.197
  401    HA   PHE  54           HA       PHE  54   2.783   5.100  -5.848
  402    HB2  PHE  54           HB3      PHE  54   3.333   5.453  -3.465
  403    HB3  PHE  54           HB2      PHE  54   1.783   4.762  -3.002
  404    HD1  PHE  54           HD1      PHE  54   1.619   2.492  -2.550
  405    HD2  PHE  54           HD2      PHE  54   4.927   3.937  -4.807
  406    HE1  PHE  54           HE1      PHE  54   2.659   0.268  -2.443
  407    HE2  PHE  54           HE2      PHE  54   5.970   1.713  -4.707
  408    HZ   PHE  54           HZ       PHE  54   4.838  -0.124  -3.525
  409    H    GLU  55           H        GLU  55   1.541   4.199  -7.416
  410    HA   GLU  55           HA       GLU  55  -0.848   2.710  -6.564
  411    HB2  GLU  55           HB3      GLU  55  -0.024   3.610  -9.338
  412    HB3  GLU  55           HB2      GLU  55  -1.467   2.677  -8.969
  413    HG2  GLU  55           HG3      GLU  55  -2.176   4.604  -7.483
  414    HG3  GLU  55           HG2      GLU  55  -0.854   5.522  -8.210
  415    H    THR  56           H        THR  56  -0.329   0.690  -6.072
  416    HA   THR  56           HA       THR  56   1.533  -0.782  -7.790
  417    HB   THR  56           HB       THR  56   0.168  -1.715  -5.253
  418    HG1  THR  56           HG1      THR  56   1.618  -0.404  -4.413
  419   HG21  THR  56          HG21      THR  56   0.833  -3.546  -6.745
  420   HG22  THR  56          HG22      THR  56   1.832  -3.515  -5.293
  421   HG23  THR  56          HG23      THR  56   2.471  -2.897  -6.816
  422    H    LYS  57           H        LYS  57   0.537  -1.358  -9.595
  423    HA   LYS  57           HA       LYS  57  -2.305  -2.089  -9.475
  424    HB2  LYS  57           HB3      LYS  57  -0.676  -1.262 -11.887
  425    HB3  LYS  57           HB2      LYS  57  -2.430  -1.378 -11.780
  426    HG2  LYS  57           HG3      LYS  57  -2.504   0.478 -10.240
  427    HG3  LYS  57           HG2      LYS  57  -0.745   0.558 -10.198
  428    HD2  LYS  57           HD3      LYS  57  -1.294   2.244 -11.685
  429    HD3  LYS  57           HD2      LYS  57  -0.952   0.887 -12.756
  430    HE2  LYS  57           HE3      LYS  57  -2.943   1.944 -13.523
  431    HE3  LYS  57           HE2      LYS  57  -3.390   0.403 -12.798
  432    HZ1  LYS  57           HZ1      LYS  57  -4.807   2.385 -12.204
  433    HZ2  LYS  57           HZ2      LYS  57  -3.501   2.952 -11.283
  434    HZ3  LYS  57           HZ3      LYS  57  -4.235   1.473 -10.901
  435    H    CYS  58           H        CYS  58  -3.066  -3.844 -10.747
  436    HA   CYS  58           HA       CYS  58  -1.329  -6.119 -10.688
  437    HB2  CYS  58           HB3      CYS  58  -4.132  -5.819 -11.801
  438    HB3  CYS  58           HB2      CYS  58  -3.289  -7.347 -11.599
  439    H    ARG  59           H        ARG  59   0.208  -6.335 -12.170
  440    HA   ARG  59           HA       ARG  59   0.077  -5.295 -14.810
  441    HB2  ARG  59           HB3      ARG  59   1.907  -7.164 -13.359
  442    HB3  ARG  59           HB2      ARG  59   2.009  -7.068 -15.109
  443    HG2  ARG  59           HG3      ARG  59   2.475  -4.691 -14.972
  444    HG3  ARG  59           HG2      ARG  59   2.304  -4.751 -13.219
  445    HD2  ARG  59           HD3      ARG  59   4.242  -6.075 -12.973
  446    HD3  ARG  59           HD2      ARG  59   4.311  -6.430 -14.697
  447    HE   ARG  59           HE       ARG  59   4.645  -3.836 -14.802
  448   HH11  ARG  59          HH11      ARG  59   5.993  -6.030 -12.429
  449   HH12  ARG  59          HH12      ARG  59   7.454  -5.120 -12.232
  450   HH21  ARG  59          HH21      ARG  59   6.563  -2.633 -14.535
  451   HH22  ARG  59          HH22      ARG  59   7.778  -3.189 -13.429
  452    H    ALA  60           H        ALA  60  -0.236  -8.569 -13.496
  453    HA   ALA  60           HA       ALA  60  -1.963  -9.293 -15.719
  454    HB1  ALA  60           HB1      ALA  60  -0.681 -11.302 -16.264
  455    HB2  ALA  60           HB2      ALA  60   0.559 -10.831 -15.104
  456    HB3  ALA  60           HB3      ALA  60   0.274  -9.847 -16.537
  457    H    SER  61           H        SER  61  -3.647  -9.610 -14.337
  458    HA   SER  61           HA       SER  61  -3.469 -10.997 -11.884
  459    HB2  SER  61           HB3      SER  61  -6.000 -11.127 -12.127
  460    HB3  SER  61           HB2      SER  61  -5.304  -9.507 -12.180
  461    HG   SER  61           HG       SER  61  -5.876  -9.308 -14.208
  462    H    ASN  62           H        ASN  62  -3.853 -13.092 -11.356
  463    HA   ASN  62           HA       ASN  62  -4.016 -15.348 -11.554
  464    HB2  ASN  62           HB3      ASN  62  -5.311 -14.678 -14.205
  465    HB3  ASN  62           HB2      ASN  62  -5.143 -16.320 -13.595
  466   HD21  ASN  62          HD21      ASN  62  -5.619 -15.602 -10.829
  467   HD22  ASN  62          HD22      ASN  62  -7.312 -15.263 -10.709
  468    HA   PRO  63           HA       PRO  63  -0.041 -15.209 -14.018
  469    HB2  PRO  63           HB3      PRO  63   1.398 -16.393 -11.985
  470    HB3  PRO  63           HB2      PRO  63   1.281 -14.645 -12.236
  471    HG2  PRO  63           HG3      PRO  63  -0.225 -16.403 -10.340
  472    HG3  PRO  63           HG2      PRO  63   0.436 -14.779 -10.078
  473    HD2  PRO  63           HD3      PRO  63  -2.192 -15.178 -10.538
  474    HD3  PRO  63           HD2      PRO  63  -1.344 -13.739 -11.159
  475    H    VAL  64           H        VAL  64  -1.711 -17.569 -12.066
  476    HA   VAL  64           HA       VAL  64  -0.735 -19.699 -13.845
  477    HB   VAL  64           HB       VAL  64  -1.395 -21.302 -12.099
  478   HG11  VAL  64          HG11      VAL  64   0.342 -20.763 -10.451
  479   HG12  VAL  64          HG12      VAL  64   0.430 -19.123 -11.092
  480   HG13  VAL  64          HG13      VAL  64   0.893 -20.492 -12.104
  481   HG21  VAL  64          HG21      VAL  64  -2.006 -20.518  -9.861
  482   HG22  VAL  64          HG22      VAL  64  -3.199 -20.045 -11.069
  483   HG23  VAL  64          HG23      VAL  64  -2.042 -18.860 -10.457
  484    H    GLU  65           H        GLU  65  -2.422 -21.432 -14.254
  485    HA   GLU  65           HA       GLU  65  -4.750 -20.088 -15.297
  486    HB2  GLU  65           HB3      GLU  65  -3.935 -22.990 -15.443
  487    HB3  GLU  65           HB2      GLU  65  -5.248 -22.254 -16.349
  488    HG2  GLU  65           HG3      GLU  65  -3.685 -20.850 -17.534
  489    HG3  GLU  65           HG2      GLU  65  -2.349 -21.481 -16.571
  490    H    SER  66           H        SER  66  -5.157 -19.733 -12.805
  491    HA   SER  66           HA       SER  66  -7.573 -21.085 -12.228
  492    HB2  SER  66           HB3      SER  66  -6.767 -22.009  -9.975
  493    HB3  SER  66           HB2      SER  66  -6.289 -22.917 -11.412
  494    HG   SER  66           HG       SER  66  -4.687 -22.135  -9.600
  495    H    GLY  67           H        GLY  67  -4.970 -19.696 -10.239
  496    HA2  GLY  67           HA3      GLY  67  -6.527 -17.263  -9.874
  497    HA3  GLY  67           HA2      GLY  67  -6.232 -18.229  -8.431
  498    H    CYS  68           H        CYS  68  -4.036 -18.556  -7.743
  499    HA   CYS  68           HA       CYS  68  -2.086 -16.698  -8.908
  500    HB2  CYS  68           HB3      CYS  68  -3.029 -16.667  -6.039
  501    HB3  CYS  68           HB2      CYS  68  -1.492 -15.955  -6.541
  502    H    ARG  69           H        ARG  69   0.093 -16.959  -7.617
  503    HA   ARG  69           HA       ARG  69   0.798 -19.717  -7.957
  504    HB2  ARG  69           HB3      ARG  69   2.470 -17.448  -6.834
  505    HB3  ARG  69           HB2      ARG  69   3.077 -19.016  -7.356
  506    HG2  ARG  69           HG3      ARG  69   2.225 -18.446  -9.663
  507    HG3  ARG  69           HG2      ARG  69   1.930 -16.816  -9.054
  508    HD2  ARG  69           HD3      ARG  69   4.328 -16.698  -8.383
  509    HD3  ARG  69           HD2      ARG  69   4.583 -18.250  -9.183
  510    HE   ARG  69           HE       ARG  69   3.673 -15.820 -10.597
  511   HH11  ARG  69          HH11      ARG  69   5.596 -18.754 -10.464
  512   HH12  ARG  69          HH12      ARG  69   6.332 -18.484 -12.008
  513   HH21  ARG  69          HH21      ARG  69   4.648 -15.469 -12.623
  514   HH22  ARG  69          HH22      ARG  69   5.792 -16.615 -13.240
  515    H    GLY  70           H        GLY  70   1.166 -21.253  -6.437
  516    HA2  GLY  70           HA3      GLY  70   1.508 -22.135  -4.294
  517    HA3  GLY  70           HA2      GLY  70   1.278 -20.527  -3.619
  518    H    ILE  71           H        ILE  71  -1.155 -19.830  -4.636
  519    HA   ILE  71           HA       ILE  71  -2.952 -21.331  -2.974
  520    HB   ILE  71           HB       ILE  71  -3.776 -19.220  -4.971
  521   HG12  ILE  71          HG13      ILE  71  -1.831 -18.368  -3.677
  522   HG13  ILE  71          HG12      ILE  71  -3.316 -17.484  -3.347
  523   HG21  ILE  71          HG21      ILE  71  -4.878 -20.161  -2.333
  524   HG22  ILE  71          HG22      ILE  71  -5.648 -20.217  -3.921
  525   HG23  ILE  71          HG23      ILE  71  -5.401 -18.669  -3.115
  526   HD11  ILE  71          HD11      ILE  71  -2.081 -19.604  -1.605
  527   HD12  ILE  71          HD12      ILE  71  -3.594 -18.760  -1.274
  528   HD13  ILE  71          HD13      ILE  71  -2.074 -17.865  -1.312
  529    H    ASP  72           H        ASP  72  -5.217 -21.798  -4.055
  530    HA   ASP  72           HA       ASP  72  -6.552 -22.829  -5.562
  531    HB2  ASP  72           HB3      ASP  72  -4.349 -22.153  -7.523
  532    HB3  ASP  72           HB2      ASP  72  -5.922 -22.806  -7.967
  533    H    SER  73           H        SER  73  -5.855 -24.617  -4.110
  534    HA   SER  73           HA       SER  73  -4.514 -26.691  -5.699
  535    HB2  SER  73           HB3      SER  73  -4.706 -26.576  -2.679
  536    HB3  SER  73           HB2      SER  73  -3.779 -27.730  -3.640
  537    HG   SER  73           HG       SER  73  -2.470 -26.015  -4.344
  538    H    LYS  74           H        LYS  74  -6.775 -26.522  -2.927
  539    HA   LYS  74           HA       LYS  74  -8.392 -28.559  -4.299
  540    HB2  LYS  74           HB3      LYS  74  -7.722 -28.458  -1.357
  541    HB3  LYS  74           HB2      LYS  74  -8.822 -29.604  -2.101
  542    HG2  LYS  74           HG3      LYS  74  -6.967 -30.490  -3.446
  543    HG3  LYS  74           HG2      LYS  74  -5.874 -29.357  -2.651
  544    HD2  LYS  74           HD3      LYS  74  -7.481 -31.487  -1.258
  545    HD3  LYS  74           HD2      LYS  74  -5.772 -31.606  -1.662
  546    HE2  LYS  74           HE3      LYS  74  -5.362 -29.597  -0.265
  547    HE3  LYS  74           HE2      LYS  74  -7.060 -29.623   0.201
  548    HZ1  LYS  74           HZ1      LYS  74  -6.722 -31.816   1.162
  549    HZ2  LYS  74           HZ2      LYS  74  -5.681 -30.683   1.865
  550    HZ3  LYS  74           HZ3      LYS  74  -5.089 -31.780   0.722
  551    H    HIS  75           H        HIS  75  -8.553 -26.331  -1.487
  552    HA   HIS  75           HA       HIS  75 -11.422 -26.053  -2.090
  553    HB2  HIS  75           HB3      HIS  75  -9.971 -26.022   0.552
  554    HB3  HIS  75           HB2      HIS  75 -11.625 -25.451   0.376
  555    HD1  HIS  75           HD1      HIS  75 -13.464 -27.200   0.124
  556    HD2  HIS  75           HD2      HIS  75  -9.644 -28.832   0.272
  557    HE1  HIS  75           HE1      HIS  75 -13.799 -29.674   0.421
  558    HE2  HIS  75           HE2      HIS  75 -11.479 -30.618   0.658
  559    H    TRP  76           H        TRP  76  -8.725 -24.356  -2.557
  560    HA   TRP  76           HA       TRP  76 -10.093 -21.819  -1.980
  561    HB2  TRP  76           HB3      TRP  76  -7.145 -22.433  -1.750
  562    HB3  TRP  76           HB2      TRP  76  -7.772 -20.788  -1.836
  563    HD1  TRP  76           HD1      TRP  76  -6.747 -23.240   0.635
  564    HE1  TRP  76           HE1      TRP  76  -7.710 -22.690   2.959
  565    HE3  TRP  76           HE3      TRP  76 -10.325 -19.847  -0.736
  566    HZ2  TRP  76           HZ2      TRP  76  -9.712 -21.049   4.061
  567    HZ3  TRP  76           HZ3      TRP  76 -11.721 -18.838   1.019
  568    HH2  TRP  76           HH2      TRP  76 -11.421 -19.428   3.367
  569    H    ASN  77           H        ASN  77 -10.288 -20.408  -3.547
  570    HA   ASN  77           HA       ASN  77  -8.756 -20.774  -6.040
  571    HB2  ASN  77           HB3      ASN  77 -11.156 -21.388  -6.318
  572    HB3  ASN  77           HB2      ASN  77 -11.614 -19.787  -5.760
  573   HD21  ASN  77          HD21      ASN  77 -11.299 -18.010  -7.120
  574   HD22  ASN  77          HD22      ASN  77 -10.996 -18.202  -8.812
  575    H    SER  78           H        SER  78  -7.778 -18.923  -6.816
  576    HA   SER  78           HA       SER  78  -8.100 -16.569  -5.063
  577    HB2  SER  78           HB3      SER  78  -5.920 -17.907  -4.951
  578    HB3  SER  78           HB2      SER  78  -5.570 -17.256  -6.551
  579    HG   SER  78           HG       SER  78  -6.140 -15.711  -4.235
  580    H    TYR  79           H        TYR  79  -7.148 -14.545  -6.105
  581    HA   TYR  79           HA       TYR  79  -7.153 -14.211  -8.907
  582    HB2  TYR  79           HB3      TYR  79  -9.584 -14.483  -8.703
  583    HB3  TYR  79           HB2      TYR  79  -9.635 -13.235  -7.459
  584    HD1  TYR  79           HD1      TYR  79 -10.073 -11.033  -8.076
  585    HD2  TYR  79           HD2      TYR  79  -8.630 -13.748 -11.017
  586    HE1  TYR  79           HE1      TYR  79 -10.382  -9.315  -9.808
  587    HE2  TYR  79           HE2      TYR  79  -8.936 -12.037 -12.755
  588    HH   TYR  79           HH       TYR  79 -10.147 -10.031 -13.172
  589    H    CYS  80           H        CYS  80  -6.276 -12.235  -9.445
  590    HA   CYS  80           HA       CYS  80  -5.161 -10.747  -7.222
  591    HB2  CYS  80           HB3      CYS  80  -4.750 -10.169 -10.154
  592    HB3  CYS  80           HB2      CYS  80  -3.676  -9.786  -8.805
  593    H    THR  81           H        THR  81  -6.137  -9.035  -6.399
  594    HA   THR  81           HA       THR  81  -7.590  -7.223  -8.202
  595    HB   THR  81           HB       THR  81  -8.541  -7.975  -5.424
  596    HG1  THR  81           HG1      THR  81  -8.738  -9.586  -7.239
  597   HG21  THR  81          HG21      THR  81 -10.572  -6.754  -6.051
  598   HG22  THR  81          HG22      THR  81  -9.854  -6.343  -7.607
  599   HG23  THR  81          HG23      THR  81  -9.159  -5.702  -6.117
  600    H    THR  82           H        THR  82  -7.034  -5.118  -7.914
  601    HA   THR  82           HA       THR  82  -5.046  -4.477  -5.946
  602    HB   THR  82           HB       THR  82  -5.405  -2.106  -6.909
  603    HG1  THR  82           HG1      THR  82  -6.739  -1.890  -8.544
  604   HG21  THR  82          HG21      THR  82  -4.410  -4.370  -8.634
  605   HG22  THR  82          HG22      THR  82  -3.471  -3.432  -7.471
  606   HG23  THR  82          HG23      THR  82  -4.094  -2.661  -8.931
  607    H    THR  83           H        THR  83  -5.506  -3.932  -3.922
  608    HA   THR  83           HA       THR  83  -8.132  -3.039  -3.169
  609    HB   THR  83           HB       THR  83  -6.684  -4.361  -1.609
  610    HG1  THR  83           HG1      THR  83  -8.029  -3.451  -0.252
  611   HG21  THR  83          HG21      THR  83  -4.915  -3.193  -0.367
  612   HG22  THR  83          HG22      THR  83  -5.118  -1.788  -1.412
  613   HG23  THR  83          HG23      THR  83  -4.531  -3.309  -2.085
  614    H    HIS  84           H        HIS  84  -8.524  -0.911  -2.177
  615    HA   HIS  84           HA       HIS  84  -6.881   1.121  -3.525
  616    HB2  HIS  84           HB3      HIS  84  -9.047   2.407  -3.868
  617    HB3  HIS  84           HB2      HIS  84  -8.831   0.971  -4.860
  618    HD1  HIS  84           HD1      HIS  84 -10.567  -0.839  -4.673
  619    HD2  HIS  84           HD2      HIS  84 -10.999   2.095  -1.759
  620    HE1  HIS  84           HE1      HIS  84 -12.748  -1.334  -3.534
  621    HE2  HIS  84           HE2      HIS  84 -12.871   0.319  -1.640
  622    H    THR  85           H        THR  85  -6.209   2.759  -2.326
  623    HA   THR  85           HA       THR  85  -7.488   3.122   0.309
  624    HB   THR  85           HB       THR  85  -5.065   2.363   0.352
  625    HG1  THR  85           HG1      THR  85  -4.813   3.525   2.147
  626   HG21  THR  85          HG21      THR  85  -4.237   3.631  -1.562
  627   HG22  THR  85          HG22      THR  85  -3.348   4.067  -0.103
  628   HG23  THR  85          HG23      THR  85  -4.594   5.145  -0.732
  629    H    PHE  86           H        PHE  86  -7.465   5.378   1.108
  630    HA   PHE  86           HA       PHE  86  -7.928   7.199  -1.149
  631    HB2  PHE  86           HB3      PHE  86  -9.086   7.284   1.653
  632    HB3  PHE  86           HB2      PHE  86  -9.415   8.459   0.379
  633    HD1  PHE  86           HD1      PHE  86 -10.679   7.783  -1.629
  634    HD2  PHE  86           HD2      PHE  86 -10.189   5.182   1.704
  635    HE1  PHE  86           HE1      PHE  86 -12.537   6.397  -2.446
  636    HE2  PHE  86           HE2      PHE  86 -12.047   3.788   0.893
  637    HZ   PHE  86           HZ       PHE  86 -13.223   4.393  -1.185
  638    H    VAL  87           H        VAL  87  -6.421   8.662  -1.447
  639    HA   VAL  87           HA       VAL  87  -4.752   9.438   0.849
  640    HB   VAL  87           HB       VAL  87  -3.042  10.091  -0.876
  641   HG11  VAL  87          HG11      VAL  87  -2.829   8.008   0.332
  642   HG12  VAL  87          HG12      VAL  87  -2.332   7.778  -1.346
  643   HG13  VAL  87          HG13      VAL  87  -3.911   7.207  -0.807
  644   HG21  VAL  87          HG21      VAL  87  -3.251   9.137  -3.122
  645   HG22  VAL  87          HG22      VAL  87  -4.510  10.328  -2.802
  646   HG23  VAL  87          HG23      VAL  87  -4.888   8.607  -2.743
  647    H    LYS  88           H        LYS  88  -4.464  11.542   1.343
  648    HA   LYS  88           HA       LYS  88  -6.322  13.449   0.394
  649    HB2  LYS  88           HB3      LYS  88  -5.092  15.069   1.800
  650    HB3  LYS  88           HB2      LYS  88  -5.476  13.592   2.668
  651    HG2  LYS  88           HG3      LYS  88  -3.246  12.867   2.641
  652    HG3  LYS  88           HG2      LYS  88  -2.803  14.015   1.380
  653    HD2  LYS  88           HD3      LYS  88  -3.261  15.858   2.968
  654    HD3  LYS  88           HD2      LYS  88  -3.543  14.655   4.229
  655    HE2  LYS  88           HE3      LYS  88  -0.988  14.918   2.657
  656    HE3  LYS  88           HE2      LYS  88  -1.255  15.636   4.244
  657    HZ1  LYS  88           HZ1      LYS  88  -0.069  13.447   4.231
  658    HZ2  LYS  88           HZ2      LYS  88  -1.522  12.728   3.737
  659    HZ3  LYS  88           HZ3      LYS  88  -1.439  13.523   5.232
  660    H    ALA  89           H        ALA  89  -6.269  14.391  -1.487
  661    HA   ALA  89           HA       ALA  89  -3.686  15.350  -2.532
  662    HB1  ALA  89           HB1      ALA  89  -5.913  14.164  -4.189
  663    HB2  ALA  89           HB2      ALA  89  -4.386  13.368  -3.804
  664    HB3  ALA  89           HB3      ALA  89  -4.396  14.826  -4.798
  665    H    LEU  90           H        LEU  90  -3.718  17.400  -3.414
  666    HA   LEU  90           HA       LEU  90  -6.067  18.991  -2.924
  667    HB2  LEU  90           HB3      LEU  90  -3.727  19.864  -2.612
  668    HB3  LEU  90           HB2      LEU  90  -3.517  19.778  -4.355
  669    HG   LEU  90           HG       LEU  90  -5.505  21.363  -4.535
  670   HD11  LEU  90          HD11      LEU  90  -4.918  21.672  -1.597
  671   HD12  LEU  90          HD12      LEU  90  -6.418  21.092  -2.322
  672   HD13  LEU  90          HD13      LEU  90  -5.915  22.765  -2.554
  673   HD21  LEU  90          HD21      LEU  90  -3.253  22.112  -4.958
  674   HD22  LEU  90          HD22      LEU  90  -2.951  22.292  -3.230
  675   HD23  LEU  90          HD23      LEU  90  -4.117  23.343  -4.035
  676    H    THR  91           H        THR  91  -7.709  18.676  -4.263
  677    HA   THR  91           HA       THR  91  -7.133  18.391  -7.143
  678    HB   THR  91           HB       THR  91  -9.164  17.038  -7.328
  679    HG1  THR  91           HG1      THR  91  -9.656  18.095  -4.904
  680   HG21  THR  91          HG21      THR  91  -7.066  15.863  -6.814
  681   HG22  THR  91          HG22      THR  91  -8.450  15.050  -6.092
  682   HG23  THR  91          HG23      THR  91  -7.390  16.042  -5.093
  683    H    THR  92           H        THR  92  -8.637  19.406  -8.591
  684    HA   THR  92           HA       THR  92 -10.023  21.639  -7.314
  685    HB   THR  92           HB       THR  92  -8.504  22.305  -9.093
  686    HG1  THR  92           HG1      THR  92  -9.971  23.572 -10.236
  687   HG21  THR  92          HG21      THR  92  -8.554  20.268 -10.455
  688   HG22  THR  92          HG22      THR  92  -8.882  21.704 -11.423
  689   HG23  THR  92          HG23      THR  92 -10.205  20.640 -10.948
  690    H    ASP  93           H        ASP  93 -12.029  21.392  -6.849
  691    HA   ASP  93           HA       ASP  93 -13.596  19.184  -7.636
  692    HB2  ASP  93           HB3      ASP  93 -13.795  20.640  -5.527
  693    HB3  ASP  93           HB2      ASP  93 -14.683  21.777  -6.533
  694    H    GLU  94           H        GLU  94 -13.357  22.474  -8.756
  695    HA   GLU  94           HA       GLU  94 -14.345  21.710 -11.342
  696    HB2  GLU  94           HB3      GLU  94 -16.460  22.290 -10.243
  697    HB3  GLU  94           HB2      GLU  94 -15.796  23.835  -9.742
  698    HG2  GLU  94           HG3      GLU  94 -15.574  24.481 -12.100
  699    HG3  GLU  94           HG2      GLU  94 -16.320  22.957 -12.568
  700    H    LYS  95           H        LYS  95 -13.936  24.729  -9.489
  701    HA   LYS  95           HA       LYS  95 -11.474  25.271 -10.980
  702    HB2  LYS  95           HB3      LYS  95 -13.769  27.216 -10.641
  703    HB3  LYS  95           HB2      LYS  95 -12.160  27.679 -11.175
  704    HG2  LYS  95           HG3      LYS  95 -12.387  26.247 -13.133
  705    HG3  LYS  95           HG2      LYS  95 -13.992  25.756 -12.589
  706    HD2  LYS  95           HD3      LYS  95 -14.719  28.105 -12.723
  707    HD3  LYS  95           HD2      LYS  95 -13.132  28.541 -13.358
  708    HE2  LYS  95           HE3      LYS  95 -13.493  27.051 -15.261
  709    HE3  LYS  95           HE2      LYS  95 -15.077  26.616 -14.623
  710    HZ1  LYS  95           HZ1      LYS  95 -15.751  28.932 -14.855
  711    HZ2  LYS  95           HZ2      LYS  95 -15.271  28.283 -16.341
  712    HZ3  LYS  95           HZ3      LYS  95 -14.238  29.325 -15.501
  713    H    GLN  96           H        GLN  96 -12.118  24.315  -8.311
  714    HA   GLN  96           HA       GLN  96 -10.766  26.381  -6.739
  715    HB2  GLN  96           HB3      GLN  96 -13.128  26.588  -6.187
  716    HB3  GLN  96           HB2      GLN  96 -13.249  24.860  -5.919
  717    HG2  GLN  96           HG3      GLN  96 -13.220  26.094  -3.830
  718    HG3  GLN  96           HG2      GLN  96 -11.829  25.026  -3.969
  719   HE21  GLN  96          HE21      GLN  96  -9.800  25.882  -3.968
  720   HE22  GLN  96          HE22      GLN  96  -9.469  27.559  -3.734
  721    H    ALA  97           H        ALA  97  -8.960  25.532  -6.003
  722    HA   ALA  97           HA       ALA  97  -8.484  22.720  -5.906
  723    HB1  ALA  97           HB1      ALA  97  -6.310  23.322  -4.972
  724    HB2  ALA  97           HB2      ALA  97  -6.853  24.987  -4.764
  725    HB3  ALA  97           HB3      ALA  97  -6.691  24.307  -6.384
  726    H    ALA  98           H        ALA  98  -9.022  21.363  -4.346
  727    HA   ALA  98           HA       ALA  98  -9.126  22.279  -1.577
  728    HB1  ALA  98           HB1      ALA  98 -11.398  20.824  -2.930
  729    HB2  ALA  98           HB2      ALA  98 -11.414  22.511  -2.418
  730    HB3  ALA  98           HB3      ALA  98 -11.307  21.227  -1.216
  731    H    TRP  99           H        TRP  99  -8.714  20.669  -0.073
  732    HA   TRP  99           HA       TRP  99  -7.285  18.393  -1.059
  733    HB2  TRP  99           HB3      TRP  99  -8.003  19.304   1.729
  734    HB3  TRP  99           HB2      TRP  99  -7.113  17.820   1.413
  735    HD1  TRP  99           HD1      TRP  99  -6.686  21.559   1.604
  736    HE1  TRP  99           HE1      TRP  99  -4.211  22.163   1.256
  737    HE3  TRP  99           HE3      TRP  99  -4.955  16.991   0.130
  738    HZ2  TRP  99           HZ2      TRP  99  -1.829  20.858   0.466
  739    HZ3  TRP  99           HZ3      TRP  99  -2.561  16.749  -0.404
  740    HH2  TRP  99           HH2      TRP  99  -1.035  18.645  -0.237
  741    H    ARG 100           H        ARG 100  -8.227  16.669  -1.792
  742    HA   ARG 100           HA       ARG 100 -10.656  15.664  -0.457
  743    HB2  ARG 100           HB3      ARG 100  -9.661  15.256  -3.289
  744    HB3  ARG 100           HB2      ARG 100 -11.024  14.392  -2.599
  745    HG2  ARG 100           HG3      ARG 100 -10.890  17.385  -2.880
  746    HG3  ARG 100           HG2      ARG 100 -11.625  16.306  -4.063
  747    HD2  ARG 100           HD3      ARG 100 -13.092  15.456  -2.183
  748    HD3  ARG 100           HD2      ARG 100 -12.486  16.810  -1.227
  749    HE   ARG 100           HE       ARG 100 -13.598  17.507  -3.808
  750   HH11  ARG 100          HH11      ARG 100 -14.185  17.115  -0.387
  751   HH12  ARG 100          HH12      ARG 100 -15.591  18.127  -0.381
  752   HH21  ARG 100          HH21      ARG 100 -15.457  18.819  -3.834
  753   HH22  ARG 100          HH22      ARG 100 -16.310  19.109  -2.344
  754    H    PHE 101           H        PHE 101 -10.812  13.192  -0.769
  755    HA   PHE 101           HA       PHE 101  -8.148  11.989  -0.349
  756    HB2  PHE 101           HB3      PHE 101 -10.780  11.255   0.978
  757    HB3  PHE 101           HB2      PHE 101  -9.316  10.290   1.097
  758    HD1  PHE 101           HD1      PHE 101  -7.491  10.959   2.496
  759    HD2  PHE 101           HD2      PHE 101 -10.935  13.426   2.083
  760    HE1  PHE 101           HE1      PHE 101  -6.769  12.288   4.435
  761    HE2  PHE 101           HE2      PHE 101 -10.218  14.757   4.022
  762    HZ   PHE 101           HZ       PHE 101  -8.133  14.188   5.198
  763    H    ILE 102           H        ILE 102  -7.673  10.827  -2.114
  764    HA   ILE 102           HA       ILE 102  -9.959   9.835  -3.688
  765    HB   ILE 102           HB       ILE 102  -8.470  10.012  -5.674
  766   HG12  ILE 102          HG13      ILE 102  -6.638  11.553  -3.831
  767   HG13  ILE 102          HG12      ILE 102  -6.323   9.918  -4.394
  768   HG21  ILE 102          HG21      ILE 102 -10.077  11.754  -5.205
  769   HG22  ILE 102          HG22      ILE 102  -8.597  12.464  -5.851
  770   HG23  ILE 102          HG23      ILE 102  -8.935  12.551  -4.121
  771   HD11  ILE 102          HD11      ILE 102  -6.280  10.741  -6.700
  772   HD12  ILE 102          HD12      ILE 102  -5.069  11.523  -5.684
  773   HD13  ILE 102          HD13      ILE 102  -6.551  12.379  -6.108
  774    H    ARG 103           H        ARG 103  -9.907   7.852  -4.615
  775    HA   ARG 103           HA       ARG 103  -8.375   5.902  -3.166
  776    HB2  ARG 103           HB3      ARG 103  -9.683   4.240  -4.430
  777    HB3  ARG 103           HB2      ARG 103 -10.717   5.454  -3.689
  778    HG2  ARG 103           HG3      ARG 103 -10.994   6.569  -5.812
  779    HG3  ARG 103           HG2      ARG 103  -9.860   5.459  -6.573
  780    HD2  ARG 103           HD3      ARG 103 -11.378   3.588  -6.072
  781    HD3  ARG 103           HD2      ARG 103 -12.523   4.727  -5.358
  782    HE   ARG 103           HE       ARG 103 -12.261   5.762  -7.793
  783   HH11  ARG 103          HH11      ARG 103 -12.665   2.423  -6.817
  784   HH12  ARG 103          HH12      ARG 103 -13.536   1.979  -8.249
  785   HH21  ARG 103          HH21      ARG 103 -13.401   5.184  -9.677
  786   HH22  ARG 103          HH22      ARG 103 -13.957   3.554  -9.877
  787    H    ILE 104           H        ILE 104  -6.511   5.079  -3.717
  788    HA   ILE 104           HA       ILE 104  -5.818   4.909  -6.573
  789    HB   ILE 104           HB       ILE 104  -3.431   5.082  -5.940
  790   HG12  ILE 104          HG13      ILE 104  -4.457   5.898  -3.217
  791   HG13  ILE 104          HG12      ILE 104  -3.737   4.334  -3.576
  792   HG21  ILE 104          HG21      ILE 104  -5.121   7.425  -5.088
  793   HG22  ILE 104          HG22      ILE 104  -4.596   7.056  -6.730
  794   HG23  ILE 104          HG23      ILE 104  -3.409   7.494  -5.502
  795   HD11  ILE 104          HD11      ILE 104  -2.360   6.992  -3.847
  796   HD12  ILE 104          HD12      ILE 104  -1.639   5.409  -4.139
  797   HD13  ILE 104          HD13      ILE 104  -2.157   5.857  -2.513
  798    H    ASP 105           H        ASP 105  -4.756   3.041  -7.241
  799    HA   ASP 105           HA       ASP 105  -5.363   0.644  -5.855
  800    HB2  ASP 105           HB3      ASP 105  -3.454   1.133  -8.162
  801    HB3  ASP 105           HB2      ASP 105  -3.942  -0.461  -7.587
  802    H    THR 106           H        THR 106  -4.399  -0.001  -4.075
  803    HA   THR 106           HA       THR 106  -1.849   1.199  -3.353
  804    HB   THR 106           HB       THR 106  -3.374  -0.604  -1.523
  805    HG1  THR 106           HG1      THR 106  -4.391   1.600  -2.804
  806   HG21  THR 106          HG21      THR 106  -1.288   0.518  -0.809
  807   HG22  THR 106          HG22      THR 106  -2.687   1.033   0.133
  808   HG23  THR 106          HG23      THR 106  -2.044   2.079  -1.131
  809    H    ALA 107           H        ALA 107  -3.305  -2.008  -3.734
  810    HA   ALA 107           HA       ALA 107  -0.726  -3.181  -4.222
  811    HB1  ALA 107           HB1      ALA 107  -0.834  -4.821  -2.423
  812    HB2  ALA 107           HB2      ALA 107  -2.298  -4.058  -1.802
  813    HB3  ALA 107           HB3      ALA 107  -0.768  -3.182  -1.775
  814    H    CYS 108           H        CYS 108  -0.884  -5.001  -5.430
  815    HA   CYS 108           HA       CYS 108  -3.551  -5.854  -6.240
  816    HB2  CYS 108           HB3      CYS 108  -1.821  -5.419  -7.982
  817    HB3  CYS 108           HB2      CYS 108  -0.828  -6.701  -7.287
  818    H    VAL 109           H        VAL 109  -4.407  -7.181  -4.746
  819    HA   VAL 109           HA       VAL 109  -2.630  -9.108  -3.424
  820    HB   VAL 109           HB       VAL 109  -4.308  -9.280  -1.676
  821   HG11  VAL 109          HG11      VAL 109  -2.684  -7.496  -1.467
  822   HG12  VAL 109          HG12      VAL 109  -4.239  -6.979  -0.814
  823   HG13  VAL 109          HG13      VAL 109  -3.717  -6.414  -2.401
  824   HG21  VAL 109          HG21      VAL 109  -6.333  -7.902  -1.683
  825   HG22  VAL 109          HG22      VAL 109  -6.323  -9.038  -3.034
  826   HG23  VAL 109          HG23      VAL 109  -5.946  -7.336  -3.308
  827    H    CYS 110           H        CYS 110  -3.238 -11.279  -3.203
  828    HA   CYS 110           HA       CYS 110  -5.118 -12.211  -5.232
  829    HB2  CYS 110           HB3      CYS 110  -2.967 -13.616  -3.651
  830    HB3  CYS 110           HB2      CYS 110  -4.151 -14.488  -4.615
  831    H    VAL 111           H        VAL 111  -7.116 -12.339  -4.594
  832    HA   VAL 111           HA       VAL 111  -7.887 -12.509  -1.853
  833    HB   VAL 111           HB       VAL 111 -10.158 -12.507  -2.641
  834   HG11  VAL 111          HG11      VAL 111 -10.166 -10.555  -4.135
  835   HG12  VAL 111          HG12      VAL 111  -8.436 -10.773  -4.402
  836   HG13  VAL 111          HG13      VAL 111  -9.038 -10.374  -2.793
  837   HG21  VAL 111          HG21      VAL 111 -10.758 -12.760  -4.991
  838   HG22  VAL 111          HG22      VAL 111  -9.955 -14.207  -4.381
  839   HG23  VAL 111          HG23      VAL 111  -9.070 -13.068  -5.397
  840    H    LEU 112           H        LEU 112  -9.388 -14.207  -1.027
  841    HA   LEU 112           HA       LEU 112  -8.823 -16.825  -2.246
  842    HB2  LEU 112           HB3      LEU 112  -9.240 -16.145   0.670
  843    HB3  LEU 112           HB2      LEU 112  -9.189 -17.781   0.044
  844    HG   LEU 112           HG       LEU 112  -6.913 -15.790   0.052
  845   HD11  LEU 112          HD11      LEU 112  -7.311 -18.397   1.519
  846   HD12  LEU 112          HD12      LEU 112  -7.394 -16.784   2.229
  847   HD13  LEU 112          HD13      LEU 112  -5.869 -17.383   1.576
  848   HD21  LEU 112          HD21      LEU 112  -6.806 -17.127  -1.969
  849   HD22  LEU 112          HD22      LEU 112  -7.019 -18.605  -1.029
  850   HD23  LEU 112          HD23      LEU 112  -5.557 -17.640  -0.835
  851    H    SER 113           H        SER 113 -10.503 -18.037  -2.767
  852    HA   SER 113           HA       SER 113 -13.124 -17.420  -1.593
  853    HB2  SER 113           HB3      SER 113 -13.058 -16.559  -3.909
  854    HB3  SER 113           HB2      SER 113 -12.558 -18.147  -4.487
  855    HG   SER 113           HG       SER 113 -14.823 -17.746  -4.713
  856    H    ARG 114           H        ARG 114 -14.344 -19.210  -1.070
  857    HA   ARG 114           HA       ARG 114 -12.864 -21.636  -0.694
  858    HB2  ARG 114           HB3      ARG 114 -14.576 -20.610   0.905
  859    HB3  ARG 114           HB2      ARG 114 -15.810 -21.244  -0.171
  860    HG2  ARG 114           HG3      ARG 114 -15.487 -22.740   1.693
  861    HG3  ARG 114           HG2      ARG 114 -14.945 -23.516   0.204
  862    HD2  ARG 114           HD3      ARG 114 -12.633 -23.008   0.756
  863    HD3  ARG 114           HD2      ARG 114 -13.147 -22.146   2.204
  864    HE   ARG 114           HE       ARG 114 -14.103 -24.817   2.228
  865   HH11  ARG 114          HH11      ARG 114 -11.173 -22.954   2.663
  866   HH12  ARG 114          HH12      ARG 114 -10.469 -24.078   3.778
  867   HH21  ARG 114          HH21      ARG 114 -13.174 -26.307   3.685
  868   HH22  ARG 114          HH22      ARG 114 -11.607 -25.987   4.360
  869    H    LYS 115           H        LYS 115 -14.045 -20.504  -3.385
  870    HA   LYS 115           HA       LYS 115 -14.414 -21.415  -5.427
  871    HB2  LYS 115           HB3      LYS 115 -14.370 -24.057  -3.955
  872    HB3  LYS 115           HB2      LYS 115 -14.549 -23.914  -5.696
  873    HG2  LYS 115           HG3      LYS 115 -12.361 -22.865  -5.852
  874    HG3  LYS 115           HG2      LYS 115 -12.192 -22.936  -4.094
  875    HD2  LYS 115           HD3      LYS 115 -10.970 -24.752  -5.187
  876    HD3  LYS 115           HD2      LYS 115 -12.265 -25.360  -4.159
  877    HE2  LYS 115           HE3      LYS 115 -13.678 -25.715  -6.081
  878    HE3  LYS 115           HE2      LYS 115 -12.465 -25.003  -7.144
  879    HZ1  LYS 115           HZ1      LYS 115 -10.986 -26.808  -6.676
  880    HZ2  LYS 115           HZ2      LYS 115 -12.474 -27.451  -7.159
  881    HZ3  LYS 115           HZ3      LYS 115 -12.044 -27.455  -5.526
  882    H    ALA 116           H        ALA 116 -16.387 -22.732  -2.822
  883    HA   ALA 116           HA       ALA 116 -18.762 -22.167  -4.476
  884    HB1  ALA 116           HB1      ALA 116 -18.507 -24.080  -2.155
  885    HB2  ALA 116           HB2      ALA 116 -18.596 -24.526  -3.858
  886    HB3  ALA 116           HB3      ALA 116 -19.978 -23.764  -3.071
  887    H    THR 117           H        THR 117 -18.532 -19.930  -3.849
  888    HA   THR 117           HA       THR 117 -19.162 -19.392  -1.026
  889    HB   THR 117           HB       THR 117 -18.373 -17.023  -1.649
  890    HG1  THR 117           HG1      THR 117 -16.617 -17.627  -3.461
  891   HG21  THR 117          HG21      THR 117 -17.079 -18.533  -0.226
  892   HG22  THR 117          HG22      THR 117 -16.019 -17.613  -1.293
  893   HG23  THR 117          HG23      THR 117 -16.388 -19.301  -1.655
  894    H    ARG 118           H        ARG 118 -20.771 -19.820  -3.738
  895    HA   ARG 118           HA       ARG 118 -22.654 -17.621  -3.206
  896    HB2  ARG 118           HB3      ARG 118 -22.019 -18.916  -5.867
  897    HB3  ARG 118           HB2      ARG 118 -23.306 -17.755  -5.610
  898    HG2  ARG 118           HG3      ARG 118 -20.407 -17.151  -5.097
  899    HG3  ARG 118           HG2      ARG 118 -21.205 -16.862  -6.640
  900    HD2  ARG 118           HD3      ARG 118 -21.178 -14.808  -5.405
  901    HD3  ARG 118           HD2      ARG 118 -22.834 -15.401  -5.456
  902    HE   ARG 118           HE       ARG 118 -21.560 -16.294  -3.093
  903   HH11  ARG 118          HH11      ARG 118 -22.824 -13.377  -4.559
  904   HH12  ARG 118          HH12      ARG 118 -23.221 -12.633  -3.044
  905   HH21  ARG 118          HH21      ARG 118 -22.081 -15.322  -1.087
  906   HH22  ARG 118          HH22      ARG 118 -22.793 -13.737  -1.066
  907    H1   SER   1           H1       SER   1 -25.029  -7.204  11.777
  908    H2   SER   1           H2       SER   1 -24.255  -5.988  12.659
  909    H3   SER   1           H3       SER   1 -23.855  -7.608  12.922
  910    HA   SER   1           HA       SER   1 -23.402  -6.117  10.415
  911    HB2  SER   1           HB3      SER   1 -21.946  -5.434  12.343
  912    HB3  SER   1           HB2      SER   1 -21.386  -7.102  12.455
  913    HG   SER   1           HG       SER   1 -21.183  -5.576  10.073
  914    H    SER   2           H        SER   2 -24.367  -7.800   9.212
  915    HA   SER   2           HA       SER   2 -22.635 -10.154   8.965
  916    HB2  SER   2           HB3      SER   2 -24.713 -11.532   8.540
  917    HB3  SER   2           HB2      SER   2 -24.516 -10.982  10.203
  918    HG   SER   2           HG       SER   2 -26.149  -9.594   9.969
  919    H    THR   3           H        THR   3 -23.524  -7.493   7.536
  920    HA   THR   3           HA       THR   3 -24.309  -8.544   4.943
  921    HB   THR   3           HB       THR   3 -24.164  -6.033   4.336
  922    HG1  THR   3           HG1      THR   3 -24.598  -4.846   6.467
  923   HG21  THR   3          HG21      THR   3 -26.180  -6.995   6.370
  924   HG22  THR   3          HG22      THR   3 -26.273  -7.236   4.627
  925   HG23  THR   3          HG23      THR   3 -26.382  -5.609   5.298
  926    H    HIS   4           H        HIS   4 -22.569  -9.605   4.117
  927    HA   HIS   4           HA       HIS   4 -20.292  -7.925   3.400
  928    HB2  HIS   4           HB3      HIS   4 -18.805 -10.003   3.792
  929    HB3  HIS   4           HB2      HIS   4 -19.292  -9.055   5.188
  930    HD1  HIS   4           HD1      HIS   4 -20.404 -10.285   7.041
  931    HD2  HIS   4           HD2      HIS   4 -20.332 -12.489   3.520
  932    HE1  HIS   4           HE1      HIS   4 -21.240 -12.570   7.661
  933    HE2  HIS   4           HE2      HIS   4 -21.046 -13.930   5.549
  934    HA   PRO   5           HA       PRO   5 -21.602  -9.941  -0.424
  935    HB2  PRO   5           HB3      PRO   5 -20.648  -8.061  -2.091
  936    HB3  PRO   5           HB2      PRO   5 -22.131  -7.802  -1.159
  937    HG2  PRO   5           HG3      PRO   5 -19.353  -6.816  -0.623
  938    HG3  PRO   5           HG2      PRO   5 -20.891  -5.947  -0.474
  939    HD2  PRO   5           HD3      PRO   5 -19.551  -7.058   1.643
  940    HD3  PRO   5           HD2      PRO   5 -21.306  -6.803   1.612
  941    H    VAL   6           H        VAL   6 -19.694 -11.309   0.627
  942    HA   VAL   6           HA       VAL   6 -17.787 -12.510   0.334
  943    HB   VAL   6           HB       VAL   6 -17.765 -11.575  -2.536
  944   HG11  VAL   6          HG11      VAL   6 -16.895 -13.833  -2.963
  945   HG12  VAL   6          HG12      VAL   6 -16.946 -14.168  -1.233
  946   HG13  VAL   6          HG13      VAL   6 -15.865 -12.924  -1.860
  947   HG21  VAL   6          HG21      VAL   6 -20.052 -12.227  -2.004
  948   HG22  VAL   6          HG22      VAL   6 -19.474 -13.763  -1.361
  949   HG23  VAL   6          HG23      VAL   6 -19.295 -13.403  -3.078
  950    H    PHE   7           H        PHE   7 -17.590  -9.811   1.225
  951    HA   PHE   7           HA       PHE   7 -16.163  -8.079   1.562
  952    HB2  PHE   7           HB3      PHE   7 -14.190 -10.264   0.876
  953    HB3  PHE   7           HB2      PHE   7 -13.707  -8.679   1.466
  954    HD1  PHE   7           HD1      PHE   7 -15.166 -11.895   2.346
  955    HD2  PHE   7           HD2      PHE   7 -14.208  -7.993   3.748
  956    HE1  PHE   7           HE1      PHE   7 -15.450 -12.663   4.661
  957    HE2  PHE   7           HE2      PHE   7 -14.491  -8.754   6.070
  958    HZ   PHE   7           HZ       PHE   7 -15.112 -11.091   6.530
  959    H    HIS   8           H        HIS   8 -17.359  -8.133  -0.964
  960    HA   HIS   8           HA       HIS   8 -17.314  -6.982  -2.923
  961    HB2  HIS   8           HB3      HIS   8 -16.236  -5.215  -1.528
  962    HB3  HIS   8           HB2      HIS   8 -14.665  -5.895  -1.917
  963    HD1  HIS   8           HD1      HIS   8 -13.653  -4.055  -3.263
  964    HD2  HIS   8           HD2      HIS   8 -17.485  -5.029  -4.551
  965    HE1  HIS   8           HE1      HIS   8 -14.020  -2.732  -5.374
  966    HE2  HIS   8           HE2      HIS   8 -16.397  -3.228  -6.047
  967    H    MET   9           H        MET   9 -15.803  -9.576  -2.328
  968    HA   MET   9           HA       MET   9 -14.255 -11.003  -3.164
  969    HB2  MET   9           HB3      MET   9 -14.604 -11.589  -5.521
  970    HB3  MET   9           HB2      MET   9 -16.119 -11.396  -4.659
  971    HG2  MET   9           HG3      MET   9 -16.340  -9.142  -5.653
  972    HG3  MET   9           HG2      MET   9 -14.880  -9.447  -6.589
  973    HE1  MET   9           HE1      MET   9 -18.591 -10.543  -5.921
  974    HE2  MET   9           HE2      MET   9 -17.699 -12.041  -5.664
  975    HE3  MET   9           HE3      MET   9 -18.776 -11.884  -7.052
  976    H    GLY  10           H        GLY  10 -13.041  -8.694  -2.538
  977    HA2  GLY  10           HA3      GLY  10 -10.764  -8.702  -4.325
  978    HA3  GLY  10           HA2      GLY  10 -11.646  -7.185  -4.278
  979    H    GLU  11           H        GLU  11 -12.382  -7.492  -1.466
  980    HA   GLU  11           HA       GLU  11  -9.923  -6.412  -0.373
  981    HB2  GLU  11           HB3      GLU  11 -12.348  -5.473  -0.109
  982    HB3  GLU  11           HB2      GLU  11 -12.497  -6.696   1.152
  983    HG2  GLU  11           HG3      GLU  11 -11.886  -4.600   2.146
  984    HG3  GLU  11           HG2      GLU  11 -10.529  -5.720   2.280
  985    H    PHE  12           H        PHE  12  -8.934  -8.603  -0.523
  986    HA   PHE  12           HA       PHE  12  -9.510 -10.134   1.927
  987    HB2  PHE  12           HB3      PHE  12  -9.036 -11.142  -0.860
  988    HB3  PHE  12           HB2      PHE  12  -8.583 -12.135   0.521
  989    HD1  PHE  12           HD1      PHE  12 -11.305 -10.868  -1.500
  990    HD2  PHE  12           HD2      PHE  12 -10.304 -12.932   2.081
  991    HE1  PHE  12           HE1      PHE  12 -13.609 -11.699  -1.337
  992    HE2  PHE  12           HE2      PHE  12 -12.611 -13.771   2.250
  993    HZ   PHE  12           HZ       PHE  12 -14.267 -13.154   0.534
  994    H    SER  13           H        SER  13  -7.683 -11.428   2.680
  995    HA   SER  13           HA       SER  13  -5.065 -10.818   1.611
  996    HB2  SER  13           HB3      SER  13  -5.481  -9.041   3.329
  997    HB3  SER  13           HB2      SER  13  -5.701 -10.304   4.533
  998    HG   SER  13           HG       SER  13  -3.559  -9.453   4.511
  999    H    VAL  14           H        VAL  14  -3.570 -12.453   2.091
 1000    HA   VAL  14           HA       VAL  14  -4.811 -14.939   2.953
 1001    HB   VAL  14           HB       VAL  14  -2.653 -15.988   2.189
 1002   HG11  VAL  14          HG11      VAL  14  -4.602 -15.911   0.738
 1003   HG12  VAL  14          HG12      VAL  14  -3.130 -15.685  -0.203
 1004   HG13  VAL  14          HG13      VAL  14  -4.148 -14.299   0.184
 1005   HG21  VAL  14          HG21      VAL  14  -1.122 -14.678   0.841
 1006   HG22  VAL  14          HG22      VAL  14  -1.226 -13.997   2.465
 1007   HG23  VAL  14          HG23      VAL  14  -2.075 -13.224   1.128
 1008    H    CYS  15           H        CYS  15  -3.481 -12.524   4.550
 1009    HA   CYS  15           HA       CYS  15  -2.678 -14.263   6.746
 1010    HB2  CYS  15           HB3      CYS  15  -0.596 -13.525   5.535
 1011    HB3  CYS  15           HB2      CYS  15  -1.029 -11.858   5.918
 1012    H    ASP  16           H        ASP  16  -2.907 -13.246   8.815
 1013    HA   ASP  16           HA       ASP  16  -5.193 -11.626   9.024
 1014    HB2  ASP  16           HB3      ASP  16  -3.034 -12.196  11.075
 1015    HB3  ASP  16           HB2      ASP  16  -4.571 -11.420  11.438
 1016    H    SER  17           H        SER  17  -5.394  -9.572   8.549
 1017    HA   SER  17           HA       SER  17  -3.117  -7.760   9.003
 1018    HB2  SER  17           HB3      SER  17  -5.055  -7.634   6.674
 1019    HB3  SER  17           HB2      SER  17  -3.635  -6.612   6.925
 1020    HG   SER  17           HG       SER  17  -3.466  -9.437   6.698
 1021    H    VAL  18           H        VAL  18  -3.643  -5.620   9.586
 1022    HA   VAL  18           HA       VAL  18  -6.495  -5.093  10.081
 1023    HB   VAL  18           HB       VAL  18  -5.496  -5.571  12.228
 1024   HG11  VAL  18          HG11      VAL  18  -3.502  -3.398  11.609
 1025   HG12  VAL  18          HG12      VAL  18  -3.166  -5.128  11.711
 1026   HG13  VAL  18          HG13      VAL  18  -3.668  -4.242  13.152
 1027   HG21  VAL  18          HG21      VAL  18  -7.186  -3.875  12.228
 1028   HG22  VAL  18          HG22      VAL  18  -6.003  -2.637  11.812
 1029   HG23  VAL  18          HG23      VAL  18  -5.933  -3.427  13.385
 1030    H    SER  19           H        SER  19  -7.162  -3.394   8.960
 1031    HA   SER  19           HA       SER  19  -5.192  -1.449   8.016
 1032    HB2  SER  19           HB3      SER  19  -8.082  -1.859   7.191
 1033    HB3  SER  19           HB2      SER  19  -6.957  -0.719   6.453
 1034    HG   SER  19           HG       SER  19  -5.723  -2.426   5.718
 1035    H    VAL  20           H        VAL  20  -4.888   0.257   9.265
 1036    HA   VAL  20           HA       VAL  20  -7.193   1.349  10.744
 1037    HB   VAL  20           HB       VAL  20  -4.285   1.438  11.553
 1038   HG11  VAL  20          HG11      VAL  20  -6.762   2.344  13.006
 1039   HG12  VAL  20          HG12      VAL  20  -5.485   3.372  12.348
 1040   HG13  VAL  20          HG13      VAL  20  -5.139   2.287  13.695
 1041   HG21  VAL  20          HG21      VAL  20  -6.546  -0.235  12.627
 1042   HG22  VAL  20          HG22      VAL  20  -4.943  -0.107  13.351
 1043   HG23  VAL  20          HG23      VAL  20  -5.132  -0.811  11.745
 1044    H    TRP  21           H        TRP  21  -7.625   3.476  10.487
 1045    HA   TRP  21           HA       TRP  21  -5.758   5.089   8.915
 1046    HB2  TRP  21           HB3      TRP  21  -8.596   5.605   9.838
 1047    HB3  TRP  21           HB2      TRP  21  -7.613   6.807   9.011
 1048    HD1  TRP  21           HD1      TRP  21  -9.554   3.573   8.384
 1049    HE1  TRP  21           HE1      TRP  21  -9.809   3.234   5.845
 1050    HE3  TRP  21           HE3      TRP  21  -6.492   7.335   6.744
 1051    HZ2  TRP  21           HZ2      TRP  21  -8.855   4.413   3.468
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.223   7.660   4.319
 1053    HH2  TRP  21           HH2      TRP  21  -7.378   6.230   2.719
 1054    H    VAL  22           H        VAL  22  -4.136   5.593  10.270
 1055    HA   VAL  22           HA       VAL  22  -4.612   6.280  13.031
 1056    HB   VAL  22           HB       VAL  22  -2.044   6.419  11.438
 1057   HG11  VAL  22          HG11      VAL  22  -1.937   7.764  13.446
 1058   HG12  VAL  22          HG12      VAL  22  -0.947   6.317  13.636
 1059   HG13  VAL  22          HG13      VAL  22  -2.527   6.412  14.413
 1060   HG21  VAL  22          HG21      VAL  22  -3.092   4.206  13.201
 1061   HG22  VAL  22          HG22      VAL  22  -1.506   4.251  12.430
 1062   HG23  VAL  22          HG23      VAL  22  -2.964   4.158  11.443
 1063    H    GLY  23           H        GLY  23  -5.136   8.251  13.698
 1064    HA2  GLY  23           HA3      GLY  23  -4.335  10.545  12.013
 1065    HA3  GLY  23           HA2      GLY  23  -5.805  10.502  12.984
 1066    H    ASP  24           H        ASP  24  -3.026   9.108  14.399
 1067    HA   ASP  24           HA       ASP  24  -2.335  11.565  15.828
 1068    HB2  ASP  24           HB3      ASP  24  -3.403   9.051  17.077
 1069    HB3  ASP  24           HB2      ASP  24  -2.254  10.052  17.964
 1070    H    LYS  25           H        LYS  25  -0.912  10.157  13.814
 1071    HA   LYS  25           HA       LYS  25   1.119   8.541  15.026
 1072    HB2  LYS  25           HB3      LYS  25   0.323   8.573  12.562
 1073    HB3  LYS  25           HB2      LYS  25   1.373   9.969  12.386
 1074    HG2  LYS  25           HG3      LYS  25   3.300   8.657  12.984
 1075    HG3  LYS  25           HG2      LYS  25   2.282   7.253  13.310
 1076    HD2  LYS  25           HD3      LYS  25   1.532   7.368  10.916
 1077    HD3  LYS  25           HD2      LYS  25   2.764   8.602  10.659
 1078    HE2  LYS  25           HE3      LYS  25   3.624   6.451   9.960
 1079    HE3  LYS  25           HE2      LYS  25   4.484   6.986  11.404
 1080    HZ1  LYS  25           HZ1      LYS  25   3.160   5.513  12.737
 1081    HZ2  LYS  25           HZ2      LYS  25   3.856   4.630  11.477
 1082    HZ3  LYS  25           HZ3      LYS  25   2.216   5.058  11.404
 1083    H    THR  26           H        THR  26   3.024   9.206  15.930
 1084    HA   THR  26           HA       THR  26   3.289  12.099  16.258
 1085    HB   THR  26           HB       THR  26   4.717  11.497  18.223
 1086    HG1  THR  26           HG1      THR  26   3.858   9.018  18.614
 1087   HG21  THR  26          HG21      THR  26   2.374  12.057  18.539
 1088   HG22  THR  26          HG22      THR  26   2.830  10.751  19.632
 1089   HG23  THR  26          HG23      THR  26   1.907  10.397  18.172
 1090    H    THR  27           H        THR  27   5.172   9.255  15.358
 1091    HA   THR  27           HA       THR  27   7.177  11.032  14.199
 1092    HB   THR  27           HB       THR  27   8.903   9.259  15.120
 1093    HG1  THR  27           HG1      THR  27   6.762   9.213  17.007
 1094   HG21  THR  27          HG21      THR  27   9.037  11.654  15.530
 1095   HG22  THR  27          HG22      THR  27   9.362  10.762  17.017
 1096   HG23  THR  27          HG23      THR  27   7.792  11.530  16.773
 1097    H    ALA  28           H        ALA  28   8.099  10.291  12.358
 1098    HA   ALA  28           HA       ALA  28   7.747   7.488  11.623
 1099    HB1  ALA  28           HB1      ALA  28   5.708   8.620  10.841
 1100    HB2  ALA  28           HB2      ALA  28   6.684   7.992   9.515
 1101    HB3  ALA  28           HB3      ALA  28   6.706   9.717   9.885
 1102    H    THR  29           H        THR  29   8.896   6.975   9.583
 1103    HA   THR  29           HA       THR  29  11.399   8.486   9.483
 1104    HB   THR  29           HB       THR  29  10.906   5.898   8.042
 1105    HG1  THR  29           HG1      THR  29  11.038   6.325  10.787
 1106   HG21  THR  29          HG21      THR  29  13.301   5.590   8.426
 1107   HG22  THR  29          HG22      THR  29  13.357   7.110   9.320
 1108   HG23  THR  29          HG23      THR  29  12.984   7.114   7.595
 1109    H    ASP  30           H        ASP  30  11.737   9.877   7.915
 1110    HA   ASP  30           HA       ASP  30  10.042  10.113   5.619
 1111    HB2  ASP  30           HB3      ASP  30  11.082  12.095   6.603
 1112    HB3  ASP  30           HB2      ASP  30  12.689  11.427   6.318
 1113    H    ILE  31           H        ILE  31  10.987  10.146   3.363
 1114    HA   ILE  31           HA       ILE  31  11.977   7.618   2.692
 1115    HB   ILE  31           HB       ILE  31  10.676   8.976   1.129
 1116   HG12  ILE  31          HG13      ILE  31  13.444   8.418   0.033
 1117   HG13  ILE  31          HG12      ILE  31  12.183   7.209   0.248
 1118   HG21  ILE  31          HG21      ILE  31  11.553  11.171   1.685
 1119   HG22  ILE  31          HG22      ILE  31  11.675  10.876  -0.048
 1120   HG23  ILE  31          HG23      ILE  31  13.110  10.751   0.970
 1121   HD11  ILE  31          HD11      ILE  31  12.056   9.597  -1.577
 1122   HD12  ILE  31          HD12      ILE  31  10.779   8.401  -1.358
 1123   HD13  ILE  31          HD13      ILE  31  12.325   7.922  -2.061
 1124    H    LYS  32           H        LYS  32  13.636  10.559   3.517
 1125    HA   LYS  32           HA       LYS  32  16.180   9.712   2.459
 1126    HB2  LYS  32           HB3      LYS  32  15.469  11.965   4.340
 1127    HB3  LYS  32           HB2      LYS  32  17.042  11.729   3.592
 1128    HG2  LYS  32           HG3      LYS  32  16.033  12.024   1.386
 1129    HG3  LYS  32           HG2      LYS  32  14.459  12.256   2.141
 1130    HD2  LYS  32           HD3      LYS  32  15.317  14.217   3.306
 1131    HD3  LYS  32           HD2      LYS  32  16.888  13.998   2.536
 1132    HE2  LYS  32           HE3      LYS  32  14.272  14.531   1.142
 1133    HE3  LYS  32           HE2      LYS  32  15.563  15.703   1.390
 1134    HZ1  LYS  32           HZ1      LYS  32  15.598  14.757  -0.841
 1135    HZ2  LYS  32           HZ2      LYS  32  15.792  13.206  -0.203
 1136    HZ3  LYS  32           HZ3      LYS  32  17.006  14.362   0.008
 1137    H    GLY  33           H        GLY  33  14.391   8.762   5.064
 1138    HA2  GLY  33           HA3      GLY  33  15.087   7.075   6.551
 1139    HA3  GLY  33           HA2      GLY  33  16.759   7.556   6.283
 1140    H    LYS  34           H        LYS  34  14.741  10.191   6.821
 1141    HA   LYS  34           HA       LYS  34  15.980  10.651   9.397
 1142    HB2  LYS  34           HB3      LYS  34  14.156  12.356   7.706
 1143    HB3  LYS  34           HB2      LYS  34  14.878  12.878   9.218
 1144    HG2  LYS  34           HG3      LYS  34  16.385  12.093   6.737
 1145    HG3  LYS  34           HG2      LYS  34  16.076  13.735   7.283
 1146    HD2  LYS  34           HD3      LYS  34  17.255  13.107   9.427
 1147    HD3  LYS  34           HD2      LYS  34  17.780  11.640   8.595
 1148    HE2  LYS  34           HE3      LYS  34  19.517  13.292   8.407
 1149    HE3  LYS  34           HE2      LYS  34  18.772  13.069   6.828
 1150    HZ1  LYS  34           HZ1      LYS  34  19.124  15.408   7.332
 1151    HZ2  LYS  34           HZ2      LYS  34  18.160  15.276   8.713
 1152    HZ3  LYS  34           HZ3      LYS  34  17.476  15.066   7.184
 1153    H    GLU  35           H        GLU  35  14.991  10.570  11.329
 1154    HA   GLU  35           HA       GLU  35  12.221   9.736  11.472
 1155    HB2  GLU  35           HB3      GLU  35  13.814   8.745  13.027
 1156    HB3  GLU  35           HB2      GLU  35  14.269  10.338  13.611
 1157    HG2  GLU  35           HG3      GLU  35  12.082  10.660  14.567
 1158    HG3  GLU  35           HG2      GLU  35  11.534   9.125  13.900
 1159    H    VAL  36           H        VAL  36  10.660  11.195  11.340
 1160    HA   VAL  36           HA       VAL  36  11.219  13.909  12.329
 1161    HB   VAL  36           HB       VAL  36   9.608  14.728  10.590
 1162   HG11  VAL  36          HG11      VAL  36  12.093  13.332   9.606
 1163   HG12  VAL  36          HG12      VAL  36  11.997  14.964  10.272
 1164   HG13  VAL  36          HG13      VAL  36  11.216  14.592   8.737
 1165   HG21  VAL  36          HG21      VAL  36   9.944  11.942   9.478
 1166   HG22  VAL  36          HG22      VAL  36   9.143  13.290   8.669
 1167   HG23  VAL  36          HG23      VAL  36   8.459  12.618  10.149
 1168    H    THR  37           H        THR  37   9.468  15.093  13.166
 1169    HA   THR  37           HA       THR  37   7.630  13.408  14.635
 1170    HB   THR  37           HB       THR  37   7.941  16.402  14.783
 1171    HG1  THR  37           HG1      THR  37   9.913  15.727  15.396
 1172   HG21  THR  37          HG21      THR  37   7.006  16.133  17.027
 1173   HG22  THR  37          HG22      THR  37   6.862  14.396  16.763
 1174   HG23  THR  37          HG23      THR  37   5.900  15.517  15.801
 1175    H    VAL  38           H        VAL  38   5.715  12.948  13.827
 1176    HA   VAL  38           HA       VAL  38   4.640  14.433  11.605
 1177    HB   VAL  38           HB       VAL  38   3.468  12.071  13.088
 1178   HG11  VAL  38          HG11      VAL  38   2.779  13.259  10.404
 1179   HG12  VAL  38          HG12      VAL  38   1.779  13.301  11.858
 1180   HG13  VAL  38          HG13      VAL  38   2.116  11.763  11.061
 1181   HG21  VAL  38          HG21      VAL  38   5.631  11.526  12.100
 1182   HG22  VAL  38          HG22      VAL  38   5.082  12.142  10.541
 1183   HG23  VAL  38          HG23      VAL  38   4.320  10.715  11.243
 1184    H    LEU  39           H        LEU  39   2.927  15.789  11.637
 1185    HA   LEU  39           HA       LEU  39   1.855  16.514  14.263
 1186    HB2  LEU  39           HB3      LEU  39   1.596  17.952  11.614
 1187    HB3  LEU  39           HB2      LEU  39   1.110  18.569  13.185
 1188    HG   LEU  39           HG       LEU  39   3.949  17.980  12.347
 1189   HD11  LEU  39          HD11      LEU  39   4.239  20.388  12.312
 1190   HD12  LEU  39          HD12      LEU  39   2.537  20.615  12.714
 1191   HD13  LEU  39          HD13      LEU  39   2.991  19.898  11.168
 1192   HD21  LEU  39          HD21      LEU  39   4.547  19.151  14.417
 1193   HD22  LEU  39          HD22      LEU  39   3.635  17.675  14.729
 1194   HD23  LEU  39          HD23      LEU  39   2.839  19.245  14.846
 1195    H    ALA  40           H        ALA  40   0.032  15.525  14.794
 1196    HA   ALA  40           HA       ALA  40  -1.644  14.168  12.961
 1197    HB1  ALA  40           HB1      ALA  40  -2.245  15.059  15.780
 1198    HB2  ALA  40           HB2      ALA  40  -1.457  13.548  15.332
 1199    HB3  ALA  40           HB3      ALA  40  -3.131  13.842  14.862
 1200    H    GLU  41           H        GLU  41  -1.707  17.306  14.473
 1201    HA   GLU  41           HA       GLU  41  -3.981  18.089  12.771
 1202    HB2  GLU  41           HB3      GLU  41  -2.990  19.328  15.353
 1203    HB3  GLU  41           HB2      GLU  41  -4.370  19.881  14.417
 1204    HG2  GLU  41           HG3      GLU  41  -4.309  17.074  15.401
 1205    HG3  GLU  41           HG2      GLU  41  -4.696  18.377  16.522
 1206    H    VAL  42           H        VAL  42  -3.305  19.254  11.056
 1207    HA   VAL  42           HA       VAL  42  -0.714  20.614  11.298
 1208    HB   VAL  42           HB       VAL  42  -0.576  20.557   8.849
 1209   HG11  VAL  42          HG11      VAL  42  -0.307  18.116   8.595
 1210   HG12  VAL  42          HG12      VAL  42  -1.128  17.893  10.140
 1211   HG13  VAL  42          HG13      VAL  42   0.416  18.745  10.075
 1212   HG21  VAL  42          HG21      VAL  42  -2.162  19.286   7.518
 1213   HG22  VAL  42          HG22      VAL  42  -2.969  20.624   8.335
 1214   HG23  VAL  42          HG23      VAL  42  -3.144  18.981   8.949
 1215    H    ASN  43           H        ASN  43  -0.536  22.735  11.103
 1216    HA   ASN  43           HA       ASN  43  -2.962  24.283  10.586
 1217    HB2  ASN  43           HB3      ASN  43  -0.261  25.135  11.672
 1218    HB3  ASN  43           HB2      ASN  43  -1.637  26.208  11.452
 1219   HD21  ASN  43          HD21      ASN  43  -0.227  23.723  13.394
 1220   HD22  ASN  43          HD22      ASN  43  -1.386  23.769  14.671
 1221    H    ILE  44           H        ILE  44  -3.218  24.386   8.418
 1222    HA   ILE  44           HA       ILE  44  -0.941  25.432   6.858
 1223    HB   ILE  44           HB       ILE  44  -3.284  23.816   5.827
 1224   HG12  ILE  44          HG13      ILE  44  -0.390  22.982   6.144
 1225   HG13  ILE  44          HG12      ILE  44  -1.686  22.513   7.242
 1226   HG21  ILE  44          HG21      ILE  44  -2.005  23.730   3.735
 1227   HG22  ILE  44          HG22      ILE  44  -0.774  24.770   4.448
 1228   HG23  ILE  44          HG23      ILE  44  -2.404  25.387   4.183
 1229   HD11  ILE  44          HD11      ILE  44  -2.804  21.329   5.439
 1230   HD12  ILE  44          HD12      ILE  44  -1.153  20.746   5.646
 1231   HD13  ILE  44          HD13      ILE  44  -1.545  21.831   4.312
 1232    H    ASN  45           H        ASN  45  -1.269  27.574   6.913
 1233    HA   ASN  45           HA       ASN  45  -2.180  29.618   6.553
 1234    HB2  ASN  45           HB3      ASN  45  -2.372  28.585   4.234
 1235    HB3  ASN  45           HB2      ASN  45  -4.059  28.248   4.617
 1236   HD21  ASN  45          HD21      ASN  45  -1.687  30.757   4.096
 1237   HD22  ASN  45          HD22      ASN  45  -2.818  32.021   3.754
 1238    H    ASN  46           H        ASN  46  -3.015  28.556   8.799
 1239    HA   ASN  46           HA       ASN  46  -4.541  28.749  10.452
 1240    HB2  ASN  46           HB3      ASN  46  -5.848  30.601   8.462
 1241    HB3  ASN  46           HB2      ASN  46  -6.454  30.362  10.098
 1242   HD21  ASN  46          HD21      ASN  46  -5.332  32.742   8.754
 1243   HD22  ASN  46          HD22      ASN  46  -4.031  33.268   9.763
 1244    H    SER  47           H        SER  47  -4.873  26.763   8.161
 1245    HA   SER  47           HA       SER  47  -7.600  25.947   8.905
 1246    HB2  SER  47           HB3      SER  47  -7.351  26.449   6.478
 1247    HB3  SER  47           HB2      SER  47  -6.076  25.237   6.379
 1248    HG   SER  47           HG       SER  47  -8.711  24.664   7.269
 1249    H    VAL  48           H        VAL  48  -7.681  24.190  10.144
 1250    HA   VAL  48           HA       VAL  48  -5.206  22.652  10.483
 1251    HB   VAL  48           HB       VAL  48  -7.575  22.836  12.350
 1252   HG11  VAL  48          HG11      VAL  48  -6.342  20.749  12.577
 1253   HG12  VAL  48          HG12      VAL  48  -6.090  21.783  13.983
 1254   HG13  VAL  48          HG13      VAL  48  -4.834  21.646  12.754
 1255   HG21  VAL  48          HG21      VAL  48  -4.888  24.193  12.503
 1256   HG22  VAL  48          HG22      VAL  48  -6.140  24.241  13.746
 1257   HG23  VAL  48          HG23      VAL  48  -6.433  24.977  12.169
 1258    H    PHE  49           H        PHE  49  -5.200  20.881   9.283
 1259    HA   PHE  49           HA       PHE  49  -7.634  19.220   9.206
 1260    HB2  PHE  49           HB3      PHE  49  -5.279  19.382   7.316
 1261    HB3  PHE  49           HB2      PHE  49  -6.427  18.048   7.279
 1262    HD1  PHE  49           HD1      PHE  49  -5.693  21.312   6.100
 1263    HD2  PHE  49           HD2      PHE  49  -8.902  18.654   6.967
 1264    HE1  PHE  49           HE1      PHE  49  -7.167  22.610   4.617
 1265    HE2  PHE  49           HE2      PHE  49 -10.380  19.949   5.490
 1266    HZ   PHE  49           HZ       PHE  49  -9.513  21.928   4.311
 1267    H    ARG  50           H        ARG  50  -7.454  16.992   9.665
 1268    HA   ARG  50           HA       ARG  50  -5.108  16.321  11.276
 1269    HB2  ARG  50           HB3      ARG  50  -7.296  15.998  12.346
 1270    HB3  ARG  50           HB2      ARG  50  -7.771  14.894  11.062
 1271    HG2  ARG  50           HG3      ARG  50  -6.286  13.243  11.766
 1272    HG3  ARG  50           HG2      ARG  50  -5.348  14.373  12.742
 1273    HD2  ARG  50           HD3      ARG  50  -8.190  13.546  13.306
 1274    HD3  ARG  50           HD2      ARG  50  -6.765  12.865  14.092
 1275    HE   ARG  50           HE       ARG  50  -7.068  15.756  14.264
 1276   HH11  ARG  50          HH11      ARG  50  -7.471  12.634  15.818
 1277   HH12  ARG  50          HH12      ARG  50  -7.677  13.314  17.403
 1278   HH21  ARG  50          HH21      ARG  50  -7.324  16.639  16.347
 1279   HH22  ARG  50          HH22      ARG  50  -7.579  15.590  17.708
 1280    H    GLN  51           H        GLN  51  -3.767  14.689  10.810
 1281    HA   GLN  51           HA       GLN  51  -3.780  13.806   8.053
 1282    HB2  GLN  51           HB3      GLN  51  -1.755  13.440  10.266
 1283    HB3  GLN  51           HB2      GLN  51  -1.520  12.937   8.597
 1284    HG2  GLN  51           HG3      GLN  51  -1.937  15.758   9.556
 1285    HG3  GLN  51           HG2      GLN  51  -0.410  15.044   9.033
 1286   HE21  GLN  51          HE21      GLN  51  -1.941  17.333   7.983
 1287   HE22  GLN  51          HE22      GLN  51  -2.210  16.983   6.311
 1288    H    TYR  52           H        TYR  52  -5.016  12.086   7.612
 1289    HA   TYR  52           HA       TYR  52  -5.093   9.830   9.465
 1290    HB2  TYR  52           HB3      TYR  52  -6.497  10.101   6.792
 1291    HB3  TYR  52           HB2      TYR  52  -6.845   8.932   8.057
 1292    HD1  TYR  52           HD1      TYR  52  -7.755   9.836  10.284
 1293    HD2  TYR  52           HD2      TYR  52  -7.611  12.141   6.712
 1294    HE1  TYR  52           HE1      TYR  52  -9.466  11.349  11.194
 1295    HE2  TYR  52           HE2      TYR  52  -9.317  13.661   7.617
 1296    HH   TYR  52           HH       TYR  52 -10.247  13.669  10.873
 1297    H    PHE  53           H        PHE  53  -3.707   8.191   9.249
 1298    HA   PHE  53           HA       PHE  53  -2.470   7.756   6.611
 1299    HB2  PHE  53           HB3      PHE  53  -1.383   7.020   9.341
 1300    HB3  PHE  53           HB2      PHE  53  -0.564   6.770   7.800
 1301    HD1  PHE  53           HD1      PHE  53  -0.270   8.937   6.354
 1302    HD2  PHE  53           HD2      PHE  53  -0.891   8.903  10.557
 1303    HE1  PHE  53           HE1      PHE  53   0.728  11.176   6.507
 1304    HE2  PHE  53           HE2      PHE  53   0.101  11.147  10.724
 1305    HZ   PHE  53           HZ       PHE  53   0.911  12.287   8.698
 1306    H    PHE  54           H        PHE  54  -2.940   5.941   5.599
 1307    HA   PHE  54           HA       PHE  54  -4.590   3.952   6.904
 1308    HB2  PHE  54           HB3      PHE  54  -5.138   4.741   4.629
 1309    HB3  PHE  54           HB2      PHE  54  -3.589   4.148   4.045
 1310    HD1  PHE  54           HD1      PHE  54  -3.426   1.999   3.183
 1311    HD2  PHE  54           HD2      PHE  54  -6.733   3.006   5.668
 1312    HE1  PHE  54           HE1      PHE  54  -4.469  -0.165   2.666
 1313    HE2  PHE  54           HE2      PHE  54  -7.778   0.839   5.158
 1314    HZ   PHE  54           HZ       PHE  54  -6.646  -0.748   3.654
 1315    H    GLU  55           H        GLU  55  -3.350   2.775   8.277
 1316    HA   GLU  55           HA       GLU  55  -0.960   1.468   7.168
 1317    HB2  GLU  55           HB3      GLU  55  -1.784   1.847  10.061
 1318    HB3  GLU  55           HB2      GLU  55  -0.342   0.995   9.528
 1319    HG2  GLU  55           HG3      GLU  55   0.366   3.162   8.420
 1320    HG3  GLU  55           HG2      GLU  55  -0.951   3.933   9.307
 1321    H    THR  56           H        THR  56  -1.476  -0.424   6.314
 1322    HA   THR  56           HA       THR  56  -3.342  -2.185   7.727
 1323    HB   THR  56           HB       THR  56  -1.975  -2.632   5.062
 1324    HG1  THR  56           HG1      THR  56  -3.425  -1.182   4.484
 1325   HG21  THR  56          HG21      THR  56  -2.642  -4.710   6.187
 1326   HG22  THR  56          HG22      THR  56  -3.641  -4.407   4.765
 1327   HG23  THR  56          HG23      THR  56  -4.279  -4.084   6.376
 1328    H    LYS  57           H        LYS  57  -2.344  -3.088   9.396
 1329    HA   LYS  57           HA       LYS  57   0.497  -3.784   9.140
 1330    HB2  LYS  57           HB3      LYS  57  -1.134  -3.415  11.660
 1331    HB3  LYS  57           HB2      LYS  57   0.620  -3.510  11.538
 1332    HG2  LYS  57           HG3      LYS  57   0.693  -1.402  10.361
 1333    HG3  LYS  57           HG2      LYS  57  -1.065  -1.317  10.338
 1334    HD2  LYS  57           HD3      LYS  57  -0.508   0.070  12.107
 1335    HD3  LYS  57           HD2      LYS  57  -0.857  -1.459  12.911
 1336    HE2  LYS  57           HE3      LYS  57   1.135  -0.567  13.862
 1337    HE3  LYS  57           HE2      LYS  57   1.577  -1.953  12.867
 1338    HZ1  LYS  57           HZ1      LYS  57   3.005   0.094  12.648
 1339    HZ2  LYS  57           HZ2      LYS  57   1.705   0.830  11.848
 1340    HZ3  LYS  57           HZ3      LYS  57   2.431  -0.556  11.197
 1341    H    CYS  58           H        CYS  58   1.258  -5.743  10.069
 1342    HA   CYS  58           HA       CYS  58  -0.481  -7.967   9.587
 1343    HB2  CYS  58           HB3      CYS  58   2.321  -7.882  10.739
 1344    HB3  CYS  58           HB2      CYS  58   1.475  -9.346  10.257
 1345    H    ARG  59           H        ARG  59  -2.020  -8.454  11.003
 1346    HA   ARG  59           HA       ARG  59  -1.890  -7.925  13.791
 1347    HB2  ARG  59           HB3      ARG  59  -3.720  -9.486  12.014
 1348    HB3  ARG  59           HB2      ARG  59  -3.824  -9.719  13.751
 1349    HG2  ARG  59           HG3      ARG  59  -4.289  -7.359  14.058
 1350    HG3  ARG  59           HG2      ARG  59  -4.118  -7.091  12.325
 1351    HD2  ARG  59           HD3      ARG  59  -6.055  -8.351  11.840
 1352    HD3  ARG  59           HD2      ARG  59  -6.123  -9.016  13.470
 1353    HE   ARG  59           HE       ARG  59  -6.457  -6.490  14.051
 1354   HH11  ARG  59          HH11      ARG  59  -7.798  -8.201  11.307
 1355   HH12  ARG  59          HH12      ARG  59  -9.261  -7.278  11.285
 1356   HH21  ARG  59          HH21      ARG  59  -8.374  -5.267  14.022
 1357   HH22  ARG  59          HH22      ARG  59  -9.585  -5.592  12.823
 1358    H    ALA  60           H        ALA  60  -1.576 -10.897  11.889
 1359    HA   ALA  60           HA       ALA  60   0.147 -12.020  13.942
 1360    HB1  ALA  60           HB1      ALA  60  -1.139 -14.094  14.107
 1361    HB2  ALA  60           HB2      ALA  60  -2.377 -13.419  13.050
 1362    HB3  ALA  60           HB3      ALA  60  -2.096 -12.713  14.640
 1363    H    SER  61           H        SER  61   1.834 -12.079  12.529
 1364    HA   SER  61           HA       SER  61   1.656 -12.988   9.859
 1365    HB2  SER  61           HB3      SER  61   4.186 -13.159  10.072
 1366    HB3  SER  61           HB2      SER  61   3.491 -11.576  10.426
 1367    HG   SER  61           HG       SER  61   4.049 -11.762  12.460
 1368    H    ASN  62           H        ASN  62   2.034 -14.948   8.951
 1369    HA   ASN  62           HA       ASN  62   2.202 -17.203   8.727
 1370    HB2  ASN  62           HB3      ASN  62   3.490 -17.036  11.456
 1371    HB3  ASN  62           HB2      ASN  62   3.324 -18.537  10.553
 1372   HD21  ASN  62          HD21      ASN  62   3.812 -17.318   7.972
 1373   HD22  ASN  62          HD22      ASN  62   5.505 -16.966   7.921
 1374    HA   PRO  63           HA       PRO  63  -1.777 -17.507  11.181
 1375    HB2  PRO  63           HB3      PRO  63  -3.213 -18.308   8.960
 1376    HB3  PRO  63           HB2      PRO  63  -3.102 -16.635   9.527
 1377    HG2  PRO  63           HG3      PRO  63  -1.591 -18.009   7.343
 1378    HG3  PRO  63           HG2      PRO  63  -2.254 -16.365   7.384
 1379    HD2  PRO  63           HD3      PRO  63   0.375 -16.839   7.763
 1380    HD3  PRO  63           HD2      PRO  63  -0.475 -15.542   8.639
 1381    H    VAL  64           H        VAL  64  -0.115 -19.473   8.823
 1382    HA   VAL  64           HA       VAL  64  -1.086 -21.898  10.175
 1383    HB   VAL  64           HB       VAL  64  -0.426 -23.144   8.163
 1384   HG11  VAL  64          HG11      VAL  64  -2.162 -22.312   6.643
 1385   HG12  VAL  64          HG12      VAL  64  -2.247 -20.817   7.575
 1386   HG13  VAL  64          HG13      VAL  64  -2.711 -22.347   8.320
 1387   HG21  VAL  64          HG21      VAL  64   0.187 -21.959   6.111
 1388   HG22  VAL  64          HG22      VAL  64   1.380 -21.720   7.387
 1389   HG23  VAL  64          HG23      VAL  64   0.228 -20.442   7.005
 1390    H    GLU  65           H        GLU  65   0.613 -23.673  10.235
 1391    HA   GLU  65           HA       GLU  65   2.924 -22.546  11.540
 1392    HB2  GLU  65           HB3      GLU  65   2.115 -25.422  11.122
 1393    HB3  GLU  65           HB2      GLU  65   3.420 -24.871  12.159
 1394    HG2  GLU  65           HG3      GLU  65   1.842 -23.707  13.574
 1395    HG3  GLU  65           HG2      GLU  65   0.516 -24.182  12.512
 1396    H    SER  66           H        SER  66   3.325 -21.736   9.135
 1397    HA   SER  66           HA       SER  66   5.750 -22.958   8.335
 1398    HB2  SER  66           HB3      SER  66   4.942 -23.454   5.946
 1399    HB3  SER  66           HB2      SER  66   4.479 -24.614   7.193
 1400    HG   SER  66           HG       SER  66   2.860 -23.516   5.561
 1401    H    GLY  67           H        GLY  67   3.148 -21.231   6.633
 1402    HA2  GLY  67           HA3      GLY  67   4.709 -18.774   6.727
 1403    HA3  GLY  67           HA2      GLY  67   4.414 -19.456   5.130
 1404    H    CYS  68           H        CYS  68   2.220 -19.646   4.396
 1405    HA   CYS  68           HA       CYS  68   0.267 -18.037   5.881
 1406    HB2  CYS  68           HB3      CYS  68   1.214 -17.474   3.067
 1407    HB3  CYS  68           HB2      CYS  68  -0.323 -16.867   3.690
 1408    H    ARG  69           H        ARG  69  -1.907 -18.053   4.568
 1409    HA   ARG  69           HA       ARG  69  -2.615 -20.823   4.389
 1410    HB2  ARG  69           HB3      ARG  69  -4.282 -18.385   3.702
 1411    HB3  ARG  69           HB2      ARG  69  -4.890 -20.021   3.922
 1412    HG2  ARG  69           HG3      ARG  69  -4.042 -19.894   6.296
 1413    HG3  ARG  69           HG2      ARG  69  -3.746 -18.178   6.004
 1414    HD2  ARG  69           HD3      ARG  69  -6.144 -17.940   5.359
 1415    HD3  ARG  69           HD2      ARG  69  -6.398 -19.614   5.865
 1416    HE   ARG  69           HE       ARG  69  -5.491 -17.476   7.695
 1417   HH11  ARG  69          HH11      ARG  69  -7.405 -20.337   7.036
 1418   HH12  ARG  69          HH12      ARG  69  -8.147 -20.354   8.601
 1419   HH21  ARG  69          HH21      ARG  69  -6.467 -17.501   9.758
 1420   HH22  ARG  69          HH22      ARG  69  -7.614 -18.744  10.148
 1421    H    GLY  70           H        GLY  70  -2.968 -22.053   2.610
 1422    HA2  GLY  70           HA3      GLY  70  -3.323 -22.520   0.340
 1423    HA3  GLY  70           HA2      GLY  70  -3.088 -20.816  -0.024
 1424    H    ILE  71           H        ILE  71  -0.659 -20.322   1.103
 1425    HA   ILE  71           HA       ILE  71   1.143 -21.492  -0.806
 1426    HB   ILE  71           HB       ILE  71   1.964 -19.782   1.544
 1427   HG12  ILE  71          HG13      ILE  71   0.018 -18.708   0.429
 1428   HG13  ILE  71          HG12      ILE  71   1.502 -17.778   0.267
 1429   HG21  ILE  71          HG21      ILE  71   3.064 -20.223  -1.223
 1430   HG22  ILE  71          HG22      ILE  71   3.835 -20.573   0.327
 1431   HG23  ILE  71          HG23      ILE  71   3.590 -18.902  -0.179
 1432   HD11  ILE  71          HD11      ILE  71   0.268 -19.540  -1.835
 1433   HD12  ILE  71          HD12      ILE  71   1.781 -18.650  -2.005
 1434   HD13  ILE  71          HD13      ILE  71   0.261 -17.778  -1.802
 1435    H    ASP  72           H        ASP  72   3.400 -22.160   0.160
 1436    HA   ASP  72           HA       ASP  72   4.740 -23.441   1.460
 1437    HB2  ASP  72           HB3      ASP  72   2.535 -23.142   3.510
 1438    HB3  ASP  72           HB2      ASP  72   4.112 -23.861   3.829
 1439    H    SER  73           H        SER  73   4.030 -24.928  -0.302
 1440    HA   SER  73           HA       SER  73   2.698 -27.267   0.877
 1441    HB2  SER  73           HB3      SER  73   2.895 -26.587  -2.069
 1442    HB3  SER  73           HB2      SER  73   1.968 -27.903  -1.345
 1443    HG   SER  73           HG       SER  73   0.642 -26.365  -0.353
 1444    H    LYS  74           H        LYS  74   4.967 -26.586  -1.811
 1445    HA   LYS  74           HA       LYS  74   6.577 -28.845  -0.845
 1446    HB2  LYS  74           HB3      LYS  74   5.905 -28.195  -3.716
 1447    HB3  LYS  74           HB2      LYS  74   7.004 -29.461  -3.198
 1448    HG2  LYS  74           HG3      LYS  74   5.148 -30.585  -2.046
 1449    HG3  LYS  74           HG2      LYS  74   4.057 -29.320  -2.610
 1450    HD2  LYS  74           HD3      LYS  74   5.657 -31.157  -4.381
 1451    HD3  LYS  74           HD2      LYS  74   3.944 -31.340  -4.009
 1452    HE2  LYS  74           HE3      LYS  74   3.546 -29.103  -5.004
 1453    HE3  LYS  74           HE2      LYS  74   5.247 -29.043  -5.461
 1454    HZ1  LYS  74           HZ1      LYS  74   4.911 -31.008  -6.824
 1455    HZ2  LYS  74           HZ2      LYS  74   3.867 -29.767  -7.300
 1456    HZ3  LYS  74           HZ3      LYS  74   3.280 -31.059  -6.388
 1457    H    HIS  75           H        HIS  75   6.734 -26.128  -3.193
 1458    HA   HIS  75           HA       HIS  75   9.604 -25.968  -2.545
 1459    HB2  HIS  75           HB3      HIS  75   8.158 -25.450  -5.140
 1460    HB3  HIS  75           HB2      HIS  75   9.813 -24.924  -4.859
 1461    HD1  HIS  75           HD1      HIS  75  11.650 -26.702  -4.916
 1462    HD2  HIS  75           HD2      HIS  75   7.823 -28.255  -5.387
 1463    HE1  HIS  75           HE1      HIS  75  11.971 -29.077  -5.678
 1464    HE2  HIS  75           HE2      HIS  75   9.645 -29.954  -6.078
 1465    H    TRP  76           H        TRP  76   6.911 -24.387  -1.776
 1466    HA   TRP  76           HA       TRP  76   8.278 -21.788  -1.873
 1467    HB2  TRP  76           HB3      TRP  76   5.330 -22.351  -2.215
 1468    HB3  TRP  76           HB2      TRP  76   5.957 -20.749  -1.826
 1469    HD1  TRP  76           HD1      TRP  76   4.938 -22.705  -4.707
 1470    HE1  TRP  76           HE1      TRP  76   5.905 -21.742  -6.889
 1471    HE3  TRP  76           HE3      TRP  76   8.510 -19.618  -2.732
 1472    HZ2  TRP  76           HZ2      TRP  76   7.908 -19.920  -7.669
 1473    HZ3  TRP  76           HZ3      TRP  76   9.909 -18.301  -4.269
 1474    HH2  TRP  76           HH2      TRP  76   9.613 -18.452  -6.687
 1475    H    ASN  77           H        ASN  77   8.472 -20.695  -0.075
 1476    HA   ASN  77           HA       ASN  77   6.939 -21.516   2.306
 1477    HB2  ASN  77           HB3      ASN  77   9.337 -22.174   2.467
 1478    HB3  ASN  77           HB2      ASN  77   9.798 -20.498   2.214
 1479   HD21  ASN  77          HD21      ASN  77   9.481 -19.008   3.872
 1480   HD22  ASN  77          HD22      ASN  77   9.173 -19.502   5.500
 1481    H    SER  78           H        SER  78   5.962 -19.839   3.417
 1482    HA   SER  78           HA       SER  78   6.289 -17.203   2.131
 1483    HB2  SER  78           HB3      SER  78   4.107 -18.493   1.776
 1484    HB3  SER  78           HB2      SER  78   3.758 -18.148   3.469
 1485    HG   SER  78           HG       SER  78   4.326 -16.208   1.470
 1486    H    TYR  79           H        TYR  79   5.329 -15.406   3.529
 1487    HA   TYR  79           HA       TYR  79   5.340 -15.591   6.343
 1488    HB2  TYR  79           HB3      TYR  79   7.768 -15.823   6.090
 1489    HB3  TYR  79           HB2      TYR  79   7.822 -14.365   5.099
 1490    HD1  TYR  79           HD1      TYR  79   8.260 -12.318   6.115
 1491    HD2  TYR  79           HD2      TYR  79   6.815 -15.531   8.499
 1492    HE1  TYR  79           HE1      TYR  79   8.566 -10.949   8.132
 1493    HE2  TYR  79           HE2      TYR  79   7.118 -14.171  10.526
 1494    HH   TYR  79           HH       TYR  79   8.349 -12.263  11.301
 1495    H    CYS  80           H        CYS  80   4.462 -13.753   7.234
 1496    HA   CYS  80           HA       CYS  80   3.353 -11.877   5.327
 1497    HB2  CYS  80           HB3      CYS  80   2.934 -11.850   8.314
 1498    HB3  CYS  80           HB2      CYS  80   1.864 -11.226   7.057
 1499    H    THR  81           H        THR  81   4.323 -10.042   4.839
 1500    HA   THR  81           HA       THR  81   5.781  -8.595   6.942
 1501    HB   THR  81           HB       THR  81   6.726  -8.817   4.070
 1502    HG1  THR  81           HG1      THR  81   6.919 -10.739   5.556
 1503   HG21  THR  81          HG21      THR  81   8.759  -7.735   4.912
 1504   HG22  THR  81          HG22      THR  81   8.042  -7.624   6.517
 1505   HG23  THR  81          HG23      THR  81   7.346  -6.716   5.176
 1506    H    THR  82           H        THR  82   5.224  -6.473   7.050
 1507    HA   THR  82           HA       THR  82   3.239  -5.476   5.230
 1508    HB   THR  82           HB       THR  82   3.589  -3.326   6.612
 1509    HG1  THR  82           HG1      THR  82   4.893  -3.413   8.295
 1510   HG21  THR  82          HG21      THR  82   2.605  -5.870   7.898
 1511   HG22  THR  82          HG22      THR  82   1.662  -4.737   6.928
 1512   HG23  THR  82          HG23      THR  82   2.285  -4.245   8.503
 1513    H    THR  83           H        THR  83   3.702  -4.568   3.347
 1514    HA   THR  83           HA       THR  83   6.329  -3.554   2.770
 1515    HB   THR  83           HB       THR  83   4.875  -4.565   0.994
 1516    HG1  THR  83           HG1      THR  83   6.241  -3.423  -0.153
 1517   HG21  THR  83          HG21      THR  83   3.109  -3.184  -0.012
 1518   HG22  THR  83          HG22      THR  83   3.312  -1.998   1.279
 1519   HG23  THR  83          HG23      THR  83   2.726  -3.617   1.655
 1520    H    HIS  84           H        HIS  84   6.726  -1.278   2.194
 1521    HA   HIS  84           HA       HIS  84   5.074   0.471   3.889
 1522    HB2  HIS  84           HB3      HIS  84   7.238   1.671   4.466
 1523    HB3  HIS  84           HB2      HIS  84   7.023   0.077   5.176
 1524    HD1  HIS  84           HD1      HIS  84   8.756  -1.676   4.651
 1525    HD2  HIS  84           HD2      HIS  84   9.197   1.754   2.343
 1526    HE1  HIS  84           HE1      HIS  84  10.946  -1.943   3.461
 1527    HE2  HIS  84           HE2      HIS  84  11.062   0.020   1.893
 1528    H    THR  85           H        THR  85   4.399   2.301   3.012
 1529    HA   THR  85           HA       THR  85   5.683   3.145   0.492
 1530    HB   THR  85           HB       THR  85   3.261   2.409   0.308
 1531    HG1  THR  85           HG1      THR  85   3.013   3.878  -1.244
 1532   HG21  THR  85          HG21      THR  85   2.432   3.301   2.423
 1533   HG22  THR  85          HG22      THR  85   1.543   4.002   1.071
 1534   HG23  THR  85          HG23      THR  85   2.791   4.942   1.889
 1535    H    PHE  86           H        PHE  86   5.664   5.509   0.126
 1536    HA   PHE  86           HA       PHE  86   6.126   6.883   2.680
 1537    HB2  PHE  86           HB3      PHE  86   7.287   7.481  -0.058
 1538    HB3  PHE  86           HB2      PHE  86   7.615   8.402   1.410
 1539    HD1  PHE  86           HD1      PHE  86   8.880   7.367   3.260
 1540    HD2  PHE  86           HD2      PHE  86   8.388   5.424  -0.494
 1541    HE1  PHE  86           HE1      PHE  86  10.740   5.853   3.807
 1542    HE2  PHE  86           HE2      PHE  86  10.245   3.904   0.045
 1543    HZ   PHE  86           HZ       PHE  86  11.422   4.114   2.196
 1544    H    VAL  87           H        VAL  87   4.619   8.263   3.242
 1545    HA   VAL  87           HA       VAL  87   2.951   9.453   1.131
 1546    HB   VAL  87           HB       VAL  87   1.241   9.778   2.945
 1547   HG11  VAL  87          HG11      VAL  87   1.028   7.954   1.372
 1548   HG12  VAL  87          HG12      VAL  87   0.528   7.419   2.977
 1549   HG13  VAL  87          HG13      VAL  87   2.107   6.954   2.346
 1550   HG21  VAL  87          HG21      VAL  87   1.451   8.422   4.978
 1551   HG22  VAL  87          HG22      VAL  87   2.705   9.655   4.884
 1552   HG23  VAL  87          HG23      VAL  87   3.088   7.976   4.507
 1553    H    LYS  88           H        LYS  88   2.661  11.613   1.034
 1554    HA   LYS  88           HA       LYS  88   4.523  13.309   2.319
 1555    HB2  LYS  88           HB3      LYS  88   3.295  15.163   1.236
 1556    HB3  LYS  88           HB2      LYS  88   3.675  13.869   0.110
 1557    HG2  LYS  88           HG3      LYS  88   1.445  13.157   0.005
 1558    HG3  LYS  88           HG2      LYS  88   1.003  14.051   1.455
 1559    HD2  LYS  88           HD3      LYS  88   1.460  16.156   0.236
 1560    HD3  LYS  88           HD2      LYS  88   1.744  15.209  -1.225
 1561    HE2  LYS  88           HE3      LYS  88  -0.812  15.174   0.366
 1562    HE3  LYS  88           HE2      LYS  88  -0.545  16.172  -1.061
 1563    HZ1  LYS  88           HZ1      LYS  88  -1.730  14.016  -1.450
 1564    HZ2  LYS  88           HZ2      LYS  88  -0.273  13.220  -1.099
 1565    HZ3  LYS  88           HZ3      LYS  88  -0.362  14.276  -2.420
 1566    H    ALA  89           H        ALA  89   4.470  13.893   4.343
 1567    HA   ALA  89           HA       ALA  89   1.886  14.640   5.545
 1568    HB1  ALA  89           HB1      ALA  89   4.110  13.164   6.955
 1569    HB2  ALA  89           HB2      ALA  89   2.582  12.456   6.431
 1570    HB3  ALA  89           HB3      ALA  89   2.595  13.705   7.677
 1571    H    LEU  90           H        LEU  90   1.918  16.489   6.790
 1572    HA   LEU  90           HA       LEU  90   4.268  18.143   6.607
 1573    HB2  LEU  90           HB3      LEU  90   1.927  19.058   6.461
 1574    HB3  LEU  90           HB2      LEU  90   1.719  18.650   8.158
 1575    HG   LEU  90           HG       LEU  90   3.706  20.176   8.629
 1576   HD11  LEU  90          HD11      LEU  90   3.118  21.025   5.798
 1577   HD12  LEU  90          HD12      LEU  90   4.619  20.319   6.402
 1578   HD13  LEU  90          HD13      LEU  90   4.117  21.921   6.942
 1579   HD21  LEU  90          HD21      LEU  90   1.453  20.833   9.182
 1580   HD22  LEU  90          HD22      LEU  90   1.153  21.332   7.515
 1581   HD23  LEU  90          HD23      LEU  90   2.317  22.214   8.504
 1582    H    THR  91           H        THR  91   5.909  17.586   7.864
 1583    HA   THR  91           HA       THR  91   5.332  16.773  10.640
 1584    HB   THR  91           HB       THR  91   7.361  15.409  10.573
 1585    HG1  THR  91           HG1      THR  91   7.858  16.893   8.386
 1586   HG21  THR  91          HG21      THR  91   5.263  14.349   9.852
 1587   HG22  THR  91          HG22      THR  91   6.647  13.682   8.992
 1588   HG23  THR  91          HG23      THR  91   5.586  14.841   8.193
 1589    H    THR  92           H        THR  92   6.839  17.499  12.252
 1590    HA   THR  92           HA       THR  92   8.221  19.934  11.411
 1591    HB   THR  92           HB       THR  92   6.708  20.261  13.286
 1592    HG1  THR  92           HG1      THR  92   8.161  21.321  14.605
 1593   HG21  THR  92          HG21      THR  92   6.752  18.000  14.241
 1594   HG22  THR  92          HG22      THR  92   7.079  19.230  15.461
 1595   HG23  THR  92          HG23      THR  92   8.404  18.275  14.797
 1596    H    ASP  93           H        ASP  93  10.232  19.776  10.904
 1597    HA   ASP  93           HA       ASP  93  11.796  17.459  11.277
 1598    HB2  ASP  93           HB3      ASP  93  12.001  19.277   9.471
 1599    HB3  ASP  93           HB2      ASP  93  12.895  20.206  10.671
 1600    H    GLU  94           H        GLU  94  11.538  20.469  12.995
 1601    HA   GLU  94           HA       GLU  94  12.545  19.251  15.386
 1602    HB2  GLU  94           HB3      GLU  94  14.658  20.027  14.416
 1603    HB3  GLU  94           HB2      GLU  94  13.991  21.634  14.200
 1604    HG2  GLU  94           HG3      GLU  94  13.758  21.832  16.643
 1605    HG3  GLU  94           HG2      GLU  94  14.532  20.262  16.819
 1606    H    LYS  95           H        LYS  95  12.143  22.563  14.122
 1607    HA   LYS  95           HA       LYS  95   9.681  22.821  15.684
 1608    HB2  LYS  95           HB3      LYS  95  11.976  24.793  15.715
 1609    HB3  LYS  95           HB2      LYS  95  10.367  25.152  16.322
 1610    HG2  LYS  95           HG3      LYS  95  10.590  23.379  17.982
 1611    HG3  LYS  95           HG2      LYS  95  12.195  22.998  17.358
 1612    HD2  LYS  95           HD3      LYS  95  12.921  25.281  17.926
 1613    HD3  LYS  95           HD2      LYS  95  11.332  25.592  18.628
 1614    HE2  LYS  95           HE3      LYS  95  11.694  23.769  20.224
 1615    HE3  LYS  95           HE2      LYS  95  13.279  23.471  19.518
 1616    HZ1  LYS  95           HZ1      LYS  95  13.946  25.701  20.175
 1617    HZ2  LYS  95           HZ2      LYS  95  13.458  24.796  21.517
 1618    HZ3  LYS  95           HZ3      LYS  95  12.430  25.970  20.872
 1619    H    GLN  96           H        GLN  96  10.306  22.368  12.893
 1620    HA   GLN  96           HA       GLN  96   8.972  24.695  11.729
 1621    HB2  GLN  96           HB3      GLN  96  11.332  25.001  11.225
 1622    HB3  GLN  96           HB2      GLN  96  11.458  23.349  10.648
 1623    HG2  GLN  96           HG3      GLN  96  11.428  24.944   8.816
 1624    HG3  GLN  96           HG2      GLN  96  10.036  23.869   8.756
 1625   HE21  GLN  96          HE21      GLN  96   8.009  24.713   8.903
 1626   HE22  GLN  96          HE22      GLN  96   7.676  26.406   8.986
 1627    H    ALA  97           H        ALA  97   7.167  24.002  10.835
 1628    HA   ALA  97           HA       ALA  97   6.687  21.253  10.225
 1629    HB1  ALA  97           HB1      ALA  97   4.514  22.019   9.420
 1630    HB2  ALA  97           HB2      ALA  97   5.057  23.693   9.523
 1631    HB3  ALA  97           HB3      ALA  97   4.894  22.726  10.989
 1632    H    ALA  98           H        ALA  98   7.229  20.211   8.442
 1633    HA   ALA  98           HA       ALA  98   7.326  21.624   5.891
 1634    HB1  ALA  98           HB1      ALA  98   9.601  19.947   6.950
 1635    HB2  ALA  98           HB2      ALA  98   9.614  21.700   6.763
 1636    HB3  ALA  98           HB3      ALA  98   9.507  20.662   5.341
 1637    H    TRP  99           H        TRP  99   6.913  20.324   4.118
 1638    HA   TRP  99           HA       TRP  99   5.485  17.903   4.662
 1639    HB2  TRP  99           HB3      TRP  99   6.206  19.316   2.093
 1640    HB3  TRP  99           HB2      TRP  99   5.316  17.799   2.127
 1641    HD1  TRP  99           HD1      TRP  99   4.888  21.511   2.633
 1642    HE1  TRP  99           HE1      TRP  99   2.408  22.033   3.082
 1643    HE3  TRP  99           HE3      TRP  99   3.158  16.745   3.236
 1644    HZ2  TRP  99           HZ2      TRP  99   0.029  20.605   3.620
 1645    HZ3  TRP  99           HZ3      TRP  99   0.765  16.406   3.712
 1646    HH2  TRP  99           HH2      TRP  99  -0.764  18.298   3.898
 1647    H    ARG 100           H        ARG 100   6.428  16.070   5.062
 1648    HA   ARG 100           HA       ARG 100   8.857  15.329   3.566
 1649    HB2  ARG 100           HB3      ARG 100   7.859  14.406   6.274
 1650    HB3  ARG 100           HB2      ARG 100   9.224  13.685   5.438
 1651    HG2  ARG 100           HG3      ARG 100   9.089  16.573   6.268
 1652    HG3  ARG 100           HG2      ARG 100   9.826  15.293   7.230
 1653    HD2  ARG 100           HD3      ARG 100  11.290  14.809   5.223
 1654    HD3  ARG 100           HD2      ARG 100  10.683  16.314   4.535
 1655    HE   ARG 100           HE       ARG 100  11.793  16.528   7.199
 1656   HH11  ARG 100          HH11      ARG 100  12.393  16.784   3.758
 1657   HH12  ARG 100          HH12      ARG 100  13.814  17.760   3.953
 1658   HH21  ARG 100          HH21      ARG 100  13.659  17.803   7.470
 1659   HH22  ARG 100          HH22      ARG 100  14.522  18.360   6.064
 1660    H    PHE 101           H        PHE 101   9.012  12.843   3.415
 1661    HA   PHE 101           HA       PHE 101   6.350  11.738   2.783
 1662    HB2  PHE 101           HB3      PHE 101   8.978  11.260   1.341
 1663    HB3  PHE 101           HB2      PHE 101   7.511  10.337   1.046
 1664    HD1  PHE 101           HD1      PHE 101   5.692  11.255  -0.206
 1665    HD2  PHE 101           HD2      PHE 101   9.139  13.599   0.657
 1666    HE1  PHE 101           HE1      PHE 101   4.972  12.917  -1.867
 1667    HE2  PHE 101           HE2      PHE 101   8.424  15.266  -1.005
 1668    HZ   PHE 101           HZ       PHE 101   6.337  14.926  -2.267
 1669    H    ILE 102           H        ILE 102   5.873  10.268   4.301
 1670    HA   ILE 102           HA       ILE 102   8.158   9.000   5.664
 1671    HB   ILE 102           HB       ILE 102   6.669   8.809   7.647
 1672   HG12  ILE 102          HG13      ILE 102   4.838  10.666   6.121
 1673   HG13  ILE 102          HG12      ILE 102   4.521   8.954   6.372
 1674   HG21  ILE 102          HG21      ILE 102   8.274  10.608   7.511
 1675   HG22  ILE 102          HG22      ILE 102   6.794  11.186   8.275
 1676   HG23  ILE 102          HG23      ILE 102   7.135  11.592   6.592
 1677   HD11  ILE 102          HD11      ILE 102   4.481   9.333   8.791
 1678   HD12  ILE 102          HD12      ILE 102   3.268  10.291   7.937
 1679   HD13  ILE 102          HD13      ILE 102   4.751  11.055   8.510
 1680    H    ARG 103           H        ARG 103   8.105   6.880   6.205
 1681    HA   ARG 103           HA       ARG 103   6.570   5.235   4.419
 1682    HB2  ARG 103           HB3      ARG 103   7.875   3.365   5.354
 1683    HB3  ARG 103           HB2      ARG 103   8.911   4.692   4.848
 1684    HG2  ARG 103           HG3      ARG 103   9.190   5.394   7.144
 1685    HG3  ARG 103           HG2      ARG 103   8.054   4.163   7.685
 1686    HD2  ARG 103           HD3      ARG 103   9.574   2.418   6.845
 1687    HD3  ARG 103           HD2      ARG 103  10.719   3.669   6.358
 1688    HE   ARG 103           HE       ARG 103  10.461   4.235   8.937
 1689   HH11  ARG 103          HH11      ARG 103  10.845   1.122   7.370
 1690   HH12  ARG 103          HH12      ARG 103  11.712   0.424   8.700
 1691   HH21  ARG 103          HH21      ARG 103  11.593   3.316  10.681
 1692   HH22  ARG 103          HH22      ARG 103  12.138   1.671  10.584
 1693    H    ILE 104           H        ILE 104   4.709   4.319   4.806
 1694    HA   ILE 104           HA       ILE 104   4.014   3.626   7.584
 1695    HB   ILE 104           HB       ILE 104   1.627   3.916   6.994
 1696   HG12  ILE 104          HG13      ILE 104   2.651   5.223   4.469
 1697   HG13  ILE 104          HG12      ILE 104   1.932   3.621   4.533
 1698   HG21  ILE 104          HG21      ILE 104   3.319   6.376   6.594
 1699   HG22  ILE 104          HG22      ILE 104   2.789   5.708   8.138
 1700   HG23  ILE 104          HG23      ILE 104   1.605   6.369   7.010
 1701   HD11  ILE 104          HD11      ILE 104   0.554   6.182   5.292
 1702   HD12  ILE 104          HD12      ILE 104  -0.165   4.571   5.286
 1703   HD13  ILE 104          HD13      ILE 104   0.352   5.312   3.771
 1704    H    ASP 105           H        ASP 105   2.949   1.673   7.893
 1705    HA   ASP 105           HA       ASP 105   3.557  -0.431   6.092
 1706    HB2  ASP 105           HB3      ASP 105   1.646  -0.375   8.453
 1707    HB3  ASP 105           HB2      ASP 105   2.129  -1.836   7.588
 1708    H    THR 106           H        THR 106   2.594  -0.731   4.223
 1709    HA   THR 106           HA       THR 106   0.043   0.581   3.737
 1710    HB   THR 106           HB       THR 106   1.569  -0.850   1.603
 1711    HG1  THR 106           HG1      THR 106   2.584   1.075   3.272
 1712   HG21  THR 106          HG21      THR 106  -0.519   0.385   1.109
 1713   HG22  THR 106          HG22      THR 106   0.881   1.063   0.278
 1714   HG23  THR 106          HG23      THR 106   0.239   1.860   1.712
 1715    H    ALA 107           H        ALA 107   1.497  -2.642   3.511
 1716    HA   ALA 107           HA       ALA 107  -1.083  -3.883   3.777
 1717    HB1  ALA 107           HB1      ALA 107  -0.976  -5.164   1.704
 1718    HB2  ALA 107           HB2      ALA 107   0.489  -4.299   1.235
 1719    HB3  ALA 107           HB3      ALA 107  -1.042  -3.433   1.370
 1720    H    CYS 108           H        CYS 108  -0.925  -5.900   4.623
 1721    HA   CYS 108           HA       CYS 108   1.742  -6.885   5.265
 1722    HB2  CYS 108           HB3      CYS 108   0.012  -6.780   7.057
 1723    HB3  CYS 108           HB2      CYS 108  -0.981  -7.912   6.138
 1724    H    VAL 109           H        VAL 109   2.598  -7.914   3.551
 1725    HA   VAL 109           HA       VAL 109   0.820  -9.560   1.896
 1726    HB   VAL 109           HB       VAL 109   2.498  -9.407   0.146
 1727   HG11  VAL 109          HG11      VAL 109   0.874  -7.616   0.269
 1728   HG12  VAL 109          HG12      VAL 109   2.431  -6.987  -0.276
 1729   HG13  VAL 109          HG13      VAL 109   1.907  -6.726   1.388
 1730   HG21  VAL 109          HG21      VAL 109   4.524  -8.058   0.407
 1731   HG22  VAL 109          HG22      VAL 109   4.512  -9.421   1.528
 1732   HG23  VAL 109          HG23      VAL 109   4.135  -7.798   2.108
 1733    H    CYS 110           H        CYS 110   1.428 -11.656   1.278
 1734    HA   CYS 110           HA       CYS 110   3.306 -12.947   3.098
 1735    HB2  CYS 110           HB3      CYS 110   1.156 -14.035   1.284
 1736    HB3  CYS 110           HB2      CYS 110   2.340 -15.071   2.070
 1737    H    VAL 111           H        VAL 111   5.303 -12.955   2.447
 1738    HA   VAL 111           HA       VAL 111   6.075 -12.619  -0.276
 1739    HB   VAL 111           HB       VAL 111   8.347 -12.762   0.501
 1740   HG11  VAL 111          HG11      VAL 111   8.353 -11.124   2.330
 1741   HG12  VAL 111          HG12      VAL 111   6.625 -11.384   2.551
 1742   HG13  VAL 111          HG13      VAL 111   7.229 -10.693   1.044
 1743   HG21  VAL 111          HG21      VAL 111   8.944 -13.445   2.765
 1744   HG22  VAL 111          HG22      VAL 111   8.142 -14.754   1.895
 1745   HG23  VAL 111          HG23      VAL 111   7.255 -13.823   3.102
 1746    H    LEU 112           H        LEU 112   7.574 -14.132  -1.402
 1747    HA   LEU 112           HA       LEU 112   7.013 -16.931  -0.690
 1748    HB2  LEU 112           HB3      LEU 112   7.431 -15.723  -3.429
 1749    HB3  LEU 112           HB2      LEU 112   7.378 -17.447  -3.116
 1750    HG   LEU 112           HG       LEU 112   5.105 -15.486  -2.757
 1751   HD11  LEU 112          HD11      LEU 112   5.503 -17.777  -4.680
 1752   HD12  LEU 112          HD12      LEU 112   5.579 -16.061  -5.081
 1753   HD13  LEU 112          HD13      LEU 112   4.058 -16.774  -4.549
 1754   HD21  LEU 112          HD21      LEU 112   4.999 -17.174  -1.017
 1755   HD22  LEU 112          HD22      LEU 112   5.208 -18.453  -2.215
 1756   HD23  LEU 112          HD23      LEU 112   3.748 -17.466  -2.226
 1757    H    SER 113           H        SER 113   8.689 -18.221  -0.402
 1758    HA   SER 113           HA       SER 113  11.312 -17.399  -1.437
 1759    HB2  SER 113           HB3      SER 113  11.237 -16.979   0.999
 1760    HB3  SER 113           HB2      SER 113  10.747 -18.649   1.272
 1761    HG   SER 113           HG       SER 113  13.010 -18.276   1.577
 1762    H    ARG 114           H        ARG 114  12.527 -19.057  -2.286
 1763    HA   ARG 114           HA       ARG 114  11.048 -21.375  -3.102
 1764    HB2  ARG 114           HB3      ARG 114  12.763 -20.070  -4.485
 1765    HB3  ARG 114           HB2      ARG 114  13.995 -20.892  -3.543
 1766    HG2  ARG 114           HG3      ARG 114  13.674 -22.015  -5.653
 1767    HG3  ARG 114           HG2      ARG 114  13.134 -23.056  -4.334
 1768    HD2  ARG 114           HD3      ARG 114  10.822 -22.458  -4.780
 1769    HD3  ARG 114           HD2      ARG 114  11.332 -21.335  -6.038
 1770    HE   ARG 114           HE       ARG 114  12.301 -23.948  -6.571
 1771   HH11  ARG 114          HH11      ARG 114   9.361 -22.053  -6.636
 1772   HH12  ARG 114          HH12      ARG 114   8.649 -22.949  -7.941
 1773   HH21  ARG 114          HH21      ARG 114  11.358 -25.150  -8.290
 1774   HH22  ARG 114          HH22      ARG 114   9.789 -24.703  -8.882
 1775    H    LYS 115           H        LYS 115  12.232 -20.760  -0.251
 1776    HA   LYS 115           HA       LYS 115  12.598 -22.032   1.589
 1777    HB2  LYS 115           HB3      LYS 115  12.554 -24.358  -0.347
 1778    HB3  LYS 115           HB2      LYS 115  12.734 -24.538   1.391
 1779    HG2  LYS 115           HG3      LYS 115  10.547 -23.535   1.741
 1780    HG3  LYS 115           HG2      LYS 115  10.378 -23.278   0.001
 1781    HD2  LYS 115           HD3      LYS 115   9.151 -25.262   0.737
 1782    HD3  LYS 115           HD2      LYS 115  10.446 -25.673  -0.388
 1783    HE2  LYS 115           HE3      LYS 115  11.856 -26.377   1.442
 1784    HE3  LYS 115           HE2      LYS 115  10.635 -25.883   2.614
 1785    HZ1  LYS 115           HZ1      LYS 115   9.167 -27.574   1.803
 1786    HZ2  LYS 115           HZ2      LYS 115  10.653 -28.293   2.162
 1787    HZ3  LYS 115           HZ3      LYS 115  10.228 -27.984   0.554
 1788    H    ALA 116           H        ALA 116  14.575 -22.839  -1.212
 1789    HA   ALA 116           HA       ALA 116  16.947 -22.603   0.522
 1790    HB1  ALA 116           HB1      ALA 116  16.686 -24.040  -2.120
 1791    HB2  ALA 116           HB2      ALA 116  16.777 -24.800  -0.530
 1792    HB3  ALA 116           HB3      ALA 116  18.160 -23.905  -1.162
 1793    H    THR 117           H        THR 117  16.715 -20.281   0.322
 1794    HA   THR 117           HA       THR 117  17.349 -19.234  -2.355
 1795    HB   THR 117           HB       THR 117  16.566 -17.017  -1.319
 1796    HG1  THR 117           HG1      THR 117  14.806 -17.962   0.358
 1797   HG21  THR 117          HG21      THR 117  15.271 -18.235  -2.989
 1798   HG22  THR 117          HG22      THR 117  14.209 -17.531  -1.770
 1799   HG23  THR 117          HG23      THR 117  14.580 -19.255  -1.725
 1800    H    ARG 118           H        ARG 118  18.953 -20.145   0.229
 1801    HA   ARG 118           HA       ARG 118  20.842 -17.890   0.112
 1802    HB2  ARG 118           HB3      ARG 118  20.213 -19.663   2.484
 1803    HB3  ARG 118           HB2      ARG 118  21.498 -18.471   2.444
 1804    HG2  ARG 118           HG3      ARG 118  18.595 -17.788   2.059
 1805    HG3  ARG 118           HG2      ARG 118  19.397 -17.791   3.627
 1806    HD2  ARG 118           HD3      ARG 118  19.365 -15.542   2.799
 1807    HD3  ARG 118           HD2      ARG 118  21.022 -16.133   2.736
 1808    HE   ARG 118           HE       ARG 118  19.750 -16.570   0.250
 1809   HH11  ARG 118          HH11      ARG 118  21.031 -13.987   2.232
 1810   HH12  ARG 118          HH12      ARG 118  21.423 -12.971   0.883
 1811   HH21  ARG 118          HH21      ARG 118  20.266 -15.243  -1.531
 1812   HH22  ARG 118          HH22      ARG 118  20.979 -13.684  -1.261
  Start of MODEL   14
    1    H1   SER   1           H1       SER   1  25.821   0.214  12.680
    2    H2   SER   1           H2       SER   1  24.346   0.611  13.399
    3    H3   SER   1           H3       SER   1  24.499   0.640  11.718
    4    HA   SER   1           HA       SER   1  24.831  -1.718  11.647
    5    HB2  SER   1           HB3      SER   1  24.339  -1.639  14.635
    6    HB3  SER   1           HB2      SER   1  24.712  -3.060  13.659
    7    HG   SER   1           HG       SER   1  26.761  -2.107  13.213
    8    H    SER   2           H        SER   2  23.026  -2.592  10.825
    9    HA   SER   2           HA       SER   2  20.454  -1.940  12.098
   10    HB2  SER   2           HB3      SER   2  20.989  -2.107   9.118
   11    HB3  SER   2           HB2      SER   2  19.425  -1.792   9.870
   12    HG   SER   2           HG       SER   2  20.394   0.113  10.792
   13    H    THR   3           H        THR   3  19.779  -3.806  12.967
   14    HA   THR   3           HA       THR   3  20.515  -6.344  11.807
   15    HB   THR   3           HB       THR   3  18.983  -7.198  13.717
   16    HG1  THR   3           HG1      THR   3  17.947  -5.254  14.206
   17   HG21  THR   3          HG21      THR   3  21.525  -5.679  14.310
   18   HG22  THR   3          HG22      THR   3  21.410  -7.355  13.775
   19   HG23  THR   3          HG23      THR   3  20.790  -6.891  15.359
   20    H    HIS   4           H        HIS   4  19.341  -5.685   9.772
   21    HA   HIS   4           HA       HIS   4  16.494  -6.404   9.960
   22    HB2  HIS   4           HB3      HIS   4  17.338  -4.183   8.838
   23    HB3  HIS   4           HB2      HIS   4  17.737  -5.237   7.488
   24    HD1  HIS   4           HD1      HIS   4  15.208  -3.040   8.362
   25    HD2  HIS   4           HD2      HIS   4  15.168  -6.978   7.032
   26    HE1  HIS   4           HE1      HIS   4  12.895  -3.425   7.457
   27    HE2  HIS   4           HE2      HIS   4  12.835  -5.874   6.880
   28    HA   PRO   5           HA       PRO   5  18.095 -10.249   8.293
   29    HB2  PRO   5           HB3      PRO   5  15.802 -11.665   8.463
   30    HB3  PRO   5           HB2      PRO   5  16.787 -11.289   9.882
   31    HG2  PRO   5           HG3      PRO   5  14.305  -9.946   8.883
   32    HG3  PRO   5           HG2      PRO   5  14.744 -10.376  10.546
   33    HD2  PRO   5           HD3      PRO   5  15.007  -7.859   9.539
   34    HD3  PRO   5           HD2      PRO   5  16.066  -8.507  10.808
   35    H    VAL   6           H        VAL   6  18.012  -8.656   6.279
   36    HA   VAL   6           HA       VAL   6  17.725  -8.501   4.033
   37    HB   VAL   6           HB       VAL   6  16.797 -11.367   4.187
   38   HG11  VAL   6          HG11      VAL   6  18.122  -9.828   1.961
   39   HG12  VAL   6          HG12      VAL   6  16.422 -10.295   2.025
   40   HG13  VAL   6          HG13      VAL   6  17.673 -11.533   1.918
   41   HG21  VAL   6          HG21      VAL   6  19.603 -10.285   3.994
   42   HG22  VAL   6          HG22      VAL   6  19.147 -11.983   3.850
   43   HG23  VAL   6          HG23      VAL   6  18.903 -11.131   5.376
   44    H    PHE   7           H        PHE   7  16.043  -6.997   4.117
   45    HA   PHE   7           HA       PHE   7  13.326  -7.592   4.462
   46    HB2  PHE   7           HB3      PHE   7  14.236  -5.307   4.636
   47    HB3  PHE   7           HB2      PHE   7  14.573  -5.309   2.910
   48    HD1  PHE   7           HD1      PHE   7  11.833  -5.453   5.399
   49    HD2  PHE   7           HD2      PHE   7  12.930  -4.688   1.359
   50    HE1  PHE   7           HE1      PHE   7   9.587  -4.559   4.965
   51    HE2  PHE   7           HE2      PHE   7  10.681  -3.793   0.917
   52    HZ   PHE   7           HZ       PHE   7   9.006  -3.727   2.718
   53    H    HIS   8           H        HIS   8  15.402  -7.994   1.749
   54    HA   HIS   8           HA       HIS   8  13.531  -7.912  -0.333
   55    HB2  HIS   8           HB3      HIS   8  16.025  -7.943  -0.608
   56    HB3  HIS   8           HB2      HIS   8  15.989  -9.665  -0.248
   57    HD1  HIS   8           HD1      HIS   8  14.299  -7.295  -2.707
   58    HD2  HIS   8           HD2      HIS   8  15.779 -11.181  -2.486
   59    HE1  HIS   8           HE1      HIS   8  14.027  -8.266  -5.015
   60    HE2  HIS   8           HE2      HIS   8  14.773 -10.662  -4.812
   61    H    MET   9           H        MET   9  14.012 -10.274   2.133
   62    HA   MET   9           HA       MET   9  12.819 -12.453   0.706
   63    HB2  MET   9           HB3      MET   9  13.220 -12.025   3.671
   64    HB3  MET   9           HB2      MET   9  12.578 -13.502   2.969
   65    HG2  MET   9           HG3      MET   9  14.729 -13.666   1.657
   66    HG3  MET   9           HG2      MET   9  15.341 -12.363   2.669
   67    HE1  MET   9           HE1      MET   9  13.763 -13.154   5.422
   68    HE2  MET   9           HE2      MET   9  15.425 -12.566   5.385
   69    HE3  MET   9           HE3      MET   9  15.034 -14.053   6.248
   70    H    GLY  10           H        GLY  10  11.658  -9.637   2.172
   71    HA2  GLY  10           HA3      GLY  10   8.931 -10.713   2.361
   72    HA3  GLY  10           HA2      GLY  10   9.476  -9.169   3.000
   73    H    GLU  11           H        GLU  11  10.835  -9.558   0.026
   74    HA   GLU  11           HA       GLU  11   8.767  -7.906  -1.238
   75    HB2  GLU  11           HB3      GLU  11  11.636  -8.405  -2.071
   76    HB3  GLU  11           HB2      GLU  11  10.508  -7.338  -2.897
   77    HG2  GLU  11           HG3      GLU  11  10.356  -6.001  -0.792
   78    HG3  GLU  11           HG2      GLU  11  11.652  -7.000  -0.134
   79    H    PHE  12           H        PHE  12   9.100 -10.987  -0.909
   80    HA   PHE  12           HA       PHE  12   9.070 -11.818  -3.691
   81    HB2  PHE  12           HB3      PHE  12   8.974 -13.318  -1.084
   82    HB3  PHE  12           HB2      PHE  12   8.591 -14.114  -2.608
   83    HD1  PHE  12           HD1      PHE  12  11.184 -13.099  -0.390
   84    HD2  PHE  12           HD2      PHE  12  10.339 -14.026  -4.454
   85    HE1  PHE  12           HE1      PHE  12  13.579 -13.483  -0.797
   86    HE2  PHE  12           HE2      PHE  12  12.733 -14.414  -4.868
   87    HZ   PHE  12           HZ       PHE  12  14.352 -14.143  -3.035
   88    H    SER  13           H        SER  13   7.170 -10.338  -3.923
   89    HA   SER  13           HA       SER  13   4.629 -10.967  -2.931
   90    HB2  SER  13           HB3      SER  13   5.200  -9.817  -5.671
   91    HB3  SER  13           HB2      SER  13   3.802  -9.514  -4.646
   92    HG   SER  13           HG       SER  13   6.179  -8.248  -4.706
   93    H    VAL  14           H        VAL  14   3.525 -12.819  -3.209
   94    HA   VAL  14           HA       VAL  14   4.135 -14.833  -5.034
   95    HB   VAL  14           HB       VAL  14   1.861 -15.747  -4.587
   96   HG11  VAL  14          HG11      VAL  14   3.701 -16.274  -3.096
   97   HG12  VAL  14          HG12      VAL  14   2.199 -16.112  -2.185
   98   HG13  VAL  14          HG13      VAL  14   3.390 -14.810  -2.162
   99   HG21  VAL  14          HG21      VAL  14   0.641 -13.632  -4.411
  100   HG22  VAL  14          HG22      VAL  14   1.504 -13.257  -2.919
  101   HG23  VAL  14          HG23      VAL  14   0.404 -14.633  -2.977
  102    H    CYS  15           H        CYS  15   2.136 -12.014  -5.377
  103    HA   CYS  15           HA       CYS  15   1.472 -12.828  -8.118
  104    HB2  CYS  15           HB3      CYS  15  -0.497 -12.327  -6.761
  105    HB3  CYS  15           HB2      CYS  15   0.173 -10.749  -6.340
  106    H    ASP  16           H        ASP  16   2.382 -11.765  -9.753
  107    HA   ASP  16           HA       ASP  16   4.413  -9.840  -9.300
  108    HB2  ASP  16           HB3      ASP  16   3.034 -10.654 -11.875
  109    HB3  ASP  16           HB2      ASP  16   4.472  -9.644 -11.786
  110    H    SER  17           H        SER  17   4.139  -7.787  -8.844
  111    HA   SER  17           HA       SER  17   1.849  -6.362  -9.995
  112    HB2  SER  17           HB3      SER  17   1.723  -5.140  -7.747
  113    HB3  SER  17           HB2      SER  17   1.134  -6.807  -7.772
  114    HG   SER  17           HG       SER  17   2.927  -7.473  -6.719
  115    H    VAL  18           H        VAL  18   2.132  -4.067 -10.163
  116    HA   VAL  18           HA       VAL  18   4.955  -3.250 -10.056
  117    HB   VAL  18           HB       VAL  18   4.303  -3.587 -12.367
  118   HG11  VAL  18          HG11      VAL  18   2.121  -1.578 -11.856
  119   HG12  VAL  18          HG12      VAL  18   1.909  -3.298 -12.186
  120   HG13  VAL  18          HG13      VAL  18   2.566  -2.236 -13.430
  121   HG21  VAL  18          HG21      VAL  18   4.835  -1.361 -13.257
  122   HG22  VAL  18          HG22      VAL  18   5.876  -1.810 -11.909
  123   HG23  VAL  18          HG23      VAL  18   4.554  -0.670 -11.660
  124    H    SER  19           H        SER  19   5.227  -1.764  -8.546
  125    HA   SER  19           HA       SER  19   3.060   0.036  -7.833
  126    HB2  SER  19           HB3      SER  19   5.854  -0.249  -6.684
  127    HB3  SER  19           HB2      SER  19   4.578   0.785  -6.028
  128    HG   SER  19           HG       SER  19   3.353  -1.052  -5.590
  129    H    VAL  20           H        VAL  20   2.822   1.949  -8.752
  130    HA   VAL  20           HA       VAL  20   5.106   3.072 -10.236
  131    HB   VAL  20           HB       VAL  20   2.170   3.299 -10.910
  132   HG11  VAL  20          HG11      VAL  20   4.609   4.211 -12.419
  133   HG12  VAL  20          HG12      VAL  20   3.399   5.239 -11.647
  134   HG13  VAL  20          HG13      VAL  20   2.958   4.245 -13.036
  135   HG21  VAL  20          HG21      VAL  20   2.648   1.823 -12.791
  136   HG22  VAL  20          HG22      VAL  20   2.992   1.029 -11.253
  137   HG23  VAL  20          HG23      VAL  20   4.315   1.653 -12.239
  138    H    TRP  21           H        TRP  21   5.613   5.149  -9.905
  139    HA   TRP  21           HA       TRP  21   3.972   6.700  -8.059
  140    HB2  TRP  21           HB3      TRP  21   6.760   7.168  -9.150
  141    HB3  TRP  21           HB2      TRP  21   5.911   8.305  -8.104
  142    HD1  TRP  21           HD1      TRP  21   7.853   5.050  -8.025
  143    HE1  TRP  21           HE1      TRP  21   8.193   4.316  -5.584
  144    HE3  TRP  21           HE3      TRP  21   4.760   8.416  -5.720
  145    HZ2  TRP  21           HZ2      TRP  21   7.280   5.063  -3.024
  146    HZ3  TRP  21           HZ3      TRP  21   4.553   8.335  -3.268
  147    HH2  TRP  21           HH2      TRP  21   5.786   6.694  -1.950
  148    H    VAL  22           H        VAL  22   2.310   7.481  -9.147
  149    HA   VAL  22           HA       VAL  22   2.513   8.261 -11.914
  150    HB   VAL  22           HB       VAL  22   0.184   8.528 -10.004
  151   HG11  VAL  22          HG11      VAL  22   0.253   8.602 -13.017
  152   HG12  VAL  22          HG12      VAL  22   0.008   9.991 -11.955
  153   HG13  VAL  22          HG13      VAL  22  -1.190   8.697 -12.006
  154   HG21  VAL  22          HG21      VAL  22  -0.659   6.476 -11.041
  155   HG22  VAL  22          HG22      VAL  22   0.883   6.207 -10.229
  156   HG23  VAL  22          HG23      VAL  22   0.824   6.347 -11.984
  157    H    GLY  23           H        GLY  23   2.588  10.274 -12.727
  158    HA2  GLY  23           HA3      GLY  23   3.434  12.398 -10.990
  159    HA3  GLY  23           HA2      GLY  23   3.245  12.481 -12.738
  160    H    ASP  24           H        ASP  24   1.191  12.076  -9.883
  161    HA   ASP  24           HA       ASP  24  -0.481  13.336  -9.020
  162    HB2  ASP  24           HB3      ASP  24   0.118  15.303 -11.241
  163    HB3  ASP  24           HB2      ASP  24  -0.909  15.610  -9.842
  164    H    LYS  25           H        LYS  25  -0.535  11.836 -11.896
  165    HA   LYS  25           HA       LYS  25  -2.143  11.008 -13.272
  166    HB2  LYS  25           HB3      LYS  25  -2.814  10.393 -10.782
  167    HB3  LYS  25           HB2      LYS  25  -4.187  11.428 -11.134
  168    HG2  LYS  25           HG3      LYS  25  -4.924  10.021 -12.881
  169    HG3  LYS  25           HG2      LYS  25  -3.413   9.110 -12.883
  170    HD2  LYS  25           HD3      LYS  25  -3.950   8.348 -10.569
  171    HD3  LYS  25           HD2      LYS  25  -5.510   9.154 -10.714
  172    HE2  LYS  25           HE3      LYS  25  -6.090   7.729 -12.605
  173    HE3  LYS  25           HE2      LYS  25  -4.513   6.945 -12.520
  174    HZ1  LYS  25           HZ1      LYS  25  -6.234   5.618 -11.466
  175    HZ2  LYS  25           HZ2      LYS  25  -6.589   6.874 -10.396
  176    HZ3  LYS  25           HZ3      LYS  25  -5.080   6.101 -10.325
  177    H    THR  26           H        THR  26  -5.095  11.864 -12.810
  178    HA   THR  26           HA       THR  26  -4.976  14.662 -13.590
  179    HB   THR  26           HB       THR  26  -6.402  12.647 -15.338
  180    HG1  THR  26           HG1      THR  26  -3.823  13.663 -15.366
  181   HG21  THR  26          HG21      THR  26  -7.459  14.861 -15.292
  182   HG22  THR  26          HG22      THR  26  -6.711  14.541 -16.857
  183   HG23  THR  26          HG23      THR  26  -5.915  15.607 -15.699
  184    H    THR  27           H        THR  27  -7.158  11.879 -13.190
  185    HA   THR  27           HA       THR  27  -8.868  13.572 -11.521
  186    HB   THR  27           HB       THR  27 -10.829  12.207 -12.472
  187    HG1  THR  27           HG1      THR  27  -8.864  11.130 -13.873
  188   HG21  THR  27          HG21      THR  27 -11.136  13.772 -14.345
  189   HG22  THR  27          HG22      THR  27  -9.442  14.249 -14.213
  190   HG23  THR  27          HG23      THR  27 -10.561  14.589 -12.891
  191    H    ALA  28           H        ALA  28  -9.890  12.539  -9.815
  192    HA   ALA  28           HA       ALA  28  -9.353   9.679  -9.462
  193    HB1  ALA  28           HB1      ALA  28  -8.489   9.994  -7.223
  194    HB2  ALA  28           HB2      ALA  28  -8.660  11.743  -7.380
  195    HB3  ALA  28           HB3      ALA  28  -7.497  10.877  -8.384
  196    H    THR  29           H        THR  29 -10.574   8.796  -7.567
  197    HA   THR  29           HA       THR  29 -13.181  10.135  -7.428
  198    HB   THR  29           HB       THR  29 -12.574   7.261  -6.730
  199    HG1  THR  29           HG1      THR  29 -12.460   8.329  -9.109
  200   HG21  THR  29          HG21      THR  29 -15.159   8.684  -7.377
  201   HG22  THR  29          HG22      THR  29 -14.643   8.162  -5.772
  202   HG23  THR  29          HG23      THR  29 -14.989   6.965  -7.020
  203    H    ASP  30           H        ASP  30 -13.621  11.184  -5.644
  204    HA   ASP  30           HA       ASP  30 -12.116  10.976  -3.235
  205    HB2  ASP  30           HB3      ASP  30 -13.215  13.068  -3.925
  206    HB3  ASP  30           HB2      ASP  30 -14.793  12.290  -3.796
  207    H    ILE  31           H        ILE  31 -13.117  10.482  -1.102
  208    HA   ILE  31           HA       ILE  31 -14.061   7.851  -1.027
  209    HB   ILE  31           HB       ILE  31 -12.824   8.878   0.820
  210   HG12  ILE  31          HG13      ILE  31 -15.581   8.024   1.733
  211   HG13  ILE  31          HG12      ILE  31 -14.304   6.915   1.243
  212   HG21  ILE  31          HG21      ILE  31 -15.321  10.498   1.295
  213   HG22  ILE  31          HG22      ILE  31 -13.760  11.112   0.749
  214   HG23  ILE  31          HG23      ILE  31 -13.924  10.432   2.369
  215   HD11  ILE  31          HD11      ILE  31 -14.196   8.824   3.566
  216   HD12  ILE  31          HD12      ILE  31 -12.907   7.724   3.077
  217   HD13  ILE  31          HD13      ILE  31 -14.444   7.080   3.656
  218    H    LYS  32           H        LYS  32 -15.772  10.870  -1.250
  219    HA   LYS  32           HA       LYS  32 -18.325   9.797  -0.453
  220    HB2  LYS  32           HB3      LYS  32 -17.628  12.350  -1.905
  221    HB3  LYS  32           HB2      LYS  32 -19.197  11.966  -1.209
  222    HG2  LYS  32           HG3      LYS  32 -18.301  12.012   1.003
  223    HG3  LYS  32           HG2      LYS  32 -16.654  12.152   0.384
  224    HD2  LYS  32           HD3      LYS  32 -17.263  14.308  -0.631
  225    HD3  LYS  32           HD2      LYS  32 -18.860  14.184   0.107
  226    HE2  LYS  32           HE3      LYS  32 -17.867  14.184   2.314
  227    HE3  LYS  32           HE2      LYS  32 -16.253  14.196   1.611
  228    HZ1  LYS  32           HZ1      LYS  32 -16.722  16.363   0.654
  229    HZ2  LYS  32           HZ2      LYS  32 -16.914  16.397   2.333
  230    HZ3  LYS  32           HZ3      LYS  32 -18.273  16.353   1.330
  231    H    GLY  33           H        GLY  33 -16.456   9.419  -3.174
  232    HA2  GLY  33           HA3      GLY  33 -17.061   8.132  -5.045
  233    HA3  GLY  33           HA2      GLY  33 -18.755   8.453  -4.692
  234    H    LYS  34           H        LYS  34 -16.605  11.117  -4.652
  235    HA   LYS  34           HA       LYS  34 -17.878  12.190  -7.052
  236    HB2  LYS  34           HB3      LYS  34 -16.130  13.487  -4.958
  237    HB3  LYS  34           HB2      LYS  34 -16.849  14.332  -6.318
  238    HG2  LYS  34           HG3      LYS  34 -18.419  12.914  -4.181
  239    HG3  LYS  34           HG2      LYS  34 -18.051  14.635  -4.177
  240    HD2  LYS  34           HD3      LYS  34 -19.199  14.837  -6.363
  241    HD3  LYS  34           HD2      LYS  34 -19.666  13.141  -6.237
  242    HE2  LYS  34           HE3      LYS  34 -20.948  13.589  -4.257
  243    HE3  LYS  34           HE2      LYS  34 -20.358  15.245  -4.203
  244    HZ1  LYS  34           HZ1      LYS  34 -22.603  15.104  -5.101
  245    HZ2  LYS  34           HZ2      LYS  34 -22.058  14.102  -6.350
  246    HZ3  LYS  34           HZ3      LYS  34 -21.522  15.702  -6.257
  247    H    GLU  35           H        GLU  35 -16.823  12.400  -8.943
  248    HA   GLU  35           HA       GLU  35 -14.024  11.671  -9.089
  249    HB2  GLU  35           HB3      GLU  35 -15.590  10.925 -10.844
  250    HB3  GLU  35           HB2      GLU  35 -15.926  12.601 -11.248
  251    HG2  GLU  35           HG3      GLU  35 -13.626  12.917 -11.950
  252    HG3  GLU  35           HG2      GLU  35 -13.247  11.258 -11.496
  253    H    VAL  36           H        VAL  36 -12.497  13.107  -8.714
  254    HA   VAL  36           HA       VAL  36 -13.108  15.955  -9.144
  255    HB   VAL  36           HB       VAL  36 -11.559  16.464  -7.295
  256   HG11  VAL  36          HG11      VAL  36 -13.763  14.550  -6.545
  257   HG12  VAL  36          HG12      VAL  36 -13.940  16.282  -6.832
  258   HG13  VAL  36          HG13      VAL  36 -12.993  15.708  -5.460
  259   HG21  VAL  36          HG21      VAL  36 -10.149  14.472  -7.440
  260   HG22  VAL  36          HG22      VAL  36 -11.491  13.479  -6.873
  261   HG23  VAL  36          HG23      VAL  36 -10.780  14.692  -5.809
  262    H    THR  37           H        THR  37 -11.344  17.314  -9.732
  263    HA   THR  37           HA       THR  37  -9.447  15.947 -11.465
  264    HB   THR  37           HB       THR  37  -9.897  18.918 -11.162
  265    HG1  THR  37           HG1      THR  37 -11.342  18.739 -12.861
  266   HG21  THR  37          HG21      THR  37  -8.657  17.284 -13.377
  267   HG22  THR  37          HG22      THR  37  -7.790  18.318 -12.241
  268   HG23  THR  37          HG23      THR  37  -8.907  19.030 -13.406
  269    H    VAL  38           H        VAL  38  -7.351  15.726 -10.980
  270    HA   VAL  38           HA       VAL  38  -6.415  16.809  -8.446
  271    HB   VAL  38           HB       VAL  38  -4.984  14.911 -10.313
  272   HG11  VAL  38          HG11      VAL  38  -4.529  15.517  -7.393
  273   HG12  VAL  38          HG12      VAL  38  -3.547  16.122  -8.725
  274   HG13  VAL  38          HG13      VAL  38  -3.603  14.394  -8.386
  275   HG21  VAL  38          HG21      VAL  38  -6.677  14.276  -7.895
  276   HG22  VAL  38          HG22      VAL  38  -5.716  13.118  -8.814
  277   HG23  VAL  38          HG23      VAL  38  -7.088  13.923  -9.573
  278    H    LEU  39           H        LEU  39  -4.718  18.198  -8.241
  279    HA   LEU  39           HA       LEU  39  -4.075  19.771 -10.587
  280    HB2  LEU  39           HB3      LEU  39  -3.169  20.124  -7.725
  281    HB3  LEU  39           HB2      LEU  39  -3.040  21.309  -9.014
  282    HG   LEU  39           HG       LEU  39  -5.628  20.299  -7.832
  283   HD11  LEU  39          HD11      LEU  39  -4.390  21.665  -6.259
  284   HD12  LEU  39          HD12      LEU  39  -5.801  22.533  -6.864
  285   HD13  LEU  39          HD13      LEU  39  -4.193  22.921  -7.481
  286   HD21  LEU  39          HD21      LEU  39  -5.088  22.476  -9.846
  287   HD22  LEU  39          HD22      LEU  39  -6.651  22.119  -9.113
  288   HD23  LEU  39          HD23      LEU  39  -5.880  20.933 -10.165
  289    H    ALA  40           H        ALA  40  -2.276  19.529 -11.734
  290    HA   ALA  40           HA       ALA  40  -0.365  17.516 -11.195
  291    HB1  ALA  40           HB1      ALA  40  -0.130  19.869 -13.069
  292    HB2  ALA  40           HB2      ALA  40  -0.889  18.326 -13.462
  293    HB3  ALA  40           HB3      ALA  40   0.837  18.395 -13.112
  294    H    GLU  41           H        GLU  41  -0.621  20.860 -10.420
  295    HA   GLU  41           HA       GLU  41   1.662  20.563  -8.624
  296    HB2  GLU  41           HB3      GLU  41   1.104  22.981 -10.358
  297    HB3  GLU  41           HB2      GLU  41   2.277  22.941  -9.051
  298    HG2  GLU  41           HG3      GLU  41   3.513  21.182 -10.233
  299    HG3  GLU  41           HG2      GLU  41   2.346  21.275 -11.554
  300    H    VAL  42           H        VAL  42   1.081  21.058  -6.595
  301    HA   VAL  42           HA       VAL  42  -1.607  22.098  -6.223
  302    HB   VAL  42           HB       VAL  42  -1.353  21.439  -3.858
  303   HG11  VAL  42          HG11      VAL  42  -2.242  19.850  -5.472
  304   HG12  VAL  42          HG12      VAL  42  -1.318  19.028  -4.215
  305   HG13  VAL  42          HG13      VAL  42  -0.611  19.271  -5.812
  306   HG21  VAL  42          HG21      VAL  42   0.574  20.171  -3.105
  307   HG22  VAL  42          HG22      VAL  42   1.068  21.780  -3.636
  308   HG23  VAL  42          HG23      VAL  42   1.350  20.383  -4.675
  309    H    ASN  43           H        ASN  43  -2.047  24.087  -5.621
  310    HA   ASN  43           HA       ASN  43   0.144  25.903  -5.162
  311    HB2  ASN  43           HB3      ASN  43  -1.674  27.661  -5.130
  312    HB3  ASN  43           HB2      ASN  43  -1.523  26.758  -6.630
  313   HD21  ASN  43          HD21      ASN  43  -3.166  25.365  -7.248
  314   HD22  ASN  43          HD22      ASN  43  -4.729  25.390  -6.504
  315    H    ILE  44           H        ILE  44   0.992  25.573  -3.235
  316    HA   ILE  44           HA       ILE  44  -0.733  25.894  -0.873
  317    HB   ILE  44           HB       ILE  44   2.112  24.868  -1.110
  318   HG12  ILE  44          HG13      ILE  44   0.512  23.269  -1.988
  319   HG13  ILE  44          HG12      ILE  44   1.136  22.692  -0.445
  320   HG21  ILE  44          HG21      ILE  44   0.342  25.035   1.323
  321   HG22  ILE  44          HG22      ILE  44   1.784  26.001   1.014
  322   HG23  ILE  44          HG23      ILE  44   1.925  24.259   1.254
  323   HD11  ILE  44          HD11      ILE  44  -0.906  23.413   0.662
  324   HD12  ILE  44          HD12      ILE  44  -1.262  22.308  -0.664
  325   HD13  ILE  44          HD13      ILE  44  -1.527  24.038  -0.865
  326    H    ASN  45           H        ASN  45   0.005  27.445   0.749
  327    HA   ASN  45           HA       ASN  45   0.526  29.932  -0.370
  328    HB2  ASN  45           HB3      ASN  45  -0.539  29.578   1.841
  329    HB3  ASN  45           HB2      ASN  45   1.028  29.120   2.498
  330   HD21  ASN  45          HD21      ASN  45  -0.872  31.743   1.196
  331   HD22  ASN  45          HD22      ASN  45   0.119  33.021   1.810
  332    H    ASN  46           H        ASN  46   2.257  30.443  -1.450
  333    HA   ASN  46           HA       ASN  46   4.393  30.979  -1.956
  334    HB2  ASN  46           HB3      ASN  46   4.863  30.483   0.988
  335    HB3  ASN  46           HB2      ASN  46   6.068  31.153  -0.106
  336   HD21  ASN  46          HD21      ASN  46   4.799  32.309   2.267
  337   HD22  ASN  46          HD22      ASN  46   4.071  33.787   1.739
  338    H    SER  47           H        SER  47   3.413  28.179  -2.106
  339    HA   SER  47           HA       SER  47   5.949  27.068  -2.862
  340    HB2  SER  47           HB3      SER  47   5.886  26.507  -0.444
  341    HB3  SER  47           HB2      SER  47   4.362  25.659  -0.699
  342    HG   SER  47           HG       SER  47   6.531  24.945  -2.308
  343    H    VAL  48           H        VAL  48   5.501  26.315  -4.820
  344    HA   VAL  48           HA       VAL  48   2.975  24.843  -5.211
  345    HB   VAL  48           HB       VAL  48   4.577  26.344  -7.296
  346   HG11  VAL  48          HG11      VAL  48   2.682  25.877  -8.779
  347   HG12  VAL  48          HG12      VAL  48   1.933  24.908  -7.510
  348   HG13  VAL  48          HG13      VAL  48   3.463  24.396  -8.227
  349   HG21  VAL  48          HG21      VAL  48   1.922  27.010  -6.030
  350   HG22  VAL  48          HG22      VAL  48   2.669  27.881  -7.367
  351   HG23  VAL  48          HG23      VAL  48   3.441  27.869  -5.782
  352    H    PHE  49           H        PHE  49   3.295  22.718  -5.370
  353    HA   PHE  49           HA       PHE  49   5.625  21.713  -6.806
  354    HB2  PHE  49           HB3      PHE  49   6.236  20.179  -4.967
  355    HB3  PHE  49           HB2      PHE  49   6.417  21.864  -4.501
  356    HD1  PHE  49           HD1      PHE  49   4.799  22.895  -2.927
  357    HD2  PHE  49           HD2      PHE  49   4.693  18.744  -3.877
  358    HE1  PHE  49           HE1      PHE  49   3.405  22.473  -0.943
  359    HE2  PHE  49           HE2      PHE  49   3.300  18.320  -1.896
  360    HZ   PHE  49           HZ       PHE  49   2.655  20.184  -0.428
  361    H    ARG  50           H        ARG  50   5.517  19.354  -7.150
  362    HA   ARG  50           HA       ARG  50   2.803  18.502  -7.735
  363    HB2  ARG  50           HB3      ARG  50   5.415  17.017  -8.137
  364    HB3  ARG  50           HB2      ARG  50   3.857  16.582  -8.820
  365    HG2  ARG  50           HG3      ARG  50   3.873  18.654 -10.134
  366    HG3  ARG  50           HG2      ARG  50   5.462  19.045  -9.473
  367    HD2  ARG  50           HD3      ARG  50   4.762  16.626 -11.128
  368    HD3  ARG  50           HD2      ARG  50   5.658  18.038 -11.682
  369    HE   ARG  50           HE       ARG  50   6.871  16.790  -9.412
  370   HH11  ARG  50          HH11      ARG  50   6.540  16.599 -12.890
  371   HH12  ARG  50          HH12      ARG  50   8.034  15.748 -13.111
  372   HH21  ARG  50          HH21      ARG  50   8.813  15.656  -9.690
  373   HH22  ARG  50          HH22      ARG  50   9.335  15.207 -11.284
  374    H    GLN  51           H        GLN  51   1.835  16.595  -6.845
  375    HA   GLN  51           HA       GLN  51   2.971  16.046  -4.191
  376    HB2  GLN  51           HB3      GLN  51   0.622  15.568  -3.461
  377    HB3  GLN  51           HB2      GLN  51   0.980  17.238  -3.848
  378    HG2  GLN  51           HG3      GLN  51  -1.130  16.896  -4.736
  379    HG3  GLN  51           HG2      GLN  51  -0.069  16.740  -6.132
  380   HE21  GLN  51          HE21      GLN  51  -0.045  14.874  -7.254
  381   HE22  GLN  51          HE22      GLN  51  -1.013  13.488  -6.849
  382    H    TYR  52           H        TYR  52   2.042  14.619  -7.120
  383    HA   TYR  52           HA       TYR  52   2.387  12.536  -7.960
  384    HB2  TYR  52           HB3      TYR  52   3.897  11.962  -5.405
  385    HB3  TYR  52           HB2      TYR  52   4.057  11.115  -6.939
  386    HD1  TYR  52           HD1      TYR  52   4.798  12.631  -8.973
  387    HD2  TYR  52           HD2      TYR  52   5.387  13.634  -4.879
  388    HE1  TYR  52           HE1      TYR  52   6.600  14.173  -9.612
  389    HE2  TYR  52           HE2      TYR  52   7.188  15.180  -5.512
  390    HH   TYR  52           HH       TYR  52   8.710  15.601  -7.291
  391    H    PHE  53           H        PHE  53   1.962  10.206  -7.716
  392    HA   PHE  53           HA       PHE  53   0.383   9.437  -5.368
  393    HB2  PHE  53           HB3      PHE  53  -0.490   9.069  -8.241
  394    HB3  PHE  53           HB2      PHE  53  -1.182   8.164  -6.902
  395    HD1  PHE  53           HD1      PHE  53  -1.767   9.924  -4.843
  396    HD2  PHE  53           HD2      PHE  53  -1.836  10.709  -9.017
  397    HE1  PHE  53           HE1      PHE  53  -3.405  11.716  -4.471
  398    HE2  PHE  53           HE2      PHE  53  -3.468  12.505  -8.661
  399    HZ   PHE  53           HZ       PHE  53  -4.256  13.014  -6.384
  400    H    PHE  54           H        PHE  54   0.231   7.088  -5.134
  401    HA   PHE  54           HA       PHE  54   2.242   5.622  -6.682
  402    HB2  PHE  54           HB3      PHE  54   2.639   4.269  -4.549
  403    HB3  PHE  54           HB2      PHE  54   3.296   5.899  -4.580
  404    HD1  PHE  54           HD1      PHE  54   0.985   3.629  -2.968
  405    HD2  PHE  54           HD2      PHE  54   2.198   7.695  -3.285
  406    HE1  PHE  54           HE1      PHE  54  -0.175   4.134  -0.862
  407    HE2  PHE  54           HE2      PHE  54   1.039   8.210  -1.179
  408    HZ   PHE  54           HZ       PHE  54  -0.148   6.431   0.036
  409    H    GLU  55           H        GLU  55   1.246   4.167  -7.878
  410    HA   GLU  55           HA       GLU  55  -1.111   2.812  -6.733
  411    HB2  GLU  55           HB3      GLU  55  -0.669   3.467  -9.656
  412    HB3  GLU  55           HB2      GLU  55  -2.068   2.648  -8.977
  413    HG2  GLU  55           HG3      GLU  55  -2.469   4.772  -7.632
  414    HG3  GLU  55           HG2      GLU  55  -1.270   5.531  -8.683
  415    H    THR  56           H        THR  56  -0.881   0.712  -6.512
  416    HA   THR  56           HA       THR  56   1.245  -0.646  -8.007
  417    HB   THR  56           HB       THR  56  -0.287  -1.613  -5.580
  418    HG1  THR  56           HG1      THR  56   1.088  -0.361  -4.566
  419   HG21  THR  56          HG21      THR  56   2.147  -2.750  -6.969
  420   HG22  THR  56          HG22      THR  56   0.528  -3.454  -6.968
  421   HG23  THR  56          HG23      THR  56   1.448  -3.352  -5.467
  422    H    LYS  57           H        LYS  57   0.625  -1.644  -9.781
  423    HA   LYS  57           HA       LYS  57  -2.180  -2.477 -10.028
  424    HB2  LYS  57           HB3      LYS  57  -1.240  -0.829 -11.672
  425    HB3  LYS  57           HB2      LYS  57  -0.123  -2.078 -12.209
  426    HG2  LYS  57           HG3      LYS  57  -1.991  -3.459 -12.926
  427    HG3  LYS  57           HG2      LYS  57  -3.124  -2.235 -12.355
  428    HD2  LYS  57           HD3      LYS  57  -1.051  -1.819 -14.500
  429    HD3  LYS  57           HD2      LYS  57  -2.764  -2.126 -14.787
  430    HE2  LYS  57           HE3      LYS  57  -1.581   0.240 -13.348
  431    HE3  LYS  57           HE2      LYS  57  -2.286   0.243 -14.960
  432    HZ1  LYS  57           HZ1      LYS  57  -3.709  -0.271 -12.408
  433    HZ2  LYS  57           HZ2      LYS  57  -4.410  -0.426 -13.938
  434    HZ3  LYS  57           HZ3      LYS  57  -3.871   1.085 -13.405
  435    H    CYS  58           H        CYS  58  -2.723  -4.546 -10.554
  436    HA   CYS  58           HA       CYS  58  -0.771  -6.587 -10.050
  437    HB2  CYS  58           HB3      CYS  58  -3.645  -6.823 -10.979
  438    HB3  CYS  58           HB2      CYS  58  -2.645  -8.152 -10.413
  439    H    ARG  59           H        ARG  59   0.716  -6.939 -11.590
  440    HA   ARG  59           HA       ARG  59   0.113  -6.795 -14.394
  441    HB2  ARG  59           HB3      ARG  59   2.523  -7.854 -12.904
  442    HB3  ARG  59           HB2      ARG  59   2.416  -7.766 -14.654
  443    HG2  ARG  59           HG3      ARG  59   2.116  -5.314 -14.461
  444    HG3  ARG  59           HG2      ARG  59   2.375  -5.463 -12.724
  445    HD2  ARG  59           HD3      ARG  59   4.425  -4.812 -13.901
  446    HD3  ARG  59           HD2      ARG  59   4.589  -6.370 -13.104
  447    HE   ARG  59           HE       ARG  59   3.770  -6.716 -15.790
  448   HH11  ARG  59          HH11      ARG  59   6.558  -5.884 -13.851
  449   HH12  ARG  59          HH12      ARG  59   7.705  -6.444 -15.028
  450   HH21  ARG  59          HH21      ARG  59   5.270  -7.472 -17.336
  451   HH22  ARG  59          HH22      ARG  59   6.970  -7.349 -17.013
  452    H    ALA  60           H        ALA  60   0.367  -9.236 -11.934
  453    HA   ALA  60           HA       ALA  60  -0.336 -11.362 -13.806
  454    HB1  ALA  60           HB1      ALA  60   1.327 -11.820 -12.045
  455    HB2  ALA  60           HB2      ALA  60  -0.094 -12.851 -11.893
  456    HB3  ALA  60           HB3      ALA  60   0.111 -11.470 -10.817
  457    H    SER  61           H        SER  61  -2.357 -12.322 -13.852
  458    HA   SER  61           HA       SER  61  -4.356 -11.500 -11.903
  459    HB2  SER  61           HB3      SER  61  -4.724 -10.996 -14.866
  460    HB3  SER  61           HB2      SER  61  -5.938 -10.728 -13.615
  461    HG   SER  61           HG       SER  61  -3.632  -9.485 -12.971
  462    H    ASN  62           H        ASN  62  -2.937 -13.962 -13.254
  463    HA   ASN  62           HA       ASN  62  -5.409 -15.474 -13.786
  464    HB2  ASN  62           HB3      ASN  62  -3.642 -15.383 -15.611
  465    HB3  ASN  62           HB2      ASN  62  -2.588 -16.288 -14.529
  466   HD21  ASN  62          HD21      ASN  62  -3.026 -18.455 -14.122
  467   HD22  ASN  62          HD22      ASN  62  -4.134 -19.366 -15.078
  468    HA   PRO  63           HA       PRO  63  -5.437 -17.356  -9.847
  469    HB2  PRO  63           HB3      PRO  63  -5.430 -20.044 -10.944
  470    HB3  PRO  63           HB2      PRO  63  -6.744 -19.168 -10.153
  471    HG2  PRO  63           HG3      PRO  63  -6.187 -19.521 -13.010
  472    HG3  PRO  63           HG2      PRO  63  -7.691 -19.036 -12.212
  473    HD2  PRO  63           HD3      PRO  63  -6.224 -17.309 -13.695
  474    HD3  PRO  63           HD2      PRO  63  -7.132 -16.779 -12.252
  475    H    VAL  64           H        VAL  64  -3.510 -19.547 -11.943
  476    HA   VAL  64           HA       VAL  64  -1.437 -19.465  -9.846
  477    HB   VAL  64           HB       VAL  64  -2.229 -21.871 -11.496
  478   HG11  VAL  64          HG11      VAL  64  -0.652 -23.106 -10.123
  479   HG12  VAL  64          HG12      VAL  64  -0.223 -21.630  -9.264
  480   HG13  VAL  64          HG13      VAL  64   0.167 -21.796 -10.975
  481   HG21  VAL  64          HG21      VAL  64  -3.035 -22.816  -9.405
  482   HG22  VAL  64          HG22      VAL  64  -3.879 -21.311  -9.771
  483   HG23  VAL  64          HG23      VAL  64  -2.602 -21.332  -8.554
  484    H    GLU  65           H        GLU  65  -1.970 -20.374 -13.238
  485    HA   GLU  65           HA       GLU  65   0.573 -20.688 -14.136
  486    HB2  GLU  65           HB3      GLU  65  -1.405 -21.108 -15.493
  487    HB3  GLU  65           HB2      GLU  65  -1.726 -19.384 -15.600
  488    HG2  GLU  65           HG3      GLU  65   0.290 -19.058 -16.890
  489    HG3  GLU  65           HG2      GLU  65   0.704 -20.763 -16.713
  490    H    SER  66           H        SER  66  -1.120 -17.596 -13.851
  491    HA   SER  66           HA       SER  66   1.479 -16.270 -13.804
  492    HB2  SER  66           HB3      SER  66   0.513 -16.032 -16.116
  493    HB3  SER  66           HB2      SER  66  -0.869 -15.201 -15.403
  494    HG   SER  66           HG       SER  66   1.220 -13.977 -14.442
  495    H    GLY  67           H        GLY  67   0.560 -16.747 -11.519
  496    HA2  GLY  67           HA3      GLY  67  -0.185 -14.260 -10.392
  497    HA3  GLY  67           HA2      GLY  67  -1.580 -15.334 -10.449
  498    H    CYS  68           H        CYS  68  -1.893 -16.558  -8.716
  499    HA   CYS  68           HA       CYS  68   0.112 -16.436  -6.630
  500    HB2  CYS  68           HB3      CYS  68  -2.718 -17.510  -6.593
  501    HB3  CYS  68           HB2      CYS  68  -1.675 -17.333  -5.182
  502    H    ARG  69           H        ARG  69   1.554 -17.848  -7.864
  503    HA   ARG  69           HA       ARG  69   1.042 -20.618  -8.146
  504    HB2  ARG  69           HB3      ARG  69   3.607 -19.031  -7.965
  505    HB3  ARG  69           HB2      ARG  69   3.579 -20.772  -8.225
  506    HG2  ARG  69           HG3      ARG  69   3.038 -20.558 -10.384
  507    HG3  ARG  69           HG2      ARG  69   1.875 -19.271 -10.070
  508    HD2  ARG  69           HD3      ARG  69   4.872 -18.917 -10.124
  509    HD3  ARG  69           HD2      ARG  69   3.790 -18.542 -11.467
  510    HE   ARG  69           HE       ARG  69   3.124 -17.224  -8.990
  511   HH11  ARG  69          HH11      ARG  69   4.985 -17.018 -11.944
  512   HH12  ARG  69          HH12      ARG  69   5.098 -15.289 -11.895
  513   HH21  ARG  69          HH21      ARG  69   3.242 -14.954  -8.940
  514   HH22  ARG  69          HH22      ARG  69   4.090 -14.108 -10.210
  515    H    GLY  70           H        GLY  70   1.052 -22.203  -6.681
  516    HA2  GLY  70           HA3      GLY  70   2.209 -23.034  -4.599
  517    HA3  GLY  70           HA2      GLY  70   1.812 -21.450  -3.931
  518    H    ILE  71           H        ILE  71  -0.771 -21.289  -5.217
  519    HA   ILE  71           HA       ILE  71  -2.327 -22.766  -3.315
  520    HB   ILE  71           HB       ILE  71  -3.253 -21.146  -5.697
  521   HG12  ILE  71          HG13      ILE  71  -1.949 -19.787  -4.128
  522   HG13  ILE  71          HG12      ILE  71  -3.651 -19.342  -4.072
  523   HG21  ILE  71          HG21      ILE  71  -4.961 -22.690  -4.928
  524   HG22  ILE  71          HG22      ILE  71  -5.403 -21.034  -4.511
  525   HG23  ILE  71          HG23      ILE  71  -4.766 -22.115  -3.272
  526   HD11  ILE  71          HD11      ILE  71  -3.905 -20.679  -2.023
  527   HD12  ILE  71          HD12      ILE  71  -2.718 -19.385  -1.848
  528   HD13  ILE  71          HD13      ILE  71  -2.180 -21.048  -2.072
  529    H    ASP  72           H        ASP  72  -3.092 -24.772  -3.558
  530    HA   ASP  72           HA       ASP  72  -3.610 -25.796  -6.243
  531    HB2  ASP  72           HB3      ASP  72  -1.259 -26.405  -5.631
  532    HB3  ASP  72           HB2      ASP  72  -1.896 -27.304  -4.257
  533    H    SER  73           H        SER  73  -5.789 -25.705  -5.673
  534    HA   SER  73           HA       SER  73  -6.745 -28.007  -4.236
  535    HB2  SER  73           HB3      SER  73  -6.468 -26.435  -2.376
  536    HB3  SER  73           HB2      SER  73  -7.376 -25.206  -3.256
  537    HG   SER  73           HG       SER  73  -8.405 -26.782  -1.573
  538    H    LYS  74           H        LYS  74  -8.927 -28.464  -4.718
  539    HA   LYS  74           HA       LYS  74  -9.933 -27.085  -7.086
  540    HB2  LYS  74           HB3      LYS  74 -10.868 -29.624  -5.739
  541    HB3  LYS  74           HB2      LYS  74 -11.491 -28.989  -7.252
  542    HG2  LYS  74           HG3      LYS  74  -9.250 -29.257  -8.254
  543    HG3  LYS  74           HG2      LYS  74  -8.694 -29.978  -6.742
  544    HD2  LYS  74           HD3      LYS  74 -10.917 -31.040  -8.477
  545    HD3  LYS  74           HD2      LYS  74  -9.277 -31.680  -8.410
  546    HE2  LYS  74           HE3      LYS  74  -9.600 -32.198  -6.032
  547    HE3  LYS  74           HE2      LYS  74 -11.243 -31.581  -6.131
  548    HZ1  LYS  74           HZ1      LYS  74 -11.756 -33.304  -7.743
  549    HZ2  LYS  74           HZ2      LYS  74 -11.204 -33.980  -6.298
  550    HZ3  LYS  74           HZ3      LYS  74 -10.179 -33.903  -7.637
  551    H    HIS  75           H        HIS  75 -10.128 -26.633  -3.912
  552    HA   HIS  75           HA       HIS  75 -12.996 -25.999  -3.854
  553    HB2  HIS  75           HB3      HIS  75 -10.971 -26.068  -1.600
  554    HB3  HIS  75           HB2      HIS  75 -12.689 -25.735  -1.415
  555    HD1  HIS  75           HD1      HIS  75 -10.310 -28.415  -1.204
  556    HD2  HIS  75           HD2      HIS  75 -14.307 -28.095  -2.308
  557    HE1  HIS  75           HE1      HIS  75 -11.245 -30.740  -1.038
  558    HE2  HIS  75           HE2      HIS  75 -13.615 -30.543  -1.860
  559    H    TRP  76           H        TRP  76 -10.089 -24.571  -4.541
  560    HA   TRP  76           HA       TRP  76 -11.004 -21.937  -3.606
  561    HB2  TRP  76           HB3      TRP  76  -8.190 -23.041  -3.681
  562    HB3  TRP  76           HB2      TRP  76  -8.546 -21.328  -3.494
  563    HD1  TRP  76           HD1      TRP  76  -7.843 -24.292  -1.495
  564    HE1  TRP  76           HE1      TRP  76  -8.494 -23.924   0.963
  565    HE3  TRP  76           HE3      TRP  76 -10.727 -20.099  -2.024
  566    HZ2  TRP  76           HZ2      TRP  76 -10.020 -22.110   2.478
  567    HZ3  TRP  76           HZ3      TRP  76 -11.744 -19.113  -0.014
  568    HH2  TRP  76           HH2      TRP  76 -11.398 -20.100   2.189
  569    H    ASN  77           H        ASN  77 -11.009 -20.325  -5.027
  570    HA   ASN  77           HA       ASN  77  -9.483 -20.653  -7.533
  571    HB2  ASN  77           HB3      ASN  77 -11.930 -20.509  -7.936
  572    HB3  ASN  77           HB2      ASN  77 -11.970 -18.975  -7.078
  573   HD21  ASN  77          HD21      ASN  77 -10.938 -20.614  -9.976
  574   HD22  ASN  77          HD22      ASN  77 -10.665 -19.186 -10.915
  575    H    SER  78           H        SER  78  -8.043 -19.005  -8.019
  576    HA   SER  78           HA       SER  78  -7.794 -16.952  -5.931
  577    HB2  SER  78           HB3      SER  78  -6.183 -18.875  -5.662
  578    HB3  SER  78           HB2      SER  78  -5.468 -18.404  -7.203
  579    HG   SER  78           HG       SER  78  -5.720 -16.664  -4.972
  580    H    TYR  79           H        TYR  79  -6.773 -15.025  -6.522
  581    HA   TYR  79           HA       TYR  79  -5.638 -14.504  -9.024
  582    HB2  TYR  79           HB3      TYR  79  -7.341 -13.038 -10.024
  583    HB3  TYR  79           HB2      TYR  79  -7.940 -14.687  -9.874
  584    HD1  TYR  79           HD1      TYR  79  -8.344 -11.228  -8.789
  585    HD2  TYR  79           HD2      TYR  79  -9.694 -15.228  -8.244
  586    HE1  TYR  79           HE1      TYR  79 -10.351 -10.392  -7.642
  587    HE2  TYR  79           HE2      TYR  79 -11.702 -14.397  -7.093
  588    HH   TYR  79           HH       TYR  79 -12.291 -12.232  -5.764
  589    H    CYS  80           H        CYS  80  -5.574 -11.974  -9.326
  590    HA   CYS  80           HA       CYS  80  -4.756 -10.961  -6.698
  591    HB2  CYS  80           HB3      CYS  80  -3.930  -9.986  -9.442
  592    HB3  CYS  80           HB2      CYS  80  -3.203  -9.541  -7.895
  593    H    THR  81           H        THR  81  -5.506  -9.053  -5.900
  594    HA   THR  81           HA       THR  81  -7.315  -7.475  -7.611
  595    HB   THR  81           HB       THR  81  -7.825  -8.186  -4.709
  596    HG1  THR  81           HG1      THR  81  -8.247  -9.659  -6.769
  597   HG21  THR  81          HG21      THR  81  -9.542  -6.656  -6.671
  598   HG22  THR  81          HG22      THR  81  -8.635  -5.942  -5.339
  599   HG23  THR  81          HG23      THR  81  -9.961  -7.053  -5.006
  600    H    THR  82           H        THR  82  -6.956  -5.308  -7.528
  601    HA   THR  82           HA       THR  82  -4.838  -4.345  -5.823
  602    HB   THR  82           HB       THR  82  -5.306  -2.143  -6.977
  603    HG1  THR  82           HG1      THR  82  -7.124  -2.055  -8.026
  604   HG21  THR  82          HG21      THR  82  -4.659  -4.526  -8.709
  605   HG22  THR  82          HG22      THR  82  -3.517  -3.619  -7.714
  606   HG23  THR  82          HG23      THR  82  -4.291  -2.845  -9.097
  607    H    THR  83           H        THR  83  -5.093  -3.380  -3.925
  608    HA   THR  83           HA       THR  83  -7.792  -2.822  -2.998
  609    HB   THR  83           HB       THR  83  -6.554  -2.341  -0.805
  610    HG1  THR  83           HG1      THR  83  -4.442  -2.980  -0.686
  611   HG21  THR  83          HG21      THR  83  -6.358  -5.099  -2.026
  612   HG22  THR  83          HG22      THR  83  -7.771  -4.421  -1.214
  613   HG23  THR  83          HG23      THR  83  -6.293  -4.728  -0.302
  614    H    HIS  84           H        HIS  84  -8.628  -0.831  -2.801
  615    HA   HIS  84           HA       HIS  84  -6.859   1.394  -3.499
  616    HB2  HIS  84           HB3      HIS  84  -8.942   2.679  -3.972
  617    HB3  HIS  84           HB2      HIS  84  -8.745   1.256  -4.988
  618    HD1  HIS  84           HD1      HIS  84 -10.645  -0.356  -5.051
  619    HD2  HIS  84           HD2      HIS  84 -10.979   2.337  -1.898
  620    HE1  HIS  84           HE1      HIS  84 -12.938  -0.724  -4.083
  621    HE2  HIS  84           HE2      HIS  84 -13.112   0.901  -2.165
  622    H    THR  85           H        THR  85  -6.370   2.947  -2.137
  623    HA   THR  85           HA       THR  85  -7.794   3.022   0.445
  624    HB   THR  85           HB       THR  85  -5.388   2.253   0.562
  625    HG1  THR  85           HG1      THR  85  -4.873   3.921   2.238
  626   HG21  THR  85          HG21      THR  85  -4.482   3.673  -1.223
  627   HG22  THR  85          HG22      THR  85  -3.623   3.932   0.293
  628   HG23  THR  85          HG23      THR  85  -4.817   5.109  -0.256
  629    H    PHE  86           H        PHE  86  -7.713   5.253   1.457
  630    HA   PHE  86           HA       PHE  86  -8.212   7.196  -0.685
  631    HB2  PHE  86           HB3      PHE  86  -9.233   7.194   2.172
  632    HB3  PHE  86           HB2      PHE  86  -9.629   8.393   0.938
  633    HD1  PHE  86           HD1      PHE  86 -10.821   7.593  -1.159
  634    HD2  PHE  86           HD2      PHE  86 -10.495   5.244   2.377
  635    HE1  PHE  86           HE1      PHE  86 -12.718   6.208  -1.907
  636    HE2  PHE  86           HE2      PHE  86 -12.387   3.859   1.638
  637    HZ   PHE  86           HZ       PHE  86 -13.499   4.338  -0.504
  638    H    VAL  87           H        VAL  87  -6.721   8.662  -0.995
  639    HA   VAL  87           HA       VAL  87  -4.905   9.300   1.231
  640    HB   VAL  87           HB       VAL  87  -3.269   9.987  -0.514
  641   HG11  VAL  87          HG11      VAL  87  -2.670   7.722  -1.217
  642   HG12  VAL  87          HG12      VAL  87  -4.262   7.153  -0.713
  643   HG13  VAL  87          HG13      VAL  87  -3.130   7.783   0.484
  644   HG21  VAL  87          HG21      VAL  87  -5.244   8.760  -2.433
  645   HG22  VAL  87          HG22      VAL  87  -3.616   9.311  -2.829
  646   HG23  VAL  87          HG23      VAL  87  -4.841  10.474  -2.321
  647    H    LYS  88           H        LYS  88  -4.356  11.383   1.657
  648    HA   LYS  88           HA       LYS  88  -6.236  13.419   0.969
  649    HB2  LYS  88           HB3      LYS  88  -4.614  14.876   2.315
  650    HB3  LYS  88           HB2      LYS  88  -5.404  13.558   3.168
  651    HG2  LYS  88           HG3      LYS  88  -3.430  12.258   3.178
  652    HG3  LYS  88           HG2      LYS  88  -2.648  13.309   1.998
  653    HD2  LYS  88           HD3      LYS  88  -2.531  15.097   3.588
  654    HD3  LYS  88           HD2      LYS  88  -3.476  14.178   4.758
  655    HE2  LYS  88           HE3      LYS  88  -0.807  13.276   3.695
  656    HE3  LYS  88           HE2      LYS  88  -0.987  14.230   5.164
  657    HZ1  LYS  88           HZ1      LYS  88  -1.967  11.480   4.656
  658    HZ2  LYS  88           HZ2      LYS  88  -2.514  12.405   5.960
  659    HZ3  LYS  88           HZ3      LYS  88  -0.876  11.997   5.844
  660    H    ALA  89           H        ALA  89  -6.199  14.224  -1.014
  661    HA   ALA  89           HA       ALA  89  -3.632  15.266  -2.024
  662    HB1  ALA  89           HB1      ALA  89  -5.788  13.982  -3.702
  663    HB2  ALA  89           HB2      ALA  89  -4.247  13.242  -3.275
  664    HB3  ALA  89           HB3      ALA  89  -4.280  14.680  -4.294
  665    H    LEU  90           H        LEU  90  -3.687  17.323  -2.801
  666    HA   LEU  90           HA       LEU  90  -6.045  18.883  -2.344
  667    HB2  LEU  90           HB3      LEU  90  -3.693  19.734  -2.043
  668    HB3  LEU  90           HB2      LEU  90  -3.515  19.697  -3.790
  669    HG   LEU  90           HG       LEU  90  -5.518  21.289  -3.871
  670   HD11  LEU  90          HD11      LEU  90  -5.863  22.643  -1.860
  671   HD12  LEU  90          HD12      LEU  90  -4.796  21.565  -0.960
  672   HD13  LEU  90          HD13      LEU  90  -6.319  20.958  -1.611
  673   HD21  LEU  90          HD21      LEU  90  -3.249  22.013  -4.346
  674   HD22  LEU  90          HD22      LEU  90  -2.934  22.213  -2.622
  675   HD23  LEU  90          HD23      LEU  90  -4.111  23.249  -3.430
  676    H    THR  91           H        THR  91  -7.705  18.589  -3.670
  677    HA   THR  91           HA       THR  91  -7.187  18.535  -6.569
  678    HB   THR  91           HB       THR  91  -9.110  16.949  -6.775
  679    HG1  THR  91           HG1      THR  91  -8.828  16.442  -4.009
  680   HG21  THR  91          HG21      THR  91  -6.800  16.097  -6.767
  681   HG22  THR  91          HG22      THR  91  -7.917  14.954  -6.027
  682   HG23  THR  91          HG23      THR  91  -6.869  15.946  -5.014
  683    H    THR  92           H        THR  92  -9.140  19.152  -7.851
  684    HA   THR  92           HA       THR  92 -10.695  21.151  -6.361
  685    HB   THR  92           HB       THR  92  -9.368  22.284  -7.990
  686    HG1  THR  92           HG1      THR  92 -11.133  23.397  -8.271
  687   HG21  THR  92          HG21      THR  92  -9.441  21.783 -10.382
  688   HG22  THR  92          HG22      THR  92 -10.502  20.411 -10.067
  689   HG23  THR  92          HG23      THR  92  -8.846  20.400  -9.463
  690    H    ASP  93           H        ASP  93 -12.626  20.448  -5.887
  691    HA   ASP  93           HA       ASP  93 -13.971  18.500  -7.582
  692    HB2  ASP  93           HB3      ASP  93 -15.575  18.308  -5.741
  693    HB3  ASP  93           HB2      ASP  93 -13.927  18.146  -5.141
  694    H    GLU  94           H        GLU  94 -13.678  21.703  -7.705
  695    HA   GLU  94           HA       GLU  94 -16.094  22.063  -9.195
  696    HB2  GLU  94           HB3      GLU  94 -16.974  22.362  -6.926
  697    HB3  GLU  94           HB2      GLU  94 -15.760  23.585  -6.604
  698    HG2  GLU  94           HG3      GLU  94 -17.884  24.615  -7.052
  699    HG3  GLU  94           HG2      GLU  94 -16.740  25.007  -8.329
  700    H    LYS  95           H        LYS  95 -14.198  24.428  -7.343
  701    HA   LYS  95           HA       LYS  95 -12.702  25.122  -9.756
  702    HB2  LYS  95           HB3      LYS  95 -14.307  27.063  -8.088
  703    HB3  LYS  95           HB2      LYS  95 -13.010  27.572  -9.161
  704    HG2  LYS  95           HG3      LYS  95 -14.212  26.582 -11.058
  705    HG3  LYS  95           HG2      LYS  95 -15.520  26.124  -9.967
  706    HD2  LYS  95           HD3      LYS  95 -15.891  28.474  -9.425
  707    HD3  LYS  95           HD2      LYS  95 -14.583  28.935 -10.515
  708    HE2  LYS  95           HE3      LYS  95 -15.806  27.998 -12.399
  709    HE3  LYS  95           HE2      LYS  95 -17.091  27.471 -11.318
  710    HZ1  LYS  95           HZ1      LYS  95 -17.674  29.517 -12.435
  711    HZ2  LYS  95           HZ2      LYS  95 -16.298  30.284 -11.823
  712    HZ3  LYS  95           HZ3      LYS  95 -17.525  29.784 -10.772
  713    H    GLN  96           H        GLN  96 -13.145  26.073  -6.351
  714    HA   GLN  96           HA       GLN  96 -10.415  26.645  -5.888
  715    HB2  GLN  96           HB3      GLN  96 -12.708  25.997  -4.036
  716    HB3  GLN  96           HB2      GLN  96 -11.090  26.304  -3.435
  717    HG2  GLN  96           HG3      GLN  96 -12.306  28.312  -3.218
  718    HG3  GLN  96           HG2      GLN  96 -11.187  28.536  -4.558
  719   HE21  GLN  96          HE21      GLN  96 -11.986  28.830  -6.614
  720   HE22  GLN  96          HE22      GLN  96 -13.664  29.092  -6.938
  721    H    ALA  97           H        ALA  97  -9.001  25.416  -4.422
  722    HA   ALA  97           HA       ALA  97  -9.218  22.541  -5.001
  723    HB1  ALA  97           HB1      ALA  97  -6.807  22.440  -4.808
  724    HB2  ALA  97           HB2      ALA  97  -6.746  24.141  -4.349
  725    HB3  ALA  97           HB3      ALA  97  -7.265  23.682  -5.971
  726    H    ALA  98           H        ALA  98  -9.114  21.060  -3.388
  727    HA   ALA  98           HA       ALA  98  -8.546  21.965  -0.664
  728    HB1  ALA  98           HB1      ALA  98 -10.948  22.236  -0.898
  729    HB2  ALA  98           HB2      ALA  98 -10.592  20.890   0.186
  730    HB3  ALA  98           HB3      ALA  98 -11.099  20.576  -1.475
  731    H    TRP  99           H        TRP  99  -7.949  20.295   0.752
  732    HA   TRP  99           HA       TRP  99  -6.744  18.021  -0.507
  733    HB2  TRP  99           HB3      TRP  99  -7.036  18.796   2.405
  734    HB3  TRP  99           HB2      TRP  99  -6.160  17.373   1.857
  735    HD1  TRP  99           HD1      TRP  99  -5.846  21.133   2.175
  736    HE1  TRP  99           HE1      TRP  99  -3.450  21.841   1.549
  737    HE3  TRP  99           HE3      TRP  99  -4.146  16.687   0.315
  738    HZ2  TRP  99           HZ2      TRP  99  -1.148  20.665   0.417
  739    HZ3  TRP  99           HZ3      TRP  99  -1.831  16.565  -0.521
  740    HH2  TRP  99           HH2      TRP  99  -0.366  18.515  -0.468
  741    H    ARG 100           H        ARG 100  -8.145  16.615  -1.331
  742    HA   ARG 100           HA       ARG 100 -10.414  15.713   0.295
  743    HB2  ARG 100           HB3      ARG 100  -9.793  15.185  -2.624
  744    HB3  ARG 100           HB2      ARG 100 -11.266  14.723  -1.788
  745    HG2  ARG 100           HG3      ARG 100 -10.348  17.553  -2.255
  746    HG3  ARG 100           HG2      ARG 100 -11.555  16.699  -3.210
  747    HD2  ARG 100           HD3      ARG 100 -12.922  16.432  -1.168
  748    HD3  ARG 100           HD2      ARG 100 -11.735  17.387  -0.284
  749    HE   ARG 100           HE       ARG 100 -12.813  18.677  -2.628
  750   HH11  ARG 100          HH11      ARG 100 -13.150  18.170   0.822
  751   HH12  ARG 100          HH12      ARG 100 -14.102  19.600   1.065
  752   HH21  ARG 100          HH21      ARG 100 -14.056  20.550  -2.325
  753   HH22  ARG 100          HH22      ARG 100 -14.616  20.959  -0.724
  754    H    PHE 101           H        PHE 101 -10.889  13.366   0.207
  755    HA   PHE 101           HA       PHE 101  -8.389  11.826   0.341
  756    HB2  PHE 101           HB3      PHE 101 -11.082  11.310   1.638
  757    HB3  PHE 101           HB2      PHE 101  -9.716  10.204   1.714
  758    HD1  PHE 101           HD1      PHE 101 -11.079  13.388   2.909
  759    HD2  PHE 101           HD2      PHE 101  -7.769  10.709   3.045
  760    HE1  PHE 101           HE1      PHE 101 -10.208  14.566   4.881
  761    HE2  PHE 101           HE2      PHE 101  -6.897  11.886   5.020
  762    HZ   PHE 101           HZ       PHE 101  -8.116  13.818   5.940
  763    H    ILE 102           H        ILE 102  -8.030  10.848  -1.540
  764    HA   ILE 102           HA       ILE 102 -10.370   9.916  -3.076
  765    HB   ILE 102           HB       ILE 102  -8.897  10.155  -5.094
  766   HG12  ILE 102          HG13      ILE 102  -7.125  11.678  -3.173
  767   HG13  ILE 102          HG12      ILE 102  -6.735  10.122  -3.896
  768   HG21  ILE 102          HG21      ILE 102  -9.468  12.644  -3.494
  769   HG22  ILE 102          HG22      ILE 102 -10.575  11.818  -4.593
  770   HG23  ILE 102          HG23      ILE 102  -9.127  12.604  -5.224
  771   HD11  ILE 102          HD11      ILE 102  -6.764  11.151  -6.108
  772   HD12  ILE 102          HD12      ILE 102  -5.595  11.923  -5.035
  773   HD13  ILE 102          HD13      ILE 102  -7.138  12.709  -5.372
  774    H    ARG 103           H        ARG 103 -10.293   7.969  -4.139
  775    HA   ARG 103           HA       ARG 103  -8.712   5.980  -2.783
  776    HB2  ARG 103           HB3      ARG 103  -9.993   4.355  -4.174
  777    HB3  ARG 103           HB2      ARG 103 -11.016   5.437  -3.242
  778    HG2  ARG 103           HG3      ARG 103 -11.853   6.454  -5.084
  779    HG3  ARG 103           HG2      ARG 103 -10.361   6.263  -6.002
  780    HD2  ARG 103           HD3      ARG 103 -12.196   3.972  -5.328
  781    HD3  ARG 103           HD2      ARG 103 -12.314   4.904  -6.822
  782    HE   ARG 103           HE       ARG 103  -9.691   4.084  -6.683
  783   HH11  ARG 103          HH11      ARG 103 -12.815   2.525  -6.744
  784   HH12  ARG 103          HH12      ARG 103 -12.237   1.099  -7.549
  785   HH21  ARG 103          HH21      ARG 103  -8.903   2.178  -7.726
  786   HH22  ARG 103          HH22      ARG 103 -10.021   0.897  -8.088
  787    H    ILE 104           H        ILE 104  -6.742   5.454  -3.374
  788    HA   ILE 104           HA       ILE 104  -6.220   5.136  -6.256
  789    HB   ILE 104           HB       ILE 104  -3.823   5.428  -5.814
  790   HG12  ILE 104          HG13      ILE 104  -4.619   6.252  -3.016
  791   HG13  ILE 104          HG12      ILE 104  -3.919   4.690  -3.419
  792   HG21  ILE 104          HG21      ILE 104  -3.839   7.843  -5.399
  793   HG22  ILE 104          HG22      ILE 104  -5.500   7.727  -4.822
  794   HG23  ILE 104          HG23      ILE 104  -5.125   7.359  -6.506
  795   HD11  ILE 104          HD11      ILE 104  -1.904   5.809  -4.224
  796   HD12  ILE 104          HD12      ILE 104  -2.244   6.195  -2.538
  797   HD13  ILE 104          HD13      ILE 104  -2.610   7.368  -3.802
  798    H    ASP 105           H        ASP 105  -5.311   3.225  -6.914
  799    HA   ASP 105           HA       ASP 105  -5.643   0.961  -5.178
  800    HB2  ASP 105           HB3      ASP 105  -4.516   1.188  -7.987
  801    HB3  ASP 105           HB2      ASP 105  -4.833  -0.333  -7.156
  802    H    THR 106           H        THR 106  -4.171   0.785  -3.568
  803    HA   THR 106           HA       THR 106  -1.485   1.814  -4.080
  804    HB   THR 106           HB       THR 106  -2.648   2.739  -2.139
  805    HG1  THR 106           HG1      THR 106  -0.259   1.348  -1.956
  806   HG21  THR 106          HG21      THR 106  -4.045   0.845  -1.524
  807   HG22  THR 106          HG22      THR 106  -3.055   1.335  -0.150
  808   HG23  THR 106          HG23      THR 106  -2.618  -0.094  -1.086
  809    H    ALA 107           H        ALA 107  -3.073  -1.214  -3.650
  810    HA   ALA 107           HA       ALA 107  -0.484  -2.540  -3.657
  811    HB1  ALA 107           HB1      ALA 107  -2.546  -3.108  -1.534
  812    HB2  ALA 107           HB2      ALA 107  -0.997  -2.300  -1.285
  813    HB3  ALA 107           HB3      ALA 107  -1.039  -3.992  -1.780
  814    H    CYS 108           H        CYS 108  -0.645  -4.837  -4.076
  815    HA   CYS 108           HA       CYS 108  -3.146  -5.624  -5.406
  816    HB2  CYS 108           HB3      CYS 108  -1.471  -5.184  -7.119
  817    HB3  CYS 108           HB2      CYS 108  -0.294  -6.187  -6.271
  818    H    VAL 109           H        VAL 109  -4.057  -7.171  -4.242
  819    HA   VAL 109           HA       VAL 109  -2.328  -8.828  -2.544
  820    HB   VAL 109           HB       VAL 109  -4.269  -9.220  -1.137
  821   HG11  VAL 109          HG11      VAL 109  -4.672  -6.924  -0.343
  822   HG12  VAL 109          HG12      VAL 109  -3.920  -6.304  -1.814
  823   HG13  VAL 109          HG13      VAL 109  -2.967  -7.242  -0.663
  824   HG21  VAL 109          HG21      VAL 109  -5.806  -7.516  -3.101
  825   HG22  VAL 109          HG22      VAL 109  -6.418  -8.119  -1.561
  826   HG23  VAL 109          HG23      VAL 109  -6.008  -9.252  -2.850
  827    H    CYS 110           H        CYS 110  -2.661 -11.038  -2.374
  828    HA   CYS 110           HA       CYS 110  -3.937 -12.313  -4.670
  829    HB2  CYS 110           HB3      CYS 110  -1.686 -13.083  -4.172
  830    HB3  CYS 110           HB2      CYS 110  -2.119 -13.397  -2.498
  831    H    VAL 111           H        VAL 111  -5.944 -13.117  -4.485
  832    HA   VAL 111           HA       VAL 111  -6.975 -13.492  -1.746
  833    HB   VAL 111           HB       VAL 111  -9.192 -12.938  -2.562
  834   HG11  VAL 111          HG11      VAL 111  -8.848 -10.574  -3.123
  835   HG12  VAL 111          HG12      VAL 111  -7.139 -10.902  -3.407
  836   HG13  VAL 111          HG13      VAL 111  -7.818 -11.097  -1.790
  837   HG21  VAL 111          HG21      VAL 111  -8.986 -13.830  -4.827
  838   HG22  VAL 111          HG22      VAL 111  -7.904 -12.502  -5.251
  839   HG23  VAL 111          HG23      VAL 111  -9.586 -12.172  -4.837
  840    H    LEU 112           H        LEU 112  -8.499 -15.170  -1.381
  841    HA   LEU 112           HA       LEU 112  -8.588 -17.254  -3.464
  842    HB2  LEU 112           HB3      LEU 112  -8.450 -17.582  -0.460
  843    HB3  LEU 112           HB2      LEU 112  -8.847 -18.890  -1.562
  844    HG   LEU 112           HG       LEU 112  -6.220 -17.393  -1.476
  845   HD11  LEU 112          HD11      LEU 112  -6.525 -18.868   0.439
  846   HD12  LEU 112          HD12      LEU 112  -5.312 -19.515  -0.667
  847   HD13  LEU 112          HD13      LEU 112  -6.938 -20.202  -0.641
  848   HD21  LEU 112          HD21      LEU 112  -5.466 -19.146  -3.041
  849   HD22  LEU 112          HD22      LEU 112  -6.701 -18.095  -3.728
  850   HD23  LEU 112          HD23      LEU 112  -7.130 -19.711  -3.172
  851    H    SER 113           H        SER 113 -10.563 -18.046  -3.963
  852    HA   SER 113           HA       SER 113 -12.829 -17.148  -2.314
  853    HB2  SER 113           HB3      SER 113 -12.790 -15.930  -4.448
  854    HB3  SER 113           HB2      SER 113 -12.730 -17.456  -5.330
  855    HG   SER 113           HG       SER 113 -14.870 -16.135  -4.437
  856    H    ARG 114           H        ARG 114 -14.419 -18.605  -1.905
  857    HA   ARG 114           HA       ARG 114 -13.700 -21.370  -2.012
  858    HB2  ARG 114           HB3      ARG 114 -14.921 -20.335  -0.113
  859    HB3  ARG 114           HB2      ARG 114 -16.299 -20.062  -1.164
  860    HG2  ARG 114           HG3      ARG 114 -16.730 -21.982   0.190
  861    HG3  ARG 114           HG2      ARG 114 -16.490 -22.514  -1.473
  862    HD2  ARG 114           HD3      ARG 114 -15.338 -24.008   0.034
  863    HD3  ARG 114           HD2      ARG 114 -14.162 -23.104  -0.917
  864    HE   ARG 114           HE       ARG 114 -14.491 -21.661   1.401
  865   HH11  ARG 114          HH11      ARG 114 -13.524 -24.928   0.601
  866   HH12  ARG 114          HH12      ARG 114 -12.444 -25.071   1.950
  867   HH21  ARG 114          HH21      ARG 114 -13.112 -21.863   3.200
  868   HH22  ARG 114          HH22      ARG 114 -12.223 -23.333   3.442
  869    H    LYS 115           H        LYS 115 -15.081 -19.296  -4.199
  870    HA   LYS 115           HA       LYS 115 -15.884 -19.578  -6.299
  871    HB2  LYS 115           HB3      LYS 115 -15.750 -22.553  -5.759
  872    HB3  LYS 115           HB2      LYS 115 -16.011 -21.809  -7.329
  873    HG2  LYS 115           HG3      LYS 115 -13.756 -20.694  -7.013
  874    HG3  LYS 115           HG2      LYS 115 -13.530 -21.788  -5.642
  875    HD2  LYS 115           HD3      LYS 115 -14.054 -22.600  -8.496
  876    HD3  LYS 115           HD2      LYS 115 -12.508 -22.701  -7.655
  877    HE2  LYS 115           HE3      LYS 115 -13.426 -24.309  -6.098
  878    HE3  LYS 115           HE2      LYS 115 -15.017 -24.151  -6.839
  879    HZ1  LYS 115           HZ1      LYS 115 -12.597 -25.153  -8.228
  880    HZ2  LYS 115           HZ2      LYS 115 -14.157 -25.078  -8.870
  881    HZ3  LYS 115           HZ3      LYS 115 -13.819 -26.131  -7.591
  882    H    ALA 116           H        ALA 116 -17.366 -21.916  -4.070
  883    HA   ALA 116           HA       ALA 116 -19.952 -21.727  -5.262
  884    HB1  ALA 116           HB1      ALA 116 -19.174 -22.746  -2.532
  885    HB2  ALA 116           HB2      ALA 116 -19.213 -23.704  -4.012
  886    HB3  ALA 116           HB3      ALA 116 -20.706 -23.034  -3.357
  887    H    THR 117           H        THR 117 -18.211 -19.812  -3.037
  888    HA   THR 117           HA       THR 117 -20.525 -18.602  -1.805
  889    HB   THR 117           HB       THR 117 -18.783 -17.034  -0.841
  890    HG1  THR 117           HG1      THR 117 -17.072 -17.185  -2.199
  891   HG21  THR 117          HG21      THR 117 -18.414 -19.996  -0.372
  892   HG22  THR 117          HG22      THR 117 -19.602 -18.959   0.419
  893   HG23  THR 117          HG23      THR 117 -17.881 -18.713   0.713
  894    H    ARG 118           H        ARG 118 -21.124 -16.398  -2.067
  895    HA   ARG 118           HA       ARG 118 -20.073 -15.114  -4.499
  896    HB2  ARG 118           HB3      ARG 118 -22.951 -14.968  -3.575
  897    HB3  ARG 118           HB2      ARG 118 -22.288 -14.287  -5.045
  898    HG2  ARG 118           HG3      ARG 118 -22.673 -17.200  -4.398
  899    HG3  ARG 118           HG2      ARG 118 -23.544 -16.241  -5.592
  900    HD2  ARG 118           HD3      ARG 118 -20.635 -17.027  -5.658
  901    HD3  ARG 118           HD2      ARG 118 -21.918 -17.619  -6.708
  902    HE   ARG 118           HE       ARG 118 -22.064 -15.296  -7.572
  903   HH11  ARG 118          HH11      ARG 118 -19.133 -16.354  -5.973
  904   HH12  ARG 118          HH12      ARG 118 -18.111 -15.263  -6.858
  905   HH21  ARG 118          HH21      ARG 118 -20.716 -13.867  -8.744
  906   HH22  ARG 118          HH22      ARG 118 -19.006 -13.875  -8.450
  907    H1   SER   1           H1       SER   1 -27.535   2.483 -12.388
  908    H2   SER   1           H2       SER   1 -26.044   2.996 -13.001
  909    H3   SER   1           H3       SER   1 -26.226   2.719 -11.345
  910    HA   SER   1           HA       SER   1 -26.553   0.387 -11.712
  911    HB2  SER   1           HB3      SER   1 -26.043   1.011 -14.631
  912    HB3  SER   1           HB2      SER   1 -26.416  -0.565 -13.933
  913    HG   SER   1           HG       SER   1 -28.468   0.297 -13.324
  914    H    SER   2           H        SER   2 -24.753  -0.627 -11.057
  915    HA   SER   2           HA       SER   2 -22.174   0.242 -12.177
  916    HB2  SER   2           HB3      SER   2 -22.722  -0.444  -9.276
  917    HB3  SER   2           HB2      SER   2 -21.152  -0.008  -9.953
  918    HG   SER   2           HG       SER   2 -22.086   2.033 -10.523
  919    H    THR   3           H        THR   3 -21.486  -1.427 -13.358
  920    HA   THR   3           HA       THR   3 -22.232  -4.135 -12.692
  921    HB   THR   3           HB       THR   3 -20.680  -4.616 -14.722
  922    HG1  THR   3           HG1      THR   3 -19.656  -2.629 -14.888
  923   HG21  THR   3          HG21      THR   3 -23.234  -3.040 -15.034
  924   HG22  THR   3          HG22      THR   3 -23.107  -4.784 -14.811
  925   HG23  THR   3          HG23      THR   3 -22.488  -4.037 -16.283
  926    H    HIS   4           H        HIS   4 -21.065  -3.853 -10.565
  927    HA   HIS   4           HA       HIS   4 -18.217  -4.528 -10.874
  928    HB2  HIS   4           HB3      HIS   4 -19.063  -2.545  -9.368
  929    HB3  HIS   4           HB2      HIS   4 -19.467  -3.828  -8.235
  930    HD1  HIS   4           HD1      HIS   4 -16.930  -1.511  -8.692
  931    HD2  HIS   4           HD2      HIS   4 -16.900  -5.626  -8.094
  932    HE1  HIS   4           HE1      HIS   4 -14.631  -2.055  -7.844
  933    HE2  HIS   4           HE2      HIS   4 -14.570  -4.568  -7.723
  934    HA   PRO   5           HA       PRO   5 -19.820  -8.612  -9.942
  935    HB2  PRO   5           HB3      PRO   5 -17.527  -9.974 -10.362
  936    HB3  PRO   5           HB2      PRO   5 -18.505  -9.338 -11.691
  937    HG2  PRO   5           HG3      PRO   5 -16.026  -8.206 -10.447
  938    HG3  PRO   5           HG2      PRO   5 -16.457  -8.323 -12.162
  939    HD2  PRO   5           HD3      PRO   5 -16.725  -6.034 -10.712
  940    HD3  PRO   5           HD2      PRO   5 -17.779  -6.436 -12.084
  941    H    VAL   6           H        VAL   6 -19.753  -7.419  -7.673
  942    HA   VAL   6           HA       VAL   6 -19.475  -7.671  -5.434
  943    HB   VAL   6           HB       VAL   6 -18.537 -10.460  -6.104
  944   HG11  VAL   6          HG11      VAL   6 -19.877  -9.353  -3.641
  945   HG12  VAL   6          HG12      VAL   6 -18.178  -9.799  -3.779
  946   HG13  VAL   6          HG13      VAL   6 -19.428 -11.038  -3.908
  947   HG21  VAL   6          HG21      VAL   6 -21.347  -9.434  -5.729
  948   HG22  VAL   6          HG22      VAL   6 -20.887 -11.130  -5.893
  949   HG23  VAL   6          HG23      VAL   6 -20.640 -10.015  -7.237
  950    H    PHE   7           H        PHE   7 -17.798  -6.175  -5.231
  951    HA   PHE   7           HA       PHE   7 -15.076  -6.696  -5.665
  952    HB2  PHE   7           HB3      PHE   7 -15.985  -4.418  -5.426
  953    HB3  PHE   7           HB2      PHE   7 -16.333  -4.732  -3.732
  954    HD1  PHE   7           HD1      PHE   7 -13.580  -4.411  -6.187
  955    HD2  PHE   7           HD2      PHE   7 -14.696  -4.412  -2.082
  956    HE1  PHE   7           HE1      PHE   7 -11.338  -3.616  -5.587
  957    HE2  PHE   7           HE2      PHE   7 -12.450  -3.616  -1.473
  958    HZ   PHE   7           HZ       PHE   7 -10.766  -3.216  -3.222
  959    H    HIS   8           H        HIS   8 -17.168  -7.598  -3.087
  960    HA   HIS   8           HA       HIS   8 -15.303  -7.883  -1.011
  961    HB2  HIS   8           HB3      HIS   8 -17.800  -7.964  -0.750
  962    HB3  HIS   8           HB2      HIS   8 -17.762  -9.591  -1.426
  963    HD1  HIS   8           HD1      HIS   8 -16.073  -7.722   1.434
  964    HD2  HIS   8           HD2      HIS   8 -17.560 -11.496   0.494
  965    HE1  HIS   8           HE1      HIS   8 -15.800  -9.105   3.522
  966    HE2  HIS   8           HE2      HIS   8 -16.579 -11.414   2.887
  967    H    MET   9           H        MET   9 -15.766  -9.754  -3.872
  968    HA   MET   9           HA       MET   9 -14.585 -12.164  -2.858
  969    HB2  MET   9           HB3      MET   9 -14.967 -11.200  -5.696
  970    HB3  MET   9           HB2      MET   9 -14.329 -12.780  -5.274
  971    HG2  MET   9           HG3      MET   9 -16.484 -13.181  -4.024
  972    HG3  MET   9           HG2      MET   9 -17.093 -11.712  -4.782
  973    HE1  MET   9           HE1      MET   9 -15.497 -11.990  -7.621
  974    HE2  MET   9           HE2      MET   9 -17.159 -11.413  -7.488
  975    HE3  MET   9           HE3      MET   9 -16.765 -12.716  -8.607
  976    H    GLY  10           H        GLY  10 -13.419  -9.129  -3.778
  977    HA2  GLY  10           HA3      GLY  10 -10.689 -10.148  -4.155
  978    HA3  GLY  10           HA2      GLY  10 -11.234  -8.514  -4.499
  979    H    GLU  11           H        GLU  11 -12.602  -9.446  -1.655
  980    HA   GLU  11           HA       GLU  11 -10.539  -8.059  -0.096
  981    HB2  GLU  11           HB3      GLU  11 -13.413  -8.694   0.612
  982    HB3  GLU  11           HB2      GLU  11 -12.287  -7.805   1.633
  983    HG2  GLU  11           HG3      GLU  11 -12.123  -6.096  -0.185
  984    HG3  GLU  11           HG2      GLU  11 -13.419  -6.950  -1.025
  985    H    PHE  12           H        PHE  12 -10.856 -11.017  -0.989
  986    HA   PHE  12           HA       PHE  12 -10.851 -12.343   1.596
  987    HB2  PHE  12           HB3      PHE  12 -10.742 -13.341  -1.240
  988    HB3  PHE  12           HB2      PHE  12 -10.366 -14.403   0.114
  989    HD1  PHE  12           HD1      PHE  12 -12.947 -12.997  -1.891
  990    HD2  PHE  12           HD2      PHE  12 -12.121 -14.655   1.939
  991    HE1  PHE  12           HE1      PHE  12 -15.344 -13.452  -1.574
  992    HE2  PHE  12           HE2      PHE  12 -14.516 -15.116   2.262
  993    HZ   PHE  12           HZ       PHE  12 -16.128 -14.514   0.501
  994    H    SER  13           H        SER  13  -8.950 -10.925   2.096
  995    HA   SER  13           HA       SER  13  -6.403 -11.366   1.032
  996    HB2  SER  13           HB3      SER  13  -7.002 -10.733   3.928
  997    HB3  SER  13           HB2      SER  13  -5.596 -10.247   2.987
  998    HG   SER  13           HG       SER  13  -7.942  -8.989   3.271
  999    H    VAL  14           H        VAL  14  -5.302 -13.239   0.970
 1000    HA   VAL  14           HA       VAL  14  -5.923 -15.555   2.393
 1001    HB   VAL  14           HB       VAL  14  -3.643 -16.372   1.797
 1002   HG11  VAL  14          HG11      VAL  14  -5.475 -16.614   0.228
 1003   HG12  VAL  14          HG12      VAL  14  -3.969 -16.290  -0.633
 1004   HG13  VAL  14          HG13      VAL  14  -5.159 -15.005  -0.421
 1005   HG21  VAL  14          HG21      VAL  14  -2.428 -14.259   2.020
 1006   HG22  VAL  14          HG22      VAL  14  -3.282 -13.616   0.617
 1007   HG23  VAL  14          HG23      VAL  14  -2.179 -14.980   0.429
 1008    H    CYS  15           H        CYS  15  -3.924 -12.851   3.254
 1009    HA   CYS  15           HA       CYS  15  -3.272 -14.148   5.804
 1010    HB2  CYS  15           HB3      CYS  15  -1.295 -13.403   4.569
 1011    HB3  CYS  15           HB2      CYS  15  -1.967 -11.775   4.442
 1012    H    ASP  16           H        ASP  16  -4.192 -13.402   7.597
 1013    HA   ASP  16           HA       ASP  16  -6.221 -11.427   7.491
 1014    HB2  ASP  16           HB3      ASP  16  -4.853 -12.701   9.874
 1015    HB3  ASP  16           HB2      ASP  16  -6.284 -11.685   9.971
 1016    H    SER  17           H        SER  17  -5.968  -9.319   7.451
 1017    HA   SER  17           HA       SER  17  -3.673  -8.132   8.831
 1018    HB2  SER  17           HB3      SER  17  -3.533  -6.518   6.847
 1019    HB3  SER  17           HB2      SER  17  -2.948  -8.161   6.565
 1020    HG   SER  17           HG       SER  17  -4.749  -8.616   5.406
 1021    H    VAL  18           H        VAL  18  -3.954  -5.903   9.410
 1022    HA   VAL  18           HA       VAL  18  -6.777  -5.080   9.446
 1023    HB   VAL  18           HB       VAL  18  -6.130  -5.835  11.659
 1024   HG11  VAL  18          HG11      VAL  18  -3.948  -3.768  11.525
 1025   HG12  VAL  18          HG12      VAL  18  -3.738  -5.519  11.548
 1026   HG13  VAL  18          HG13      VAL  18  -4.399  -4.693  12.958
 1027   HG21  VAL  18          HG21      VAL  18  -6.671  -3.817  12.940
 1028   HG22  VAL  18          HG22      VAL  18  -7.706  -4.010  11.526
 1029   HG23  VAL  18          HG23      VAL  18  -6.384  -2.841  11.499
 1030    H    SER  19           H        SER  19  -7.043  -3.345   8.235
 1031    HA   SER  19           HA       SER  19  -4.872  -1.446   7.868
 1032    HB2  SER  19           HB3      SER  19  -7.662  -1.513   6.675
 1033    HB3  SER  19           HB2      SER  19  -6.380  -0.380   6.224
 1034    HG   SER  19           HG       SER  19  -5.156  -2.109   5.465
 1035    H    VAL  20           H        VAL  20  -4.643   0.269   9.128
 1036    HA   VAL  20           HA       VAL  20  -6.941   1.094  10.781
 1037    HB   VAL  20           HB       VAL  20  -4.007   1.199  11.495
 1038   HG11  VAL  20          HG11      VAL  20  -6.450   1.821  13.141
 1039   HG12  VAL  20          HG12      VAL  20  -5.241   2.972  12.569
 1040   HG13  VAL  20          HG13      VAL  20  -4.800   1.745  13.755
 1041   HG21  VAL  20          HG21      VAL  20  -4.491  -0.598  13.072
 1042   HG22  VAL  20          HG22      VAL  20  -4.827  -1.094  11.413
 1043   HG23  VAL  20          HG23      VAL  20  -6.154  -0.664  12.492
 1044    H    TRP  21           H        TRP  21  -7.442   3.205  10.847
 1045    HA   TRP  21           HA       TRP  21  -5.798   5.061   9.305
 1046    HB2  TRP  21           HB3      TRP  21  -8.590   5.321  10.450
 1047    HB3  TRP  21           HB2      TRP  21  -7.739   6.632   9.633
 1048    HD1  TRP  21           HD1      TRP  21  -9.679   3.448   8.951
 1049    HE1  TRP  21           HE1      TRP  21 -10.017   3.176   6.414
 1050    HE3  TRP  21           HE3      TRP  21  -6.573   7.176   7.317
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.082   4.378   4.037
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.354   7.547   4.892
 1053    HH2  TRP  21           HH2      TRP  21  -7.582   6.176   3.290
 1054    H    VAL  22           H        VAL  22  -4.141   5.627  10.528
 1055    HA   VAL  22           HA       VAL  22  -4.359   5.895  13.386
 1056    HB   VAL  22           HB       VAL  22  -2.021   6.504  11.567
 1057   HG11  VAL  22          HG11      VAL  22  -2.096   6.026  14.541
 1058   HG12  VAL  22          HG12      VAL  22  -1.856   7.586  13.754
 1059   HG13  VAL  22          HG13      VAL  22  -0.653   6.310  13.569
 1060   HG21  VAL  22          HG21      VAL  22  -1.180   4.297  12.217
 1061   HG22  VAL  22          HG22      VAL  22  -2.717   4.180  11.363
 1062   HG23  VAL  22          HG23      VAL  22  -2.667   3.998  13.116
 1063    H    GLY  23           H        GLY  23  -4.439   7.726  14.552
 1064    HA2  GLY  23           HA3      GLY  23  -5.280  10.128  13.229
 1065    HA3  GLY  23           HA2      GLY  23  -5.100   9.894  14.965
 1066    H    ASP  24           H        ASP  24  -3.028  10.016  12.091
 1067    HA   ASP  24           HA       ASP  24  -1.352  11.413  11.487
 1068    HB2  ASP  24           HB3      ASP  24  -1.958  12.937  14.029
 1069    HB3  ASP  24           HB2      ASP  24  -0.930  13.499  12.711
 1070    H    LYS  25           H        LYS  25  -1.314   9.406  14.037
 1071    HA   LYS  25           HA       LYS  25   0.288   8.340  15.244
 1072    HB2  LYS  25           HB3      LYS  25   0.975   8.196  12.691
 1073    HB3  LYS  25           HB2      LYS  25   2.343   9.152  13.234
 1074    HG2  LYS  25           HG3      LYS  25   3.074   7.449  14.695
 1075    HG3  LYS  25           HG2      LYS  25   1.566   6.551  14.523
 1076    HD2  LYS  25           HD3      LYS  25   2.114   6.227  12.114
 1077    HD3  LYS  25           HD2      LYS  25   3.672   6.994  12.408
 1078    HE2  LYS  25           HE3      LYS  25   4.250   5.247  14.006
 1079    HE3  LYS  25           HE2      LYS  25   2.673   4.492  13.774
 1080    HZ1  LYS  25           HZ1      LYS  25   4.409   3.385  12.502
 1081    HZ2  LYS  25           HZ2      LYS  25   4.748   4.815  11.671
 1082    HZ3  LYS  25           HZ3      LYS  25   3.244   4.056  11.470
 1083    H    THR  26           H        THR  26   3.244   9.274  14.961
 1084    HA   THR  26           HA       THR  26   3.112  11.880  16.249
 1085    HB   THR  26           HB       THR  26   4.559   9.589  17.591
 1086    HG1  THR  26           HG1      THR  26   1.967  10.578  17.839
 1087   HG21  THR  26          HG21      THR  26   5.587  11.776  17.970
 1088   HG22  THR  26          HG22      THR  26   4.832  11.168  19.443
 1089   HG23  THR  26          HG23      THR  26   4.033  12.423  18.496
 1090    H    THR  27           H        THR  27   5.300   9.226  15.348
 1091    HA   THR  27           HA       THR  27   7.022  11.195  14.031
 1092    HB   THR  27           HB       THR  27   8.972   9.665  14.734
 1093    HG1  THR  27           HG1      THR  27   6.997   8.359  15.888
 1094   HG21  THR  27          HG21      THR  27   9.276  10.877  16.848
 1095   HG22  THR  27          HG22      THR  27   7.585  11.375  16.801
 1096   HG23  THR  27          HG23      THR  27   8.707  11.942  15.563
 1097    H    ALA  28           H        ALA  28   8.048  10.488  12.168
 1098    HA   ALA  28           HA       ALA  28   7.515   7.739  11.299
 1099    HB1  ALA  28           HB1      ALA  28   6.670   8.463   9.148
 1100    HB2  ALA  28           HB2      ALA  28   6.837  10.152   9.628
 1101    HB3  ALA  28           HB3      ALA  28   5.667   9.115  10.445
 1102    H    THR  29           H        THR  29   8.743   7.225   9.273
 1103    HA   THR  29           HA       THR  29  11.354   8.559   9.401
 1104    HB   THR  29           HB       THR  29  10.753   5.864   8.180
 1105    HG1  THR  29           HG1      THR  29  10.623   6.464  10.719
 1106   HG21  THR  29          HG21      THR  29  13.327   7.147   9.102
 1107   HG22  THR  29          HG22      THR  29  12.826   6.923   7.425
 1108   HG23  THR  29          HG23      THR  29  13.167   5.520   8.439
 1109    H    ASP  30           H        ASP  30  11.805   9.919   7.838
 1110    HA   ASP  30           HA       ASP  30  10.310  10.150   5.425
 1111    HB2  ASP  30           HB3      ASP  30  11.403  12.084   6.483
 1112    HB3  ASP  30           HB2      ASP  30  12.983  11.347   6.222
 1113    H    ILE  31           H        ILE  31  11.326  10.056   3.242
 1114    HA   ILE  31           HA       ILE  31  12.274   7.483   2.688
 1115    HB   ILE  31           HB       ILE  31  11.041   8.832   1.059
 1116   HG12  ILE  31          HG13      ILE  31  13.801   8.159   0.016
 1117   HG13  ILE  31          HG12      ILE  31  12.520   6.982   0.285
 1118   HG21  ILE  31          HG21      ILE  31  13.539  10.516   0.900
 1119   HG22  ILE  31          HG22      ILE  31  11.974  11.016   1.541
 1120   HG23  ILE  31          HG23      ILE  31  12.146  10.645  -0.175
 1121   HD11  ILE  31          HD11      ILE  31  12.431   9.284  -1.650
 1122   HD12  ILE  31          HD12      ILE  31  11.137   8.116  -1.378
 1123   HD13  ILE  31          HD13      ILE  31  12.677   7.587  -2.055
 1124    H    LYS  32           H        LYS  32  13.975  10.408   3.476
 1125    HA   LYS  32           HA       LYS  32  16.536   9.507   2.506
 1126    HB2  LYS  32           HB3      LYS  32  15.823  11.750   4.398
 1127    HB3  LYS  32           HB2      LYS  32  17.398  11.503   3.652
 1128    HG2  LYS  32           HG3      LYS  32  16.513  11.956   1.482
 1129    HG3  LYS  32           HG2      LYS  32  14.863  11.974   2.105
 1130    HD2  LYS  32           HD3      LYS  32  15.453  13.910   3.506
 1131    HD3  LYS  32           HD2      LYS  32  17.058  13.928   2.772
 1132    HE2  LYS  32           HE3      LYS  32  16.078  14.326   0.593
 1133    HE3  LYS  32           HE2      LYS  32  14.458  14.220   1.279
 1134    HZ1  LYS  32           HZ1      LYS  32  14.936  16.171   2.613
 1135    HZ2  LYS  32           HZ2      LYS  32  15.144  16.511   0.972
 1136    HZ3  LYS  32           HZ3      LYS  32  16.492  16.272   1.964
 1137    H    GLY  33           H        GLY  33  14.651   8.642   5.102
 1138    HA2  GLY  33           HA3      GLY  33  15.253   7.026   6.704
 1139    HA3  GLY  33           HA2      GLY  33  16.949   7.415   6.429
 1140    H    LYS  34           H        LYS  34  14.798  10.039   6.861
 1141    HA   LYS  34           HA       LYS  34  16.051  10.651   9.426
 1142    HB2  LYS  34           HB3      LYS  34  14.311  12.313   7.598
 1143    HB3  LYS  34           HB2      LYS  34  15.023  12.892   9.093
 1144    HG2  LYS  34           HG3      LYS  34  16.601  11.889   6.738
 1145    HG3  LYS  34           HG2      LYS  34  16.234  13.582   7.050
 1146    HD2  LYS  34           HD3      LYS  34  17.375  13.379   9.239
 1147    HD3  LYS  34           HD2      LYS  34  17.839  11.733   8.805
 1148    HE2  LYS  34           HE3      LYS  34  19.137  12.534   6.947
 1149    HE3  LYS  34           HE2      LYS  34  18.545  14.172   7.190
 1150    HZ1  LYS  34           HZ1      LYS  34  20.774  13.889   8.071
 1151    HZ2  LYS  34           HZ2      LYS  34  20.240  12.656   9.096
 1152    HZ3  LYS  34           HZ3      LYS  34  19.683  14.237   9.314
 1153    H    GLU  35           H        GLU  35  14.987  10.510  11.318
 1154    HA   GLU  35           HA       GLU  35  12.187   9.773  11.316
 1155    HB2  GLU  35           HB3      GLU  35  13.745   8.713  12.908
 1156    HB3  GLU  35           HB2      GLU  35  14.077  10.285  13.620
 1157    HG2  GLU  35           HG3      GLU  35  11.776  10.463  14.362
 1158    HG3  GLU  35           HG2      GLU  35  11.396   8.921  13.596
 1159    H    VAL  36           H        VAL  36  10.667  11.251  11.197
 1160    HA   VAL  36           HA       VAL  36  11.267  13.968  12.150
 1161    HB   VAL  36           HB       VAL  36   9.728  14.808  10.417
 1162   HG11  VAL  36          HG11      VAL  36  11.940  13.066   9.342
 1163   HG12  VAL  36          HG12      VAL  36  12.111  14.716   9.941
 1164   HG13  VAL  36          HG13      VAL  36  11.173  14.400   8.481
 1165   HG21  VAL  36          HG21      VAL  36   8.319  12.821  10.188
 1166   HG22  VAL  36          HG22      VAL  36   9.667  11.951   9.452
 1167   HG23  VAL  36          HG23      VAL  36   8.959  13.340   8.628
 1168    H    THR  37           H        THR  37   9.501  15.192  12.964
 1169    HA   THR  37           HA       THR  37   7.595  13.539  14.410
 1170    HB   THR  37           HB       THR  37   8.040  16.516  14.645
 1171    HG1  THR  37           HG1      THR  37   9.464  16.003  16.336
 1172   HG21  THR  37          HG21      THR  37   6.814  14.502  16.531
 1173   HG22  THR  37          HG22      THR  37   5.940  15.718  15.600
 1174   HG23  THR  37          HG23      THR  37   7.054  16.215  16.874
 1175    H    VAL  38           H        VAL  38   5.505  13.407  13.885
 1176    HA   VAL  38           HA       VAL  38   4.579  14.932  11.584
 1177    HB   VAL  38           HB       VAL  38   3.139  12.726  13.068
 1178   HG11  VAL  38          HG11      VAL  38   2.697  13.858  10.306
 1179   HG12  VAL  38          HG12      VAL  38   1.708  14.208  11.724
 1180   HG13  VAL  38          HG13      VAL  38   1.766  12.573  11.075
 1181   HG21  VAL  38          HG21      VAL  38   4.846  12.549  10.586
 1182   HG22  VAL  38          HG22      VAL  38   3.878  11.240  11.268
 1183   HG23  VAL  38          HG23      VAL  38   5.245  11.890  12.172
 1184    H    LEU  39           H        LEU  39   2.879  16.336  11.624
 1185    HA   LEU  39           HA       LEU  39   2.223  17.452  14.217
 1186    HB2  LEU  39           HB3      LEU  39   1.330  18.327  11.466
 1187    HB3  LEU  39           HB2      LEU  39   1.197  19.253  12.950
 1188    HG   LEU  39           HG       LEU  39   3.788  18.475  11.615
 1189   HD11  LEU  39          HD11      LEU  39   2.554  20.104  10.311
 1190   HD12  LEU  39          HD12      LEU  39   3.960  20.848  11.072
 1191   HD13  LEU  39          HD13      LEU  39   2.351  21.114  11.742
 1192   HD21  LEU  39          HD21      LEU  39   3.236  20.249  13.986
 1193   HD22  LEU  39          HD22      LEU  39   4.804  20.033  13.208
 1194   HD23  LEU  39          HD23      LEU  39   4.030  18.675  14.022
 1195    H    ALA  40           H        ALA  40   0.422  17.008  15.293
 1196    HA   ALA  40           HA       ALA  40  -1.486  15.129  14.387
 1197    HB1  ALA  40           HB1      ALA  40  -1.735  17.098  16.657
 1198    HB2  ALA  40           HB2      ALA  40  -0.972  15.514  16.768
 1199    HB3  ALA  40           HB3      ALA  40  -2.697  15.641  16.426
 1200    H    GLU  41           H        GLU  41  -1.239  18.561  14.246
 1201    HA   GLU  41           HA       GLU  41  -3.511  18.589  12.408
 1202    HB2  GLU  41           HB3      GLU  41  -2.959  20.652  14.553
 1203    HB3  GLU  41           HB2      GLU  41  -4.126  20.851  13.256
 1204    HG2  GLU  41           HG3      GLU  41  -5.367  18.911  14.097
 1205    HG3  GLU  41           HG2      GLU  41  -4.207  18.764  15.417
 1206    H    VAL  42           H        VAL  42  -2.917  19.445  10.504
 1207    HA   VAL  42           HA       VAL  42  -0.228  20.540  10.342
 1208    HB   VAL  42           HB       VAL  42  -0.470  20.327   7.895
 1209   HG11  VAL  42          HG11      VAL  42   0.415  18.470   9.196
 1210   HG12  VAL  42          HG12      VAL  42  -0.502  17.892   7.804
 1211   HG13  VAL  42          HG13      VAL  42  -1.218  17.836   9.416
 1212   HG21  VAL  42          HG21      VAL  42  -2.391  19.211   6.915
 1213   HG22  VAL  42          HG22      VAL  42  -2.889  20.697   7.725
 1214   HG23  VAL  42          HG23      VAL  42  -3.175  19.135   8.493
 1215    H    ASN  43           H        ASN  43   0.211  22.605  10.122
 1216    HA   ASN  43           HA       ASN  43  -1.982  24.473   9.986
 1217    HB2  ASN  43           HB3      ASN  43  -0.163  26.208  10.289
 1218    HB3  ASN  43           HB2      ASN  43  -0.326  25.045  11.600
 1219   HD21  ASN  43          HD21      ASN  43   1.303  23.566  11.971
 1220   HD22  ASN  43          HD22      ASN  43   2.872  23.713  11.249
 1221    H    ILE  44           H        ILE  44  -2.811  24.503   8.031
 1222    HA   ILE  44           HA       ILE  44  -1.079  25.253   5.776
 1223    HB   ILE  44           HB       ILE  44  -3.924  24.199   5.804
 1224   HG12  ILE  44          HG13      ILE  44  -2.327  22.467   6.384
 1225   HG13  ILE  44          HG12      ILE  44  -2.944  22.180   4.759
 1226   HG21  ILE  44          HG21      ILE  44  -2.139  24.809   3.451
 1227   HG22  ILE  44          HG22      ILE  44  -3.583  25.703   3.926
 1228   HG23  ILE  44          HG23      ILE  44  -3.721  24.035   3.370
 1229   HD11  ILE  44          HD11      ILE  44  -0.898  23.093   3.810
 1230   HD12  ILE  44          HD12      ILE  44  -0.546  21.763   4.914
 1231   HD13  ILE  44          HD13      ILE  44  -0.285  23.427   5.429
 1232    H    ASN  45           H        ASN  45  -1.811  27.069   4.466
 1233    HA   ASN  45           HA       ASN  45  -2.342  29.308   6.017
 1234    HB2  ASN  45           HB3      ASN  45  -1.260  29.368   3.786
 1235    HB3  ASN  45           HB2      ASN  45  -2.823  29.036   3.044
 1236   HD21  ASN  45          HD21      ASN  45  -0.930  31.377   4.815
 1237   HD22  ASN  45          HD22      ASN  45  -1.922  32.744   4.440
 1238    H    ASN  46           H        ASN  46  -4.080  29.619   7.153
 1239    HA   ASN  46           HA       ASN  46  -6.213  30.050   7.742
 1240    HB2  ASN  46           HB3      ASN  46  -6.672  30.099   4.755
 1241    HB3  ASN  46           HB2      ASN  46  -7.880  30.562   5.950
 1242   HD21  ASN  46          HD21      ASN  46  -6.598  32.128   3.833
 1243   HD22  ASN  46          HD22      ASN  46  -5.880  33.484   4.627
 1244    H    SER  47           H        SER  47  -5.238  27.273   7.386
 1245    HA   SER  47           HA       SER  47  -7.775  26.040   7.916
 1246    HB2  SER  47           HB3      SER  47  -7.699  25.936   5.435
 1247    HB3  SER  47           HB2      SER  47  -6.177  25.050   5.539
 1248    HG   SER  47           HG       SER  47  -8.350  24.064   6.985
 1249    H    VAL  48           H        VAL  48  -7.325  24.942   9.707
 1250    HA   VAL  48           HA       VAL  48  -4.802  23.420   9.825
 1251    HB   VAL  48           HB       VAL  48  -6.412  24.516  12.141
 1252   HG11  VAL  48          HG11      VAL  48  -4.531  23.784  13.527
 1253   HG12  VAL  48          HG12      VAL  48  -3.771  23.062  12.108
 1254   HG13  VAL  48          HG13      VAL  48  -5.305  22.429  12.707
 1255   HG21  VAL  48          HG21      VAL  48  -3.754  25.396  11.027
 1256   HG22  VAL  48          HG22      VAL  48  -4.504  26.011  12.498
 1257   HG23  VAL  48          HG23      VAL  48  -5.272  26.289  10.934
 1258    H    PHE  49           H        PHE  49  -5.124  21.301   9.598
 1259    HA   PHE  49           HA       PHE  49  -7.463  20.055  10.814
 1260    HB2  PHE  49           HB3      PHE  49  -8.064  18.880   8.722
 1261    HB3  PHE  49           HB2      PHE  49  -8.243  20.624   8.570
 1262    HD1  PHE  49           HD1      PHE  49  -6.616  21.921   7.220
 1263    HD2  PHE  49           HD2      PHE  49  -6.517  17.666   7.395
 1264    HE1  PHE  49           HE1      PHE  49  -5.212  21.870   5.199
 1265    HE2  PHE  49           HE2      PHE  49  -5.112  17.613   5.378
 1266    HZ   PHE  49           HZ       PHE  49  -4.460  19.715   4.278
 1267    H    ARG  50           H        ARG  50  -7.359  17.660  10.698
 1268    HA   ARG  50           HA       ARG  50  -4.643  16.727  11.149
 1269    HB2  ARG  50           HB3      ARG  50  -7.252  15.184  11.260
 1270    HB3  ARG  50           HB2      ARG  50  -5.695  14.638  11.860
 1271    HG2  ARG  50           HG3      ARG  50  -5.728  16.439  13.528
 1272    HG3  ARG  50           HG2      ARG  50  -7.315  16.937  12.940
 1273    HD2  ARG  50           HD3      ARG  50  -6.613  14.260  14.134
 1274    HD3  ARG  50           HD2      ARG  50  -7.516  15.547  14.931
 1275    HE   ARG  50           HE       ARG  50  -8.717  14.734  12.466
 1276   HH11  ARG  50          HH11      ARG  50  -8.398  13.908  15.852
 1277   HH12  ARG  50          HH12      ARG  50  -9.888  13.021  15.905
 1278   HH21  ARG  50          HH21      ARG  50 -10.666  13.574  12.525
 1279   HH22  ARG  50          HH22      ARG  50 -11.192  12.843  14.013
 1280    H    GLN  51           H        GLN  51  -3.666  15.014   9.930
 1281    HA   GLN  51           HA       GLN  51  -4.785  14.959   7.214
 1282    HB2  GLN  51           HB3      GLN  51  -2.431  14.625   6.425
 1283    HB3  GLN  51           HB2      GLN  51  -2.794  16.196   7.108
 1284    HG2  GLN  51           HG3      GLN  51  -0.688  15.698   7.930
 1285    HG3  GLN  51           HG2      GLN  51  -1.759  15.290   9.267
 1286   HE21  GLN  51          HE21      GLN  51  -1.789  13.250  10.031
 1287   HE22  GLN  51          HE22      GLN  51  -0.818  11.960   9.383
 1288    H    TYR  52           H        TYR  52  -3.871  13.023   9.839
 1289    HA   TYR  52           HA       TYR  52  -4.219  10.823  10.285
 1290    HB2  TYR  52           HB3      TYR  52  -5.714  10.724   7.659
 1291    HB3  TYR  52           HB2      TYR  52  -5.880   9.609   9.011
 1292    HD1  TYR  52           HD1      TYR  52  -6.636  10.722  11.285
 1293    HD2  TYR  52           HD2      TYR  52  -7.201  12.464   7.443
 1294    HE1  TYR  52           HE1      TYR  52  -8.442  12.122  12.187
 1295    HE2  TYR  52           HE2      TYR  52  -9.006  13.868   8.339
 1296    HH   TYR  52           HH       TYR  52 -10.548  13.935  10.164
 1297    H    PHE  53           H        PHE  53  -3.792   8.574   9.622
 1298    HA   PHE  53           HA       PHE  53  -2.199   8.248   7.180
 1299    HB2  PHE  53           HB3      PHE  53  -1.338   7.363   9.942
 1300    HB3  PHE  53           HB2      PHE  53  -0.638   6.717   8.462
 1301    HD1  PHE  53           HD1      PHE  53  -0.048   8.827   6.764
 1302    HD2  PHE  53           HD2      PHE  53   0.002   8.833  11.012
 1303    HE1  PHE  53           HE1      PHE  53   1.590  10.655   6.732
 1304    HE2  PHE  53           HE2      PHE  53   1.636  10.664  10.995
 1305    HZ   PHE  53           HZ       PHE  53   2.433  11.581   8.853
 1306    H    PHE  54           H        PHE  54  -2.044   5.985   6.519
 1307    HA   PHE  54           HA       PHE  54  -4.059   4.258   7.763
 1308    HB2  PHE  54           HB3      PHE  54  -4.441   3.317   5.418
 1309    HB3  PHE  54           HB2      PHE  54  -5.103   4.911   5.742
 1310    HD1  PHE  54           HD1      PHE  54  -2.780   2.976   3.752
 1311    HD2  PHE  54           HD2      PHE  54  -3.999   6.917   4.801
 1312    HE1  PHE  54           HE1      PHE  54  -1.612   3.859   1.779
 1313    HE2  PHE  54           HE2      PHE  54  -2.831   7.809   2.831
 1314    HZ   PHE  54           HZ       PHE  54  -1.638   6.282   1.316
 1315    H    GLU  55           H        GLU  55  -3.064   2.612   8.679
 1316    HA   GLU  55           HA       GLU  55  -0.703   1.487   7.315
 1317    HB2  GLU  55           HB3      GLU  55  -1.156   1.595  10.307
 1318    HB3  GLU  55           HB2      GLU  55   0.244   0.913   9.493
 1319    HG2  GLU  55           HG3      GLU  55   0.651   3.247   8.561
 1320    HG3  GLU  55           HG2      GLU  55  -0.551   3.802   9.730
 1321    H    THR  56           H        THR  56  -0.925  -0.539   6.715
 1322    HA   THR  56           HA       THR  56  -3.059  -2.149   7.925
 1323    HB   THR  56           HB       THR  56  -1.516  -2.653   5.369
 1324    HG1  THR  56           HG1      THR  56  -2.889  -1.237   4.597
 1325   HG21  THR  56          HG21      THR  56  -3.954  -4.027   6.516
 1326   HG22  THR  56          HG22      THR  56  -2.334  -4.716   6.394
 1327   HG23  THR  56          HG23      THR  56  -3.248  -4.344   4.931
 1328    H    LYS  57           H        LYS  57  -2.446  -3.450   9.493
 1329    HA   LYS  57           HA       LYS  57   0.356  -4.319   9.595
 1330    HB2  LYS  57           HB3      LYS  57  -0.598  -2.999  11.506
 1331    HB3  LYS  57           HB2      LYS  57  -1.711  -4.327  11.802
 1332    HG2  LYS  57           HG3      LYS  57   0.160  -5.812  12.263
 1333    HG3  LYS  57           HG2      LYS  57   1.289  -4.501  11.927
 1334    HD2  LYS  57           HD3      LYS  57  -0.788  -4.485  14.104
 1335    HD3  LYS  57           HD2      LYS  57   0.923  -4.836  14.338
 1336    HE2  LYS  57           HE3      LYS  57  -0.263  -2.250  13.347
 1337    HE3  LYS  57           HE2      LYS  57   0.436  -2.539  14.936
 1338    HZ1  LYS  57           HZ1      LYS  57   1.875  -2.579  12.340
 1339    HZ2  LYS  57           HZ2      LYS  57   2.568  -3.001  13.822
 1340    HZ3  LYS  57           HZ3      LYS  57   2.025  -1.421  13.564
 1341    H    CYS  58           H        CYS  58   0.894  -6.444   9.712
 1342    HA   CYS  58           HA       CYS  58  -1.051  -8.363   8.849
 1343    HB2  CYS  58           HB3      CYS  58   1.817  -8.762   9.741
 1344    HB3  CYS  58           HB2      CYS  58   0.824  -9.966   8.933
 1345    H    ARG  59           H        ARG  59  -2.545  -8.995  10.293
 1346    HA   ARG  59           HA       ARG  59  -1.951  -9.362  13.080
 1347    HB2  ARG  59           HB3      ARG  59  -4.357 -10.131  11.417
 1348    HB3  ARG  59           HB2      ARG  59  -4.253 -10.364  13.156
 1349    HG2  ARG  59           HG3      ARG  59  -3.956  -7.919  13.414
 1350    HG3  ARG  59           HG2      ARG  59  -4.207  -7.747  11.677
 1351    HD2  ARG  59           HD3      ARG  59  -6.261  -7.322  12.944
 1352    HD3  ARG  59           HD2      ARG  59  -6.421  -8.704  11.873
 1353    HE   ARG  59           HE       ARG  59  -5.616  -9.545  14.453
 1354   HH11  ARG  59          HH11      ARG  59  -8.392  -8.353  12.691
 1355   HH12  ARG  59          HH12      ARG  59  -9.545  -9.128  13.731
 1356   HH21  ARG  59          HH21      ARG  59  -7.132 -10.582  15.818
 1357   HH22  ARG  59          HH22      ARG  59  -8.827 -10.395  15.508
 1358    H    ALA  60           H        ALA  60  -2.194 -11.315  10.212
 1359    HA   ALA  60           HA       ALA  60  -1.499 -13.742  11.676
 1360    HB1  ALA  60           HB1      ALA  60  -3.153 -13.874   9.853
 1361    HB2  ALA  60           HB2      ALA  60  -1.731 -14.863   9.525
 1362    HB3  ALA  60           HB3      ALA  60  -1.928 -13.309   8.716
 1363    H    SER  61           H        SER  61   0.526 -14.695  11.566
 1364    HA   SER  61           HA       SER  61   2.528 -13.539   9.798
 1365    HB2  SER  61           HB3      SER  61   2.873 -13.550  12.806
 1366    HB3  SER  61           HB2      SER  61   4.107 -13.090  11.632
 1367    HG   SER  61           HG       SER  61   1.764 -11.759  11.234
 1368    H    ASN  62           H        ASN  62   1.111 -16.199  10.668
 1369    HA   ASN  62           HA       ASN  62   3.583 -17.780  10.925
 1370    HB2  ASN  62           HB3      ASN  62   1.812 -18.031  12.730
 1371    HB3  ASN  62           HB2      ASN  62   0.761 -18.719  11.498
 1372   HD21  ASN  62          HD21      ASN  62   1.205 -20.768  10.692
 1373   HD22  ASN  62          HD22      ASN  62   2.309 -21.847  11.463
 1374    HA   PRO  63           HA       PRO  63   3.635 -18.908   6.708
 1375    HB2  PRO  63           HB3      PRO  63   3.626 -21.752   7.295
 1376    HB3  PRO  63           HB2      PRO  63   4.942 -20.746   6.685
 1377    HG2  PRO  63           HG3      PRO  63   4.367 -21.613   9.427
 1378    HG3  PRO  63           HG2      PRO  63   5.878 -20.994   8.742
 1379    HD2  PRO  63           HD3      PRO  63   4.402 -19.562  10.502
 1380    HD3  PRO  63           HD2      PRO  63   5.316 -18.781   9.185
 1381    H    VAL  64           H        VAL  64   1.701 -21.449   8.359
 1382    HA   VAL  64           HA       VAL  64  -0.362 -20.984   6.302
 1383    HB   VAL  64           HB       VAL  64   0.426 -23.648   7.492
 1384   HG11  VAL  64          HG11      VAL  64  -1.144 -24.618   5.918
 1385   HG12  VAL  64          HG12      VAL  64  -1.572 -23.013   5.335
 1386   HG13  VAL  64          HG13      VAL  64  -1.969 -23.482   6.986
 1387   HG21  VAL  64          HG21      VAL  64   1.236 -24.199   5.264
 1388   HG22  VAL  64          HG22      VAL  64   2.080 -22.787   5.904
 1389   HG23  VAL  64          HG23      VAL  64   0.809 -22.584   4.698
 1390    H    GLU  65           H        GLU  65   0.153 -22.491   9.475
 1391    HA   GLU  65           HA       GLU  65  -2.397 -22.971  10.283
 1392    HB2  GLU  65           HB3      GLU  65  -0.425 -23.634  11.552
 1393    HB3  GLU  65           HB2      GLU  65  -0.108 -21.959  11.975
 1394    HG2  GLU  65           HG3      GLU  65  -2.127 -21.874  13.294
 1395    HG3  GLU  65           HG2      GLU  65  -2.544 -23.518  12.805
 1396    H    SER  66           H        SER  66  -0.707 -19.879  10.576
 1397    HA   SER  66           HA       SER  66  -3.307 -18.568  10.761
 1398    HB2  SER  66           HB3      SER  66  -2.360 -18.751  13.084
 1399    HB3  SER  66           HB2      SER  66  -0.968 -17.811  12.544
 1400    HG   SER  66           HG       SER  66  -3.058 -16.430  11.804
 1401    H    GLY  67           H        GLY  67  -2.380 -18.614   8.434
 1402    HA2  GLY  67           HA3      GLY  67  -1.623 -15.967   7.782
 1403    HA3  GLY  67           HA2      GLY  67  -0.230 -17.035   7.652
 1404    H    CYS  68           H        CYS  68   0.093 -17.920   5.726
 1405    HA   CYS  68           HA       CYS  68  -1.902 -17.420   3.688
 1406    HB2  CYS  68           HB3      CYS  68   0.931 -18.467   3.466
 1407    HB3  CYS  68           HB2      CYS  68  -0.107 -18.036   2.106
 1408    H    ARG  69           H        ARG  69  -3.344 -19.034   4.636
 1409    HA   ARG  69           HA       ARG  69  -2.835 -21.808   4.406
 1410    HB2  ARG  69           HB3      ARG  69  -5.404 -20.215   4.502
 1411    HB3  ARG  69           HB2      ARG  69  -5.371 -21.974   4.439
 1412    HG2  ARG  69           HG3      ARG  69  -4.846 -22.160   6.604
 1413    HG3  ARG  69           HG2      ARG  69  -3.679 -20.839   6.537
 1414    HD2  ARG  69           HD3      ARG  69  -6.678 -20.498   6.638
 1415    HD3  ARG  69           HD2      ARG  69  -5.601 -20.375   8.032
 1416    HE   ARG  69           HE       ARG  69  -4.907 -18.628   5.847
 1417   HH11  ARG  69          HH11      ARG  69  -6.803 -18.968   8.763
 1418   HH12  ARG  69          HH12      ARG  69  -6.930 -17.257   9.024
 1419   HH21  ARG  69          HH21      ARG  69  -5.040 -16.381   6.207
 1420   HH22  ARG  69          HH22      ARG  69  -5.908 -15.784   7.601
 1421    H    GLY  70           H        GLY  70  -2.838 -23.097   2.684
 1422    HA2  GLY  70           HA3      GLY  70  -3.985 -23.540   0.478
 1423    HA3  GLY  70           HA2      GLY  70  -3.590 -21.860   0.110
 1424    H    ILE  71           H        ILE  71  -1.009 -21.933   1.411
 1425    HA   ILE  71           HA       ILE  71   0.560 -23.040  -0.721
 1426    HB   ILE  71           HB       ILE  71   1.470 -21.882   1.922
 1427   HG12  ILE  71          HG13      ILE  71   0.174 -20.257   0.624
 1428   HG13  ILE  71          HG12      ILE  71   1.874 -19.810   0.659
 1429   HG21  ILE  71          HG21      ILE  71   3.186 -23.258   0.894
 1430   HG22  ILE  71          HG22      ILE  71   3.627 -21.554   0.790
 1431   HG23  ILE  71          HG23      ILE  71   2.998 -22.390  -0.629
 1432   HD11  ILE  71          HD11      ILE  71   2.141 -20.746  -1.601
 1433   HD12  ILE  71          HD12      ILE  71   0.954 -19.442  -1.540
 1434   HD13  ILE  71          HD13      ILE  71   0.416 -21.119  -1.628
 1435    H    ASP  72           H        ASP  72   1.352 -25.049  -0.837
 1436    HA   ASP  72           HA       ASP  72   1.832 -26.555   1.614
 1437    HB2  ASP  72           HB3      ASP  72  -0.516 -27.040   0.888
 1438    HB3  ASP  72           HB2      ASP  72   0.131 -27.670  -0.626
 1439    H    SER  73           H        SER  73   4.014 -26.354   1.079
 1440    HA   SER  73           HA       SER  73   4.982 -28.353  -0.748
 1441    HB2  SER  73           HB3      SER  73   4.714 -26.472  -2.294
 1442    HB3  SER  73           HB2      SER  73   5.616 -25.421  -1.199
 1443    HG   SER  73           HG       SER  73   6.665 -26.666  -3.133
 1444    H    LYS  74           H        LYS  74   7.159 -28.892  -0.347
 1445    HA   LYS  74           HA       LYS  74   8.154 -27.970   2.238
 1446    HB2  LYS  74           HB3      LYS  74   9.098 -30.220   0.452
 1447    HB3  LYS  74           HB2      LYS  74   9.714 -29.873   2.058
 1448    HG2  LYS  74           HG3      LYS  74   7.468 -30.318   2.985
 1449    HG3  LYS  74           HG2      LYS  74   6.921 -30.754   1.364
 1450    HD2  LYS  74           HD3      LYS  74   9.140 -32.109   2.885
 1451    HD3  LYS  74           HD2      LYS  74   7.501 -32.730   2.700
 1452    HE2  LYS  74           HE3      LYS  74   7.828 -32.804   0.267
 1453    HE3  LYS  74           HE2      LYS  74   9.472 -32.211   0.481
 1454    HZ1  LYS  74           HZ1      LYS  74   9.983 -34.198   1.756
 1455    HZ2  LYS  74           HZ2      LYS  74   9.441 -34.600   0.208
 1456    HZ3  LYS  74           HZ3      LYS  74   8.408 -34.772   1.534
 1457    H    HIS  75           H        HIS  75   8.359 -26.939  -0.797
 1458    HA   HIS  75           HA       HIS  75  11.229 -26.307  -0.724
 1459    HB2  HIS  75           HB3      HIS  75   9.219 -25.961  -2.966
 1460    HB3  HIS  75           HB2      HIS  75  10.938 -25.602  -3.077
 1461    HD1  HIS  75           HD1      HIS  75   8.561 -28.192  -3.790
 1462    HD2  HIS  75           HD2      HIS  75  12.552 -28.083  -2.627
 1463    HE1  HIS  75           HE1      HIS  75   9.494 -30.453  -4.359
 1464    HE2  HIS  75           HE2      HIS  75  11.875 -30.404  -3.539
 1465    H    TRP  76           H        TRP  76   8.316 -25.030   0.195
 1466    HA   TRP  76           HA       TRP  76   9.230 -22.271  -0.238
 1467    HB2  TRP  76           HB3      TRP  76   6.420 -23.373  -0.379
 1468    HB3  TRP  76           HB2      TRP  76   6.772 -21.653  -0.249
 1469    HD1  TRP  76           HD1      TRP  76   6.085 -24.205  -2.759
 1470    HE1  TRP  76           HE1      TRP  76   6.741 -23.396  -5.109
 1471    HE3  TRP  76           HE3      TRP  76   8.961 -20.179  -1.459
 1472    HZ2  TRP  76           HZ2      TRP  76   8.272 -21.329  -6.259
 1473    HZ3  TRP  76           HZ3      TRP  76   9.985 -18.839  -3.249
 1474    HH2  TRP  76           HH2      TRP  76   9.646 -19.406  -5.599
 1475    H    ASN  77           H        ASN  77   9.231 -20.945   1.452
 1476    HA   ASN  77           HA       ASN  77   7.693 -21.719   3.849
 1477    HB2  ASN  77           HB3      ASN  77  10.140 -21.653   4.281
 1478    HB3  ASN  77           HB2      ASN  77  10.182 -19.988   3.720
 1479   HD21  ASN  77          HD21      ASN  77   9.138 -22.134   6.262
 1480   HD22  ASN  77          HD22      ASN  77   8.863 -20.900   7.446
 1481    H    SER  78           H        SER  78   6.254 -20.187   4.625
 1482    HA   SER  78           HA       SER  78   6.004 -17.791   2.943
 1483    HB2  SER  78           HB3      SER  78   4.401 -19.642   2.320
 1484    HB3  SER  78           HB2      SER  78   3.675 -19.459   3.915
 1485    HG   SER  78           HG       SER  78   3.940 -17.336   2.048
 1486    H    TYR  79           H        TYR  79   4.978 -16.010   3.870
 1487    HA   TYR  79           HA       TYR  79   3.833 -15.957   6.422
 1488    HB2  TYR  79           HB3      TYR  79   5.531 -14.696   7.682
 1489    HB3  TYR  79           HB2      TYR  79   6.132 -16.291   7.235
 1490    HD1  TYR  79           HD1      TYR  79   6.540 -12.691   6.802
 1491    HD2  TYR  79           HD2      TYR  79   7.896 -16.525   5.543
 1492    HE1  TYR  79           HE1      TYR  79   8.548 -11.659   5.834
 1493    HE2  TYR  79           HE2      TYR  79   9.907 -15.498   4.569
 1494    HH   TYR  79           HH       TYR  79  10.503 -13.140   3.652
 1495    H    CYS  80           H        CYS  80   3.767 -13.522   7.180
 1496    HA   CYS  80           HA       CYS  80   2.960 -12.048   4.776
 1497    HB2  CYS  80           HB3      CYS  80   2.117 -11.594   7.648
 1498    HB3  CYS  80           HB2      CYS  80   1.398 -10.871   6.207
 1499    H    THR  81           H        THR  81   3.714 -10.023   4.350
 1500    HA   THR  81           HA       THR  81   5.512  -8.786   6.329
 1501    HB   THR  81           HB       THR  81   6.038  -8.951   3.349
 1502    HG1  THR  81           HG1      THR  81   6.454 -10.780   5.099
 1503   HG21  THR  81          HG21      THR  81   7.740  -7.803   5.566
 1504   HG22  THR  81          HG22      THR  81   6.841  -6.860   4.378
 1505   HG23  THR  81          HG23      THR  81   8.171  -7.893   3.858
 1506    H    THR  82           H        THR  82   5.143  -6.639   6.643
 1507    HA   THR  82           HA       THR  82   3.035  -5.385   5.131
 1508    HB   THR  82           HB       THR  82   3.494  -3.430   6.667
 1509    HG1  THR  82           HG1      THR  82   5.289  -3.520   7.749
 1510   HG21  THR  82          HG21      THR  82   2.854  -6.088   7.939
 1511   HG22  THR  82          HG22      THR  82   1.710  -5.020   7.124
 1512   HG23  THR  82          HG23      THR  82   2.482  -4.507   8.624
 1513    H    THR  83           H        THR  83   3.297  -4.089   3.440
 1514    HA   THR  83           HA       THR  83   6.000  -3.366   2.648
 1515    HB   THR  83           HB       THR  83   4.775  -2.494   0.573
 1516    HG1  THR  83           HG1      THR  83   2.667  -3.100   0.326
 1517   HG21  THR  83          HG21      THR  83   4.575  -5.428   1.266
 1518   HG22  THR  83          HG22      THR  83   5.990  -4.614   0.600
 1519   HG23  THR  83          HG23      THR  83   4.518  -4.750  -0.362
 1520    H    HIS  84           H        HIS  84   6.833  -1.381   2.838
 1521    HA   HIS  84           HA       HIS  84   5.061   0.688   3.905
 1522    HB2  HIS  84           HB3      HIS  84   7.141   1.864   4.613
 1523    HB3  HIS  84           HB2      HIS  84   6.944   0.281   5.354
 1524    HD1  HIS  84           HD1      HIS  84   8.844  -1.318   5.127
 1525    HD2  HIS  84           HD2      HIS  84   9.187   1.909   2.521
 1526    HE1  HIS  84           HE1      HIS  84  11.142  -1.499   4.117
 1527    HE2  HIS  84           HE2      HIS  84  11.324   0.455   2.540
 1528    H    THR  85           H        THR  85   4.587   2.460   2.848
 1529    HA   THR  85           HA       THR  85   6.018   3.008   0.327
 1530    HB   THR  85           HB       THR  85   3.612   2.273   0.058
 1531    HG1  THR  85           HG1      THR  85   3.102   4.209  -1.289
 1532   HG21  THR  85          HG21      THR  85   2.697   3.335   2.072
 1533   HG22  THR  85          HG22      THR  85   1.843   3.872   0.625
 1534   HG23  THR  85          HG23      THR  85   3.035   4.926   1.389
 1535    H    PHE  86           H        PHE  86   5.939   5.383  -0.255
 1536    HA   PHE  86           HA       PHE  86   6.423   6.903   2.209
 1537    HB2  PHE  86           HB3      PHE  86   7.455   7.423  -0.596
 1538    HB3  PHE  86           HB2      PHE  86   7.844   8.377   0.836
 1539    HD1  PHE  86           HD1      PHE  86   9.031   7.210   2.755
 1540    HD2  PHE  86           HD2      PHE  86   8.719   5.546  -1.149
 1541    HE1  PHE  86           HE1      PHE  86  10.925   5.712   3.248
 1542    HE2  PHE  86           HE2      PHE  86  10.609   4.048  -0.667
 1543    HZ   PHE  86           HZ       PHE  86  11.712   4.127   1.533
 1544    H    VAL  87           H        VAL  87   4.928   8.286   2.773
 1545    HA   VAL  87           HA       VAL  87   3.122   9.317   0.690
 1546    HB   VAL  87           HB       VAL  87   1.478   9.679   2.523
 1547   HG11  VAL  87          HG11      VAL  87   0.876   7.322   2.799
 1548   HG12  VAL  87          HG12      VAL  87   2.470   6.852   2.207
 1549   HG13  VAL  87          HG13      VAL  87   1.344   7.692   1.139
 1550   HG21  VAL  87          HG21      VAL  87   3.444   8.119   4.196
 1551   HG22  VAL  87          HG22      VAL  87   1.815   8.591   4.679
 1552   HG23  VAL  87          HG23      VAL  87   3.044   9.825   4.396
 1553    H    LYS  88           H        LYS  88   2.572  11.447   0.650
 1554    HA   LYS  88           HA       LYS  88   4.448  13.322   1.711
 1555    HB2  LYS  88           HB3      LYS  88   2.832  15.003   0.647
 1556    HB3  LYS  88           HB2      LYS  88   3.626  13.863  -0.430
 1557    HG2  LYS  88           HG3      LYS  88   1.652  12.588  -0.691
 1558    HG3  LYS  88           HG2      LYS  88   0.862  13.404   0.656
 1559    HD2  LYS  88           HD3      LYS  88   0.750  15.454  -0.579
 1560    HD3  LYS  88           HD2      LYS  88   1.703  14.764  -1.894
 1561    HE2  LYS  88           HE3      LYS  88  -0.968  13.680  -1.024
 1562    HE3  LYS  88           HE2      LYS  88  -0.784  14.888  -2.292
 1563    HZ1  LYS  88           HZ1      LYS  88   0.196  12.092  -2.294
 1564    HZ2  LYS  88           HZ2      LYS  88   0.749  13.240  -3.404
 1565    HZ3  LYS  88           HZ3      LYS  88  -0.891  12.817  -3.371
 1566    H    ALA  89           H        ALA  89   4.402  13.755   3.805
 1567    HA   ALA  89           HA       ALA  89   1.828  14.590   4.978
 1568    HB1  ALA  89           HB1      ALA  89   3.979  13.023   6.404
 1569    HB2  ALA  89           HB2      ALA  89   2.440  12.370   5.837
 1570    HB3  ALA  89           HB3      ALA  89   2.466  13.596   7.105
 1571    H    LEU  90           H        LEU  90   1.874  16.471   6.115
 1572    HA   LEU  90           HA       LEU  90   4.233  18.088   5.967
 1573    HB2  LEU  90           HB3      LEU  90   1.881  18.978   5.813
 1574    HB3  LEU  90           HB2      LEU  90   1.696  18.624   7.524
 1575    HG   LEU  90           HG       LEU  90   3.695  20.172   7.904
 1576   HD11  LEU  90          HD11      LEU  90   4.051  21.870   6.176
 1577   HD12  LEU  90          HD12      LEU  90   2.992  20.973   5.088
 1578   HD13  LEU  90          HD13      LEU  90   4.512  20.259   5.627
 1579   HD21  LEU  90          HD21      LEU  90   1.425  20.799   8.492
 1580   HD22  LEU  90          HD22      LEU  90   1.120  21.314   6.832
 1581   HD23  LEU  90          HD23      LEU  90   2.294  22.179   7.823
 1582    H    THR  91           H        THR  91   5.884  17.557   7.222
 1583    HA   THR  91           HA       THR  91   5.359  16.973  10.060
 1584    HB   THR  91           HB       THR  91   7.281  15.378   9.984
 1585    HG1  THR  91           HG1      THR  91   7.015  15.384   7.168
 1586   HG21  THR  91          HG21      THR  91   4.973  14.539   9.807
 1587   HG22  THR  91          HG22      THR  91   6.094  13.553   8.873
 1588   HG23  THR  91          HG23      THR  91   5.048  14.715   8.056
 1589    H    THR  92           H        THR  92   7.303  17.349  11.441
 1590    HA   THR  92           HA       THR  92   8.861  19.587  10.350
 1591    HB   THR  92           HB       THR  92   7.525  20.404  12.150
 1592    HG1  THR  92           HG1      THR  92   9.278  21.448  12.660
 1593   HG21  THR  92          HG21      THR  92   7.588  19.474  14.410
 1594   HG22  THR  92          HG22      THR  92   8.650  18.182  13.853
 1595   HG23  THR  92          HG23      THR  92   6.997  18.284  13.251
 1596    H    ASP  93           H        ASP  93  10.791  18.979   9.763
 1597    HA   ASP  93           HA       ASP  93  12.128  16.755  11.085
 1598    HB2  ASP  93           HB3      ASP  93  13.744  16.893   9.252
 1599    HB3  ASP  93           HB2      ASP  93  12.103  16.850   8.617
 1600    H    GLU  94           H        GLU  94  11.832  19.876  11.795
 1601    HA   GLU  94           HA       GLU  94  14.237  19.964  13.337
 1602    HB2  GLU  94           HB3      GLU  94  15.130  20.670  11.164
 1603    HB3  GLU  94           HB2      GLU  94  13.915  21.928  11.061
 1604    HG2  GLU  94           HG3      GLU  94  16.027  22.871  11.696
 1605    HG3  GLU  94           HG2      GLU  94  14.886  23.011  13.029
 1606    H    LYS  95           H        LYS  95  12.358  22.630  11.937
 1607    HA   LYS  95           HA       LYS  95  10.846  22.868  14.428
 1608    HB2  LYS  95           HB3      LYS  95  12.459  25.082  13.154
 1609    HB3  LYS  95           HB2      LYS  95  11.160  25.384  14.297
 1610    HG2  LYS  95           HG3      LYS  95  12.355  24.063  15.985
 1611    HG3  LYS  95           HG2      LYS  95  13.669  23.813  14.836
 1612    HD2  LYS  95           HD3      LYS  95  14.035  26.222  14.730
 1613    HD3  LYS  95           HD2      LYS  95  12.723  26.474  15.881
 1614    HE2  LYS  95           HE3      LYS  95  13.940  25.224  17.570
 1615    HE3  LYS  95           HE2      LYS  95  15.232  24.897  16.417
 1616    HZ1  LYS  95           HZ1      LYS  95  15.812  26.722  17.880
 1617    HZ2  LYS  95           HZ2      LYS  95  14.435  27.580  17.411
 1618    HZ3  LYS  95           HZ3      LYS  95  15.661  27.275  16.289
 1619    H    GLN  96           H        GLN  96  11.304  24.433  11.261
 1620    HA   GLN  96           HA       GLN  96   8.579  25.078  10.890
 1621    HB2  GLN  96           HB3      GLN  96  10.892  24.776   8.972
 1622    HB3  GLN  96           HB2      GLN  96   9.281  25.185   8.419
 1623    HG2  GLN  96           HG3      GLN  96  10.484  27.202   8.578
 1624    HG3  GLN  96           HG2      GLN  96   9.359  27.177   9.930
 1625   HE21  GLN  96          HE21      GLN  96  10.145  27.092  12.007
 1626   HE22  GLN  96          HE22      GLN  96  11.818  27.300  12.386
 1627    H    ALA  97           H        ALA  97   7.175  24.136   9.207
 1628    HA   ALA  97           HA       ALA  97   7.391  21.202   9.261
 1629    HB1  ALA  97           HB1      ALA  97   4.983  21.134   9.047
 1630    HB2  ALA  97           HB2      ALA  97   4.921  22.890   8.903
 1631    HB3  ALA  97           HB3      ALA  97   5.436  22.146  10.417
 1632    H    ALA  98           H        ALA  98   7.296  20.039   7.402
 1633    HA   ALA  98           HA       ALA  98   6.738  21.431   4.891
 1634    HB1  ALA  98           HB1      ALA  98   9.139  21.654   5.176
 1635    HB2  ALA  98           HB2      ALA  98   8.789  20.529   3.865
 1636    HB3  ALA  98           HB3      ALA  98   9.291  19.918   5.442
 1637    H    TRP  99           H        TRP  99   6.139  20.047   3.192
 1638    HA   TRP  99           HA       TRP  99   4.942  17.577   4.000
 1639    HB2  TRP  99           HB3      TRP  99   5.245  18.872   1.283
 1640    HB3  TRP  99           HB2      TRP  99   4.368  17.374   1.557
 1641    HD1  TRP  99           HD1      TRP  99   4.055  21.130   1.935
 1642    HE1  TRP  99           HE1      TRP  99   1.654  21.709   2.666
 1643    HE3  TRP  99           HE3      TRP  99   2.353  16.418   2.938
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.654  20.345   3.551
 1645    HZ3  TRP  99           HZ3      TRP  99   0.034  16.143   3.728
 1646    HH2  TRP  99           HH2      TRP  99  -1.434  18.068   4.025
 1647    H    ARG 100           H        ARG 100   6.343  16.049   4.562
 1648    HA   ARG 100           HA       ARG 100   8.620  15.461   2.808
 1649    HB2  ARG 100           HB3      ARG 100   7.984  14.406   5.577
 1650    HB3  ARG 100           HB2      ARG 100   9.462  14.104   4.678
 1651    HG2  ARG 100           HG3      ARG 100   8.543  16.801   5.649
 1652    HG3  ARG 100           HG2      ARG 100   9.743  15.785   6.441
 1653    HD2  ARG 100           HD3      ARG 100  11.127  15.896   4.395
 1654    HD3  ARG 100           HD2      ARG 100   9.943  16.995   3.688
 1655    HE   ARG 100           HE       ARG 100  10.998  17.839   6.238
 1656   HH11  ARG 100          HH11      ARG 100  11.366  17.958   2.764
 1657   HH12  ARG 100          HH12      ARG 100  12.307  19.413   2.784
 1658   HH21  ARG 100          HH21      ARG 100  12.234  19.739   6.292
 1659   HH22  ARG 100          HH22      ARG 100  12.813  20.427   4.799
 1660    H    PHE 101           H        PHE 101   9.098  13.127   2.487
 1661    HA   PHE 101           HA       PHE 101   6.599  11.642   2.046
 1662    HB2  PHE 101           HB3      PHE 101   9.300  11.373   0.690
 1663    HB3  PHE 101           HB2      PHE 101   7.937  10.300   0.405
 1664    HD1  PHE 101           HD1      PHE 101   9.299  13.651  -0.180
 1665    HD2  PHE 101           HD2      PHE 101   5.992  11.039  -0.819
 1666    HE1  PHE 101           HE1      PHE 101   8.436  15.169  -1.908
 1667    HE2  PHE 101           HE2      PHE 101   5.128  12.559  -2.550
 1668    HZ   PHE 101           HZ       PHE 101   6.349  14.626  -3.096
 1669    H    ILE 102           H        ILE 102   6.231  10.338   3.713
 1670    HA   ILE 102           HA       ILE 102   8.564   9.139   5.063
 1671    HB   ILE 102           HB       ILE 102   7.082   9.005   7.084
 1672   HG12  ILE 102          HG13      ILE 102   5.319  10.852   5.466
 1673   HG13  ILE 102          HG12      ILE 102   4.928   9.190   5.892
 1674   HG21  ILE 102          HG21      ILE 102   7.661  11.748   5.974
 1675   HG22  ILE 102          HG22      ILE 102   8.761  10.734   6.910
 1676   HG23  ILE 102          HG23      ILE 102   7.310  11.388   7.664
 1677   HD11  ILE 102          HD11      ILE 102   4.944   9.803   8.253
 1678   HD12  ILE 102          HD12      ILE 102   3.781  10.756   7.333
 1679   HD13  ILE 102          HD13      ILE 102   5.320  11.468   7.813
 1680    H    ARG 103           H        ARG 103   8.487   7.031   5.752
 1681    HA   ARG 103           HA       ARG 103   6.913   5.322   4.049
 1682    HB2  ARG 103           HB3      ARG 103   8.194   3.473   5.124
 1683    HB3  ARG 103           HB2      ARG 103   9.218   4.711   4.412
 1684    HG2  ARG 103           HG3      ARG 103  10.045   5.368   6.412
 1685    HG3  ARG 103           HG2      ARG 103   8.548   5.014   7.274
 1686    HD2  ARG 103           HD3      ARG 103  10.391   2.886   6.205
 1687    HD3  ARG 103           HD2      ARG 103  10.495   3.528   7.844
 1688    HE   ARG 103           HE       ARG 103   7.875   2.747   7.533
 1689   HH11  ARG 103          HH11      ARG 103  11.007   1.211   7.348
 1690   HH12  ARG 103          HH12      ARG 103  10.429  -0.344   7.866
 1691   HH21  ARG 103          HH21      ARG 103   7.085   0.680   8.208
 1692   HH22  ARG 103          HH22      ARG 103   8.206  -0.643   8.343
 1693    H    ILE 104           H        ILE 104   4.944   4.696   4.523
 1694    HA   ILE 104           HA       ILE 104   4.407   3.858   7.298
 1695    HB   ILE 104           HB       ILE 104   2.012   4.226   6.903
 1696   HG12  ILE 104          HG13      ILE 104   2.820   5.548   4.309
 1697   HG13  ILE 104          HG12      ILE 104   2.118   3.939   4.415
 1698   HG21  ILE 104          HG21      ILE 104   2.028   6.673   6.937
 1699   HG22  ILE 104          HG22      ILE 104   3.692   6.666   6.357
 1700   HG23  ILE 104          HG23      ILE 104   3.308   5.996   7.942
 1701   HD11  ILE 104          HD11      ILE 104   0.099   4.891   5.402
 1702   HD12  ILE 104          HD12      ILE 104   0.447   5.579   3.815
 1703   HD13  ILE 104          HD13      ILE 104   0.805   6.501   5.275
 1704    H    ASP 105           H        ASP 105   3.497   1.862   7.590
 1705    HA   ASP 105           HA       ASP 105   3.838  -0.049   5.473
 1706    HB2  ASP 105           HB3      ASP 105   2.704  -0.331   8.276
 1707    HB3  ASP 105           HB2      ASP 105   3.013  -1.679   7.182
 1708    H    THR 106           H        THR 106   2.374   0.075   3.849
 1709    HA   THR 106           HA       THR 106  -0.318   0.990   4.525
 1710    HB   THR 106           HB       THR 106   0.855   2.254   2.793
 1711    HG1  THR 106           HG1      THR 106  -1.531   0.919   2.345
 1712   HG21  THR 106          HG21      THR 106   2.259   0.506   1.848
 1713   HG22  THR 106          HG22      THR 106   1.276   1.238   0.581
 1714   HG23  THR 106          HG23      THR 106   0.837  -0.339   1.239
 1715    H    ALA 107           H        ALA 107   1.278  -1.906   3.557
 1716    HA   ALA 107           HA       ALA 107  -1.310  -3.214   3.309
 1717    HB1  ALA 107           HB1      ALA 107   0.763  -3.384   1.127
 1718    HB2  ALA 107           HB2      ALA 107  -0.785  -2.543   1.023
 1719    HB3  ALA 107           HB3      ALA 107  -0.743  -4.298   1.201
 1720    H    CYS 108           H        CYS 108  -1.146  -5.549   3.301
 1721    HA   CYS 108           HA       CYS 108   1.350  -6.565   4.478
 1722    HB2  CYS 108           HB3      CYS 108  -0.339  -6.446   6.232
 1723    HB3  CYS 108           HB2      CYS 108  -1.505  -7.282   5.207
 1724    H    VAL 109           H        VAL 109   2.268  -7.871   3.054
 1725    HA   VAL 109           HA       VAL 109   0.550  -9.190   1.075
 1726    HB   VAL 109           HB       VAL 109   2.497  -9.319  -0.371
 1727   HG11  VAL 109          HG11      VAL 109   2.901  -6.915  -0.729
 1728   HG12  VAL 109          HG12      VAL 109   2.141  -6.574   0.828
 1729   HG13  VAL 109          HG13      VAL 109   1.194  -7.285  -0.481
 1730   HG21  VAL 109          HG21      VAL 109   4.022  -8.005   1.879
 1731   HG22  VAL 109          HG22      VAL 109   4.642  -8.311   0.256
 1732   HG23  VAL 109          HG23      VAL 109   4.228  -9.662   1.312
 1733    H    CYS 110           H        CYS 110   0.881 -11.333   0.507
 1734    HA   CYS 110           HA       CYS 110   2.152 -13.007   2.536
 1735    HB2  CYS 110           HB3      CYS 110  -0.096 -13.673   1.895
 1736    HB3  CYS 110           HB2      CYS 110   0.344 -13.675   0.194
 1737    H    VAL 111           H        VAL 111   4.162 -13.765   2.215
 1738    HA   VAL 111           HA       VAL 111   5.203 -13.628  -0.543
 1739    HB   VAL 111           HB       VAL 111   7.419 -13.234   0.372
 1740   HG11  VAL 111          HG11      VAL 111   7.069 -11.012   1.355
 1741   HG12  VAL 111          HG12      VAL 111   5.359 -11.387   1.564
 1742   HG13  VAL 111          HG13      VAL 111   6.047 -11.283  -0.057
 1743   HG21  VAL 111          HG21      VAL 111   7.202 -14.526   2.433
 1744   HG22  VAL 111          HG22      VAL 111   6.116 -13.298   3.089
 1745   HG23  VAL 111          HG23      VAL 111   7.800 -12.897   2.751
 1746    H    LEU 112           H        LEU 112   6.736 -15.210  -1.201
 1747    HA   LEU 112           HA       LEU 112   6.817 -17.639   0.466
 1748    HB2  LEU 112           HB3      LEU 112   6.690 -17.417  -2.548
 1749    HB3  LEU 112           HB2      LEU 112   7.082 -18.901  -1.701
 1750    HG   LEU 112           HG       LEU 112   4.456 -17.414  -1.524
 1751   HD11  LEU 112          HD11      LEU 112   4.767 -18.511  -3.674
 1752   HD12  LEU 112          HD12      LEU 112   3.554 -19.355  -2.711
 1753   HD13  LEU 112          HD13      LEU 112   5.181 -20.019  -2.860
 1754   HD21  LEU 112          HD21      LEU 112   3.698 -19.427  -0.309
 1755   HD22  LEU 112          HD22      LEU 112   4.924 -18.513   0.565
 1756   HD23  LEU 112          HD23      LEU 112   5.364 -20.002  -0.272
 1757    H    SER 113           H        SER 113   8.787 -18.507   0.816
 1758    HA   SER 113           HA       SER 113  11.065 -17.322  -0.626
 1759    HB2  SER 113           HB3      SER 113  11.008 -16.518   1.697
 1760    HB3  SER 113           HB2      SER 113  10.949 -18.181   2.281
 1761    HG   SER 113           HG       SER 113  13.089 -16.715   1.667
 1762    H    ARG 114           H        ARG 114  12.658 -18.684  -1.284
 1763    HA   ARG 114           HA       ARG 114  11.940 -21.422  -1.682
 1764    HB2  ARG 114           HB3      ARG 114  13.161 -20.060  -3.359
 1765    HB3  ARG 114           HB2      ARG 114  14.536 -19.977  -2.271
 1766    HG2  ARG 114           HG3      ARG 114  14.976 -21.617  -3.948
 1767    HG3  ARG 114           HG2      ARG 114  14.731 -22.446  -2.411
 1768    HD2  ARG 114           HD3      ARG 114  13.589 -23.639  -4.168
 1769    HD3  ARG 114           HD2      ARG 114  12.405 -22.923  -3.074
 1770    HE   ARG 114           HE       ARG 114  12.748 -21.083  -5.088
 1771   HH11  ARG 114          HH11      ARG 114  11.785 -24.436  -4.908
 1772   HH12  ARG 114          HH12      ARG 114  10.714 -24.337  -6.270
 1773   HH21  ARG 114          HH21      ARG 114  11.377 -20.944  -6.899
 1774   HH22  ARG 114          HH22      ARG 114  10.497 -22.349  -7.422
 1775    H    LYS 115           H        LYS 115  13.312 -19.783   0.852
 1776    HA   LYS 115           HA       LYS 115  14.104 -20.444   2.868
 1777    HB2  LYS 115           HB3      LYS 115  13.971 -23.270   1.791
 1778    HB3  LYS 115           HB2      LYS 115  14.222 -22.828   3.472
 1779    HG2  LYS 115           HG3      LYS 115  11.965 -21.669   3.349
 1780    HG3  LYS 115           HG2      LYS 115  11.750 -22.498   1.803
 1781    HD2  LYS 115           HD3      LYS 115  12.255 -23.815   4.463
 1782    HD3  LYS 115           HD2      LYS 115  10.715 -23.760   3.611
 1783    HE2  LYS 115           HE3      LYS 115  11.638 -25.062   1.795
 1784    HE3  LYS 115           HE2      LYS 115  13.229 -25.032   2.553
 1785    HZ1  LYS 115           HZ1      LYS 115  10.814 -26.284   3.733
 1786    HZ2  LYS 115           HZ2      LYS 115  12.374 -26.317   4.381
 1787    HZ3  LYS 115           HZ3      LYS 115  12.042 -27.123   2.932
 1788    H    ALA 116           H        ALA 116  15.591 -22.327   0.251
 1789    HA   ALA 116           HA       ALA 116  18.176 -22.371   1.466
 1790    HB1  ALA 116           HB1      ALA 116  17.405 -22.866  -1.406
 1791    HB2  ALA 116           HB2      ALA 116  17.440 -24.080  -0.129
 1792    HB3  ALA 116           HB3      ALA 116  18.934 -23.303  -0.646
 1793    H    THR 117           H        THR 117  16.443 -20.074  -0.365
 1794    HA   THR 117           HA       THR 117  18.761 -18.661  -1.353
 1795    HB   THR 117           HB       THR 117  17.017 -16.946  -2.022
 1796    HG1  THR 117           HG1      THR 117  15.295 -17.333  -0.735
 1797   HG21  THR 117          HG21      THR 117  16.656 -19.774  -3.020
 1798   HG22  THR 117          HG22      THR 117  17.844 -18.610  -3.606
 1799   HG23  THR 117          HG23      THR 117  16.124 -18.315  -3.856
 1800    H    ARG 118           H        ARG 118  19.333 -16.522  -0.697
 1801    HA   ARG 118           HA       ARG 118  18.293 -15.726   1.940
 1802    HB2  ARG 118           HB3      ARG 118  21.174 -15.415   1.067
 1803    HB3  ARG 118           HB2      ARG 118  20.505 -15.013   2.636
 1804    HG2  ARG 118           HG3      ARG 118  20.888 -17.755   1.463
 1805    HG3  ARG 118           HG2      ARG 118  21.754 -17.036   2.817
 1806    HD2  ARG 118           HD3      ARG 118  18.845 -17.824   2.724
 1807    HD3  ARG 118           HD2      ARG 118  20.125 -18.595   3.655
 1808    HE   ARG 118           HE       ARG 118  20.260 -16.475   4.932
 1809   HH11  ARG 118          HH11      ARG 118  17.336 -17.212   3.145
 1810   HH12  ARG 118          HH12      ARG 118  16.309 -16.309   4.214
 1811   HH21  ARG 118          HH21      ARG 118  18.908 -15.300   6.345
 1812   HH22  ARG 118          HH22      ARG 118  17.202 -15.227   6.044
  Start of MODEL   15
    1    H1   SER   1           H1       SER   1  26.207  -8.180 -18.622
    2    H2   SER   1           H2       SER   1  26.809  -6.716 -18.028
    3    H3   SER   1           H3       SER   1  25.161  -6.879 -18.366
    4    HA   SER   1           HA       SER   1  26.639  -8.345 -16.279
    5    HB2  SER   1           HB3      SER   1  25.129  -6.964 -14.769
    6    HB3  SER   1           HB2      SER   1  26.406  -6.071 -15.590
    7    HG   SER   1           HG       SER   1  24.861  -4.860 -16.320
    8    H    SER   2           H        SER   2  25.409  -9.832 -15.101
    9    HA   SER   2           HA       SER   2  22.631 -10.249 -15.907
   10    HB2  SER   2           HB3      SER   2  24.738 -12.418 -16.061
   11    HB3  SER   2           HB2      SER   2  23.005 -12.669 -16.274
   12    HG   SER   2           HG       SER   2  23.714 -10.691 -17.881
   13    H    THR   3           H        THR   3  24.237  -9.428 -13.479
   14    HA   THR   3           HA       THR   3  23.658 -11.562 -11.595
   15    HB   THR   3           HB       THR   3  24.500  -9.714  -9.948
   16    HG1  THR   3           HG1      THR   3  24.792  -7.904 -11.041
   17   HG21  THR   3          HG21      THR   3  26.827 -10.359 -10.398
   18   HG22  THR   3          HG22      THR   3  26.338 -11.015 -11.960
   19   HG23  THR   3          HG23      THR   3  25.741 -11.747 -10.471
   20    H    HIS   4           H        HIS   4  21.373 -11.597 -11.790
   21    HA   HIS   4           HA       HIS   4  20.082  -9.335 -10.427
   22    HB2  HIS   4           HB3      HIS   4  18.000  -9.942 -11.771
   23    HB3  HIS   4           HB2      HIS   4  19.296  -9.146 -12.643
   24    HD1  HIS   4           HD1      HIS   4  20.189 -10.311 -14.670
   25    HD2  HIS   4           HD2      HIS   4  17.772 -12.775 -12.365
   26    HE1  HIS   4           HE1      HIS   4  19.868 -12.400 -16.028
   27    HE2  HIS   4           HE2      HIS   4  18.524 -13.932 -14.549
   28    HA   PRO   5           HA       PRO   5  19.068 -12.798  -7.742
   29    HB2  PRO   5           HB3      PRO   5  18.747 -11.383  -5.499
   30    HB3  PRO   5           HB2      PRO   5  20.358 -11.656  -6.177
   31    HG2  PRO   5           HG3      PRO   5  18.618  -9.228  -6.335
   32    HG3  PRO   5           HG2      PRO   5  20.370  -9.331  -6.090
   33    HD2  PRO   5           HD3      PRO   5  19.135  -8.797  -8.513
   34    HD3  PRO   5           HD2      PRO   5  20.784  -9.430  -8.333
   35    H    VAL   6           H        VAL   6  17.099 -12.209  -9.455
   36    HA   VAL   6           HA       VAL   6  14.850 -11.996  -9.786
   37    HB   VAL   6           HB       VAL   6  14.564 -12.605  -6.840
   38   HG11  VAL   6          HG11      VAL   6  12.769 -13.193  -9.186
   39   HG12  VAL   6          HG12      VAL   6  12.510 -11.947  -7.968
   40   HG13  VAL   6          HG13      VAL   6  12.462 -13.650  -7.511
   41   HG21  VAL   6          HG21      VAL   6  14.534 -14.977  -7.439
   42   HG22  VAL   6          HG22      VAL   6  16.086 -14.231  -7.817
   43   HG23  VAL   6          HG23      VAL   6  14.929 -14.558  -9.105
   44    H    PHE   7           H        PHE   7  15.711  -9.676  -9.904
   45    HA   PHE   7           HA       PHE   7  15.665  -7.465  -9.462
   46    HB2  PHE   7           HB3      PHE   7  13.156  -8.180  -7.930
   47    HB3  PHE   7           HB2      PHE   7  13.671  -6.536  -8.281
   48    HD1  PHE   7           HD1      PHE   7  12.027  -9.487  -9.547
   49    HD2  PHE   7           HD2      PHE   7  13.760  -5.758 -10.641
   50    HE1  PHE   7           HE1      PHE   7  10.850  -9.579 -11.702
   51    HE2  PHE   7           HE2      PHE   7  12.587  -5.842 -12.800
   52    HZ   PHE   7           HZ       PHE   7  11.129  -7.750 -13.337
   53    H    HIS   8           H        HIS   8  14.210  -8.238  -6.340
   54    HA   HIS   8           HA       HIS   8  16.833  -8.353  -5.101
   55    HB2  HIS   8           HB3      HIS   8  16.237  -6.725  -3.324
   56    HB3  HIS   8           HB2      HIS   8  16.384  -5.986  -4.909
   57    HD1  HIS   8           HD1      HIS   8  14.555  -4.443  -5.513
   58    HD2  HIS   8           HD2      HIS   8  13.367  -7.188  -2.624
   59    HE1  HIS   8           HE1      HIS   8  12.247  -3.735  -4.811
   60    HE2  HIS   8           HE2      HIS   8  11.507  -5.469  -3.147
   61    H    MET   9           H        MET   9  14.498 -10.040  -5.686
   62    HA   MET   9           HA       MET   9  13.089 -11.557  -4.763
   63    HB2  MET   9           HB3      MET   9  14.236 -13.110  -3.191
   64    HB3  MET   9           HB2      MET   9  15.134 -12.766  -4.654
   65    HG2  MET   9           HG3      MET   9  16.571 -11.238  -3.425
   66    HG3  MET   9           HG2      MET   9  15.645 -11.532  -1.957
   67    HE1  MET   9           HE1      MET   9  17.981 -14.895  -4.091
   68    HE2  MET   9           HE2      MET   9  17.830 -13.267  -4.752
   69    HE3  MET   9           HE3      MET   9  16.406 -14.300  -4.615
   70    H    GLY  10           H        GLY  10  12.246  -9.231  -3.828
   71    HA2  GLY  10           HA3      GLY  10  11.385  -9.976  -1.099
   72    HA3  GLY  10           HA2      GLY  10  11.876  -8.324  -1.449
   73    H    GLU  11           H        GLU  11  10.654  -8.968  -4.225
   74    HA   GLU  11           HA       GLU  11   7.962  -8.093  -3.489
   75    HB2  GLU  11           HB3      GLU  11   7.791  -7.390  -5.880
   76    HB3  GLU  11           HB2      GLU  11   9.071  -6.577  -4.987
   77    HG2  GLU  11           HG3      GLU  11   9.627  -8.982  -6.692
   78    HG3  GLU  11           HG2      GLU  11   9.566  -7.357  -7.370
   79    H    PHE  12           H        PHE  12   8.498 -10.778  -3.094
   80    HA   PHE  12           HA       PHE  12   7.497 -12.295  -5.324
   81    HB2  PHE  12           HB3      PHE  12   8.119 -13.002  -2.464
   82    HB3  PHE  12           HB2      PHE  12   7.301 -14.137  -3.533
   83    HD1  PHE  12           HD1      PHE  12  10.373 -13.304  -2.234
   84    HD2  PHE  12           HD2      PHE  12   8.528 -14.293  -5.938
   85    HE1  PHE  12           HE1      PHE  12  12.537 -14.071  -3.107
   86    HE2  PHE  12           HE2      PHE  12  10.693 -15.060  -6.817
   87    HZ   PHE  12           HZ       PHE  12  12.702 -14.950  -5.399
   88    H    SER  13           H        SER  13   5.622 -10.832  -5.516
   89    HA   SER  13           HA       SER  13   3.480 -11.115  -3.627
   90    HB2  SER  13           HB3      SER  13   3.702  -9.073  -4.993
   91    HB3  SER  13           HB2      SER  13   3.485 -10.020  -6.458
   92    HG   SER  13           HG       SER  13   1.433  -9.798  -6.188
   93    H    VAL  14           H        VAL  14   1.856 -12.565  -3.649
   94    HA   VAL  14           HA       VAL  14   2.103 -14.942  -5.151
   95    HB   VAL  14           HB       VAL  14  -0.069 -15.598  -4.197
   96   HG11  VAL  14          HG11      VAL  14   1.757 -14.265  -2.202
   97   HG12  VAL  14          HG12      VAL  14   1.950 -15.887  -2.866
   98   HG13  VAL  14          HG13      VAL  14   0.566 -15.514  -1.838
   99   HG21  VAL  14          HG21      VAL  14  -1.286 -14.116  -2.696
  100   HG22  VAL  14          HG22      VAL  14  -1.195 -13.422  -4.316
  101   HG23  VAL  14          HG23      VAL  14  -0.146 -12.813  -3.037
  102    H    CYS  15           H        CYS  15   0.518 -11.960  -5.764
  103    HA   CYS  15           HA       CYS  15  -0.579 -13.099  -8.242
  104    HB2  CYS  15           HB3      CYS  15  -2.421 -12.361  -6.855
  105    HB3  CYS  15           HB2      CYS  15  -1.646 -10.796  -6.593
  106    H    ASP  16           H        ASP  16   0.046 -12.193 -10.105
  107    HA   ASP  16           HA       ASP  16   2.268 -10.455 -10.174
  108    HB2  ASP  16           HB3      ASP  16   0.443 -11.645 -12.216
  109    HB3  ASP  16           HB2      ASP  16   1.462 -10.293 -12.698
  110    H    SER  17           H        SER  17   2.295  -8.377  -9.806
  111    HA   SER  17           HA       SER  17   0.085  -6.706 -10.716
  112    HB2  SER  17           HB3      SER  17   0.332  -5.514  -8.406
  113    HB3  SER  17           HB2      SER  17  -0.631  -6.992  -8.513
  114    HG   SER  17           HG       SER  17   1.101  -8.149  -7.687
  115    H    VAL  18           H        VAL  18   0.616  -4.424 -10.747
  116    HA   VAL  18           HA       VAL  18   3.512  -3.930 -10.880
  117    HB   VAL  18           HB       VAL  18   2.715  -4.101 -13.140
  118   HG11  VAL  18          HG11      VAL  18   0.617  -2.075 -12.387
  119   HG12  VAL  18          HG12      VAL  18   0.353  -3.767 -12.811
  120   HG13  VAL  18          HG13      VAL  18   0.946  -2.637 -14.026
  121   HG21  VAL  18          HG21      VAL  18   3.240  -1.862 -14.004
  122   HG22  VAL  18          HG22      VAL  18   4.366  -2.382 -12.751
  123   HG23  VAL  18          HG23      VAL  18   3.100  -1.215 -12.369
  124    H    SER  19           H        SER  19   4.123  -2.406  -9.496
  125    HA   SER  19           HA       SER  19   2.162  -0.526  -8.447
  126    HB2  SER  19           HB3      SER  19   5.053  -0.984  -7.655
  127    HB3  SER  19           HB2      SER  19   3.911   0.062  -6.812
  128    HG   SER  19           HG       SER  19   2.672  -1.749  -6.301
  129    H    VAL  20           H        VAL  20   1.950   1.461  -9.241
  130    HA   VAL  20           HA       VAL  20   4.148   2.533 -10.889
  131    HB   VAL  20           HB       VAL  20   1.177   2.965 -11.227
  132   HG11  VAL  20          HG11      VAL  20   2.412   4.928 -11.894
  133   HG12  VAL  20          HG12      VAL  20   1.776   4.100 -13.316
  134   HG13  VAL  20          HG13      VAL  20   3.482   3.946 -12.896
  135   HG21  VAL  20          HG21      VAL  20   1.419   1.677 -13.294
  136   HG22  VAL  20          HG22      VAL  20   1.838   0.720 -11.873
  137   HG23  VAL  20          HG23      VAL  20   3.112   1.376 -12.901
  138    H    TRP  21           H        TRP  21   4.842   4.552 -10.459
  139    HA   TRP  21           HA       TRP  21   3.415   6.111  -8.425
  140    HB2  TRP  21           HB3      TRP  21   6.220   6.328  -9.540
  141    HB3  TRP  21           HB2      TRP  21   5.513   7.541  -8.482
  142    HD1  TRP  21           HD1      TRP  21   6.888   3.969  -8.449
  143    HE1  TRP  21           HE1      TRP  21   7.303   3.264  -6.007
  144    HE3  TRP  21           HE3      TRP  21   4.730   7.960  -6.071
  145    HZ2  TRP  21           HZ2      TRP  21   6.788   4.272  -3.420
  146    HZ3  TRP  21           HZ3      TRP  21   4.739   8.010  -3.612
  147    HH2  TRP  21           HH2      TRP  21   5.744   6.206  -2.316
  148    H    VAL  22           H        VAL  22   1.791   7.066  -9.529
  149    HA   VAL  22           HA       VAL  22   2.164   8.098 -12.184
  150    HB   VAL  22           HB       VAL  22  -0.196   8.524 -10.349
  151   HG11  VAL  22          HG11      VAL  22  -0.160  10.014 -12.262
  152   HG12  VAL  22          HG12      VAL  22  -1.438   8.812 -12.447
  153   HG13  VAL  22          HG13      VAL  22   0.067   8.643 -13.349
  154   HG21  VAL  22          HG21      VAL  22  -1.214   6.587 -11.460
  155   HG22  VAL  22          HG22      VAL  22   0.234   6.142 -10.558
  156   HG23  VAL  22          HG23      VAL  22   0.299   6.292 -12.315
  157    H    GLY  23           H        GLY  23   3.169   9.954 -12.548
  158    HA2  GLY  23           HA3      GLY  23   3.246  11.996 -10.460
  159    HA3  GLY  23           HA2      GLY  23   4.236  11.959 -11.919
  160    H    ASP  24           H        ASP  24   1.326  11.273 -13.074
  161    HA   ASP  24           HA       ASP  24   0.263  13.987 -13.097
  162    HB2  ASP  24           HB3      ASP  24   1.840  13.868 -15.017
  163    HB3  ASP  24           HB2      ASP  24   0.927  12.504 -15.655
  164    H    LYS  25           H        LYS  25  -1.119  12.467 -11.731
  165    HA   LYS  25           HA       LYS  25  -3.011  10.881 -13.246
  166    HB2  LYS  25           HB3      LYS  25  -2.238  10.349 -10.888
  167    HB3  LYS  25           HB2      LYS  25  -3.161  11.741 -10.350
  168    HG2  LYS  25           HG3      LYS  25  -5.214  10.717 -11.128
  169    HG3  LYS  25           HG2      LYS  25  -4.307   9.331 -11.743
  170    HD2  LYS  25           HD3      LYS  25  -3.516   8.881  -9.444
  171    HD3  LYS  25           HD2      LYS  25  -4.510  10.215  -8.865
  172    HE2  LYS  25           HE3      LYS  25  -5.661   8.118  -8.489
  173    HE3  LYS  25           HE2      LYS  25  -6.515   9.057  -9.715
  174    HZ1  LYS  25           HZ1      LYS  25  -5.537   7.692 -11.424
  175    HZ2  LYS  25           HZ2      LYS  25  -6.317   6.707 -10.298
  176    HZ3  LYS  25           HZ3      LYS  25  -4.626   6.827 -10.285
  177    H    THR  26           H        THR  26  -4.193  12.206 -14.592
  178    HA   THR  26           HA       THR  26  -4.724  14.905 -13.909
  179    HB   THR  26           HB       THR  26  -4.389  14.213 -16.245
  180    HG1  THR  26           HG1      THR  26  -5.837  16.065 -15.492
  181   HG21  THR  26          HG21      THR  26  -7.090  12.893 -15.957
  182   HG22  THR  26          HG22      THR  26  -5.552  12.084 -16.260
  183   HG23  THR  26          HG23      THR  26  -6.245  13.152 -17.481
  184    H    THR  27           H        THR  27  -6.581  11.978 -13.546
  185    HA   THR  27           HA       THR  27  -8.646  13.551 -12.220
  186    HB   THR  27           HB       THR  27 -10.370  11.944 -13.290
  187    HG1  THR  27           HG1      THR  27  -8.094  11.388 -14.723
  188   HG21  THR  27          HG21      THR  27 -10.734  13.502 -15.149
  189   HG22  THR  27          HG22      THR  27  -9.119  14.167 -14.902
  190   HG23  THR  27          HG23      THR  27 -10.351  14.355 -13.654
  191    H    ALA  28           H        ALA  28  -9.691  12.534 -10.570
  192    HA   ALA  28           HA       ALA  28  -9.181   9.689 -10.126
  193    HB1  ALA  28           HB1      ALA  28  -8.577  11.794  -8.055
  194    HB2  ALA  28           HB2      ALA  28  -7.379  10.853  -8.942
  195    HB3  ALA  28           HB3      ALA  28  -8.482  10.048  -7.825
  196    H    THR  29           H        THR  29 -10.516   8.890  -8.259
  197    HA   THR  29           HA       THR  29 -13.154  10.116  -8.441
  198    HB   THR  29           HB       THR  29 -12.452   7.477  -7.155
  199    HG1  THR  29           HG1      THR  29 -12.591   8.205  -9.818
  200   HG21  THR  29          HG21      THR  29 -14.649   8.401  -6.573
  201   HG22  THR  29          HG22      THR  29 -14.810   6.962  -7.583
  202   HG23  THR  29          HG23      THR  29 -15.034   8.564  -8.288
  203    H    ASP  30           H        ASP  30 -13.874  11.357  -6.910
  204    HA   ASP  30           HA       ASP  30 -12.477  11.830  -4.467
  205    HB2  ASP  30           HB3      ASP  30 -13.850  13.504  -5.810
  206    HB3  ASP  30           HB2      ASP  30 -15.289  12.692  -5.196
  207    H    ILE  31           H        ILE  31 -13.368  11.572  -2.334
  208    HA   ILE  31           HA       ILE  31 -14.411   9.004  -1.807
  209    HB   ILE  31           HB       ILE  31 -12.979  10.257  -0.224
  210   HG12  ILE  31          HG13      ILE  31 -15.690   9.580   0.947
  211   HG13  ILE  31          HG12      ILE  31 -14.420   8.413   0.594
  212   HG21  ILE  31          HG21      ILE  31 -15.414  11.994   0.165
  213   HG22  ILE  31          HG22      ILE  31 -13.871  12.482  -0.536
  214   HG23  ILE  31          HG23      ILE  31 -13.963  12.033   1.167
  215   HD11  ILE  31          HD11      ILE  31 -12.969   9.518   2.228
  216   HD12  ILE  31          HD12      ILE  31 -14.474   8.950   2.953
  217   HD13  ILE  31          HD13      ILE  31 -14.261  10.662   2.587
  218    H    LYS  32           H        LYS  32 -15.920  11.980  -2.589
  219    HA   LYS  32           HA       LYS  32 -18.502  11.239  -1.498
  220    HB2  LYS  32           HB3      LYS  32 -17.666  13.545  -3.257
  221    HB3  LYS  32           HB2      LYS  32 -19.259  13.350  -2.536
  222    HG2  LYS  32           HG3      LYS  32 -18.276  13.498  -0.312
  223    HG3  LYS  32           HG2      LYS  32 -16.672  13.656  -1.027
  224    HD2  LYS  32           HD3      LYS  32 -17.356  15.715  -2.117
  225    HD3  LYS  32           HD2      LYS  32 -18.971  15.564  -1.424
  226    HE2  LYS  32           HE3      LYS  32 -16.402  15.856   0.121
  227    HE3  LYS  32           HE2      LYS  32 -17.576  17.138  -0.162
  228    HZ1  LYS  32           HZ1      LYS  32 -19.222  15.794   1.045
  229    HZ2  LYS  32           HZ2      LYS  32 -17.898  16.206   2.013
  230    HZ3  LYS  32           HZ3      LYS  32 -18.030  14.642   1.385
  231    H    GLY  33           H        GLY  33 -16.763  10.334  -4.154
  232    HA2  GLY  33           HA3      GLY  33 -17.522   8.853  -5.813
  233    HA3  GLY  33           HA2      GLY  33 -19.175   9.367  -5.485
  234    H    LYS  34           H        LYS  34 -16.715  11.741  -5.906
  235    HA   LYS  34           HA       LYS  34 -17.957  12.577  -8.422
  236    HB2  LYS  34           HB3      LYS  34 -16.035  14.039  -6.604
  237    HB3  LYS  34           HB2      LYS  34 -16.807  14.716  -8.029
  238    HG2  LYS  34           HG3      LYS  34 -18.257  13.757  -5.574
  239    HG3  LYS  34           HG2      LYS  34 -17.845  15.431  -5.920
  240    HD2  LYS  34           HD3      LYS  34 -19.168  15.285  -8.002
  241    HD3  LYS  34           HD2      LYS  34 -19.657  13.653  -7.539
  242    HE2  LYS  34           HE3      LYS  34 -20.737  14.510  -5.550
  243    HE3  LYS  34           HE2      LYS  34 -20.160  16.134  -5.907
  244    HZ1  LYS  34           HZ1      LYS  34 -22.463  15.857  -6.566
  245    HZ2  LYS  34           HZ2      LYS  34 -22.050  14.561  -7.571
  246    HZ3  LYS  34           HZ3      LYS  34 -21.493  16.116  -7.926
  247    H    GLU  35           H        GLU  35 -16.512  13.435 -10.098
  248    HA   GLU  35           HA       GLU  35 -13.929  12.030 -10.178
  249    HB2  GLU  35           HB3      GLU  35 -15.427  11.458 -12.037
  250    HB3  GLU  35           HB2      GLU  35 -15.600  13.160 -12.433
  251    HG2  GLU  35           HG3      GLU  35 -13.306  13.306 -13.091
  252    HG3  GLU  35           HG2      GLU  35 -12.989  11.673 -12.517
  253    H    VAL  36           H        VAL  36 -12.255  13.277  -9.704
  254    HA   VAL  36           HA       VAL  36 -12.575  16.178 -10.083
  255    HB   VAL  36           HB       VAL  36 -10.988  16.439  -8.160
  256   HG11  VAL  36          HG11      VAL  36 -13.596  15.025  -7.627
  257   HG12  VAL  36          HG12      VAL  36 -13.361  16.762  -7.830
  258   HG13  VAL  36          HG13      VAL  36 -12.676  15.936  -6.430
  259   HG21  VAL  36          HG21      VAL  36 -11.533  13.498  -7.783
  260   HG22  VAL  36          HG22      VAL  36 -10.702  14.545  -6.635
  261   HG23  VAL  36          HG23      VAL  36  -9.984  14.219  -8.212
  262    H    THR  37           H        THR  37 -10.845  17.391 -10.745
  263    HA   THR  37           HA       THR  37  -8.871  15.973 -12.319
  264    HB   THR  37           HB       THR  37  -9.280  18.952 -12.031
  265    HG1  THR  37           HG1      THR  37 -10.257  18.288 -14.302
  266   HG21  THR  37          HG21      THR  37  -8.146  19.068 -14.195
  267   HG22  THR  37          HG22      THR  37  -7.941  17.316 -14.187
  268   HG23  THR  37          HG23      THR  37  -7.117  18.306 -12.981
  269    H    VAL  38           H        VAL  38  -7.061  15.353 -11.340
  270    HA   VAL  38           HA       VAL  38  -6.181  16.683  -8.914
  271    HB   VAL  38           HB       VAL  38  -4.968  14.280 -10.284
  272   HG11  VAL  38          HG11      VAL  38  -4.044  13.810  -8.050
  273   HG12  VAL  38          HG12      VAL  38  -4.698  15.343  -7.478
  274   HG13  VAL  38          HG13      VAL  38  -3.452  15.326  -8.726
  275   HG21  VAL  38          HG21      VAL  38  -7.298  13.830  -9.729
  276   HG22  VAL  38          HG22      VAL  38  -7.015  14.359  -8.071
  277   HG23  VAL  38          HG23      VAL  38  -6.213  12.915  -8.684
  278    H    LEU  39           H        LEU  39  -4.434  17.976  -8.756
  279    HA   LEU  39           HA       LEU  39  -3.270  18.891 -11.250
  280    HB2  LEU  39           HB3      LEU  39  -2.909  19.889  -8.422
  281    HB3  LEU  39           HB2      LEU  39  -2.310  20.686  -9.866
  282    HG   LEU  39           HG       LEU  39  -5.226  20.227  -9.241
  283   HD11  LEU  39          HD11      LEU  39  -3.544  22.715  -9.023
  284   HD12  LEU  39          HD12      LEU  39  -4.250  21.808  -7.687
  285   HD13  LEU  39          HD13      LEU  39  -5.296  22.643  -8.835
  286   HD21  LEU  39          HD21      LEU  39  -3.860  21.792 -11.422
  287   HD22  LEU  39          HD22      LEU  39  -5.591  21.805 -11.092
  288   HD23  LEU  39          HD23      LEU  39  -4.805  20.317 -11.620
  289    H    ALA  40           H        ALA  40  -2.443  16.852  -8.655
  290    HA   ALA  40           HA       ALA  40  -0.660  15.517  -8.216
  291    HB1  ALA  40           HB1      ALA  40   1.119  15.216  -9.828
  292    HB2  ALA  40           HB2      ALA  40   0.589  16.647 -10.715
  293    HB3  ALA  40           HB3      ALA  40  -0.447  15.221 -10.642
  294    H    GLU  41           H        GLU  41  -0.079  18.852  -8.978
  295    HA   GLU  41           HA       GLU  41   2.121  18.964  -7.033
  296    HB2  GLU  41           HB3      GLU  41   1.178  21.043  -9.024
  297    HB3  GLU  41           HB2      GLU  41   2.592  21.172  -7.993
  298    HG2  GLU  41           HG3      GLU  41   3.632  19.319  -9.154
  299    HG3  GLU  41           HG2      GLU  41   2.201  19.130 -10.164
  300    H    VAL  42           H        VAL  42   2.021  20.672  -5.410
  301    HA   VAL  42           HA       VAL  42  -0.751  21.466  -4.867
  302    HB   VAL  42           HB       VAL  42  -0.310  21.377  -2.476
  303   HG11  VAL  42          HG11      VAL  42  -0.094  18.944  -2.233
  304   HG12  VAL  42          HG12      VAL  42   0.441  18.840  -3.911
  305   HG13  VAL  42          HG13      VAL  42  -1.191  19.393  -3.538
  306   HG21  VAL  42          HG21      VAL  42   1.736  20.400  -1.577
  307   HG22  VAL  42          HG22      VAL  42   2.076  21.883  -2.471
  308   HG23  VAL  42          HG23      VAL  42   2.415  20.314  -3.202
  309    H    ASN  43           H        ASN  43  -1.075  23.518  -5.104
  310    HA   ASN  43           HA       ASN  43   1.119  25.420  -4.773
  311    HB2  ASN  43           HB3      ASN  43  -1.675  25.754  -5.912
  312    HB3  ASN  43           HB2      ASN  43  -0.505  27.062  -5.761
  313   HD21  ASN  43          HD21      ASN  43  -1.404  24.205  -7.508
  314   HD22  ASN  43          HD22      ASN  43  -0.266  24.391  -8.792
  315    H    ILE  44           H        ILE  44   1.352  25.794  -2.629
  316    HA   ILE  44           HA       ILE  44  -1.043  26.200  -1.008
  317    HB   ILE  44           HB       ILE  44   1.855  26.110  -0.149
  318   HG12  ILE  44          HG13      ILE  44  -0.311  24.007   0.112
  319   HG13  ILE  44          HG12      ILE  44   0.991  23.964  -1.075
  320   HG21  ILE  44          HG21      ILE  44  -0.682  26.074   1.479
  321   HG22  ILE  44          HG22      ILE  44   0.474  27.404   1.380
  322   HG23  ILE  44          HG23      ILE  44   0.950  25.874   2.117
  323   HD11  ILE  44          HD11      ILE  44   1.318  23.870   1.918
  324   HD12  ILE  44          HD12      ILE  44   2.628  23.835   0.736
  325   HD13  ILE  44          HD13      ILE  44   1.467  22.508   0.806
  326    H    ASN  45           H        ASN  45   2.038  27.865  -0.567
  327    HA   ASN  45           HA       ASN  45   0.678  30.413  -1.141
  328    HB2  ASN  45           HB3      ASN  45   2.679  29.851   1.067
  329    HB3  ASN  45           HB2      ASN  45   2.111  31.453   0.626
  330   HD21  ASN  45          HD21      ASN  45  -0.636  30.669   0.171
  331   HD22  ASN  45          HD22      ASN  45  -1.320  30.343   1.729
  332    H    ASN  46           H        ASN  46   3.971  29.305  -0.421
  333    HA   ASN  46           HA       ASN  46   4.824  30.333  -3.034
  334    HB2  ASN  46           HB3      ASN  46   6.202  30.843  -0.386
  335    HB3  ASN  46           HB2      ASN  46   6.916  31.188  -1.955
  336   HD21  ASN  46          HD21      ASN  46   6.090  32.886  -3.192
  337   HD22  ASN  46          HD22      ASN  46   5.092  34.118  -2.503
  338    H    SER  47           H        SER  47   4.246  27.738  -2.679
  339    HA   SER  47           HA       SER  47   6.758  26.428  -3.069
  340    HB2  SER  47           HB3      SER  47   6.564  26.516  -0.557
  341    HB3  SER  47           HB2      SER  47   5.091  25.556  -0.691
  342    HG   SER  47           HG       SER  47   7.503  24.669  -1.855
  343    H    VAL  48           H        VAL  48   6.421  24.954  -4.588
  344    HA   VAL  48           HA       VAL  48   3.772  23.680  -4.785
  345    HB   VAL  48           HB       VAL  48   5.499  24.478  -7.135
  346   HG11  VAL  48          HG11      VAL  48   2.683  23.415  -7.012
  347   HG12  VAL  48          HG12      VAL  48   4.110  22.534  -7.560
  348   HG13  VAL  48          HG13      VAL  48   3.529  23.927  -8.473
  349   HG21  VAL  48          HG21      VAL  48   3.827  26.203  -7.597
  350   HG22  VAL  48          HG22      VAL  48   4.623  26.468  -6.047
  351   HG23  VAL  48          HG23      VAL  48   2.995  25.795  -6.097
  352    H    PHE  49           H        PHE  49   4.348  21.725  -3.899
  353    HA   PHE  49           HA       PHE  49   6.514  20.283  -5.264
  354    HB2  PHE  49           HB3      PHE  49   6.744  18.980  -3.078
  355    HB3  PHE  49           HB2      PHE  49   7.349  20.630  -3.095
  356    HD1  PHE  49           HD1      PHE  49   6.010  22.432  -1.985
  357    HD2  PHE  49           HD2      PHE  49   5.044  18.304  -1.594
  358    HE1  PHE  49           HE1      PHE  49   4.668  22.937   0.013
  359    HE2  PHE  49           HE2      PHE  49   3.694  18.812   0.401
  360    HZ   PHE  49           HZ       PHE  49   3.507  21.126   1.204
  361    H    ARG  50           H        ARG  50   6.238  18.187  -5.806
  362    HA   ARG  50           HA       ARG  50   3.493  17.370  -6.227
  363    HB2  ARG  50           HB3      ARG  50   6.142  16.212  -7.119
  364    HB3  ARG  50           HB2      ARG  50   4.588  15.505  -7.532
  365    HG2  ARG  50           HG3      ARG  50   3.956  17.523  -8.702
  366    HG3  ARG  50           HG2      ARG  50   5.483  18.283  -8.257
  367    HD2  ARG  50           HD3      ARG  50   5.208  15.781  -9.913
  368    HD3  ARG  50           HD2      ARG  50   5.458  17.398 -10.567
  369    HE   ARG  50           HE       ARG  50   7.456  16.588  -8.654
  370   HH11  ARG  50          HH11      ARG  50   6.492  16.554 -12.017
  371   HH12  ARG  50          HH12      ARG  50   8.105  16.314 -12.610
  372   HH21  ARG  50          HH21      ARG  50   9.589  16.267  -9.437
  373   HH22  ARG  50          HH22      ARG  50   9.861  16.149 -11.146
  374    H    GLN  51           H        GLN  51   3.769  14.622  -6.304
  375    HA   GLN  51           HA       GLN  51   4.538  13.705  -3.664
  376    HB2  GLN  51           HB3      GLN  51   2.352  14.425  -3.103
  377    HB3  GLN  51           HB2      GLN  51   1.679  13.844  -4.617
  378    HG2  GLN  51           HG3      GLN  51   0.994  12.440  -2.761
  379    HG3  GLN  51           HG2      GLN  51   2.003  11.541  -3.891
  380   HE21  GLN  51          HE21      GLN  51   2.670  10.016  -2.444
  381   HE22  GLN  51          HE22      GLN  51   3.719  10.360  -1.106
  382    H    TYR  52           H        TYR  52   2.929  12.960  -6.724
  383    HA   TYR  52           HA       TYR  52   2.967  11.174  -8.111
  384    HB2  TYR  52           HB3      TYR  52   5.314  10.358  -6.394
  385    HB3  TYR  52           HB2      TYR  52   4.699   9.334  -7.685
  386    HD1  TYR  52           HD1      TYR  52   6.092  12.726  -7.024
  387    HD2  TYR  52           HD2      TYR  52   5.378   9.660  -9.888
  388    HE1  TYR  52           HE1      TYR  52   7.465  13.938  -8.661
  389    HE2  TYR  52           HE2      TYR  52   6.750  10.867 -11.529
  390    HH   TYR  52           HH       TYR  52   7.505  13.163 -11.963
  391    H    PHE  53           H        PHE  53   1.456   9.691  -8.165
  392    HA   PHE  53           HA       PHE  53   0.451   8.740  -5.592
  393    HB2  PHE  53           HB3      PHE  53  -0.880   8.721  -8.313
  394    HB3  PHE  53           HB2      PHE  53  -1.648   8.310  -6.778
  395    HD1  PHE  53           HD1      PHE  53  -1.827  10.089  -5.010
  396    HD2  PHE  53           HD2      PHE  53  -0.746  10.946  -9.031
  397    HE1  PHE  53           HE1      PHE  53  -2.382  12.455  -4.646
  398    HE2  PHE  53           HE2      PHE  53  -1.302  13.316  -8.680
  399    HZ   PHE  53           HZ       PHE  53  -2.114  14.072  -6.483
  400    H    PHE  54           H        PHE  54   0.909   6.806  -4.949
  401    HA   PHE  54           HA       PHE  54   2.066   4.877  -6.750
  402    HB2  PHE  54           HB3      PHE  54   2.285   3.533  -4.573
  403    HB3  PHE  54           HB2      PHE  54   3.195   5.033  -4.680
  404    HD1  PHE  54           HD1      PHE  54   0.680   3.193  -2.875
  405    HD2  PHE  54           HD2      PHE  54   2.321   7.072  -3.502
  406    HE1  PHE  54           HE1      PHE  54  -0.346   3.966  -0.779
  407    HE2  PHE  54           HE2      PHE  54   1.293   7.848  -1.409
  408    HZ   PHE  54           HZ       PHE  54  -0.043   6.296  -0.044
  409    H    GLU  55           H        GLU  55   0.726   3.760  -7.969
  410    HA   GLU  55           HA       GLU  55  -1.642   2.559  -6.686
  411    HB2  GLU  55           HB3      GLU  55  -1.349   3.370  -9.593
  412    HB3  GLU  55           HB2      GLU  55  -2.761   2.607  -8.876
  413    HG2  GLU  55           HG3      GLU  55  -2.950   4.621  -7.371
  414    HG3  GLU  55           HG2      GLU  55  -1.700   5.377  -8.364
  415    H    THR  56           H        THR  56  -1.342   0.472  -6.404
  416    HA   THR  56           HA       THR  56   0.335  -1.022  -8.278
  417    HB   THR  56           HB       THR  56  -0.926  -1.960  -5.692
  418    HG1  THR  56           HG1      THR  56   0.693  -0.940  -4.799
  419   HG21  THR  56          HG21      THR  56  -0.468  -3.799  -7.232
  420   HG22  THR  56          HG22      THR  56   0.667  -3.833  -5.881
  421   HG23  THR  56          HG23      THR  56   1.184  -3.221  -7.452
  422    H    LYS  57           H        LYS  57  -0.595  -1.931  -9.956
  423    HA   LYS  57           HA       LYS  57  -3.482  -2.492  -9.829
  424    HB2  LYS  57           HB3      LYS  57  -2.714  -0.797 -11.482
  425    HB3  LYS  57           HB2      LYS  57  -1.715  -2.026 -12.243
  426    HG2  LYS  57           HG3      LYS  57  -3.695  -3.301 -12.833
  427    HG3  LYS  57           HG2      LYS  57  -4.715  -2.111 -12.025
  428    HD2  LYS  57           HD3      LYS  57  -2.895  -1.521 -14.345
  429    HD3  LYS  57           HD2      LYS  57  -4.626  -1.814 -14.479
  430    HE2  LYS  57           HE3      LYS  57  -3.332   0.409 -12.913
  431    HE3  LYS  57           HE2      LYS  57  -4.111   0.575 -14.481
  432    HZ1  LYS  57           HZ1      LYS  57  -6.193  -0.160 -13.459
  433    HZ2  LYS  57           HZ2      LYS  57  -5.605   1.256 -12.744
  434    HZ3  LYS  57           HZ3      LYS  57  -5.432  -0.226 -11.948
  435    H    CYS  58           H        CYS  58  -4.255  -4.486 -10.363
  436    HA   CYS  58           HA       CYS  58  -2.439  -6.696 -10.382
  437    HB2  CYS  58           HB3      CYS  58  -5.394  -6.701 -11.054
  438    HB3  CYS  58           HB2      CYS  58  -4.426  -8.086 -10.565
  439    H    ARG  59           H        ARG  59  -1.202  -7.045 -12.140
  440    HA   ARG  59           HA       ARG  59  -2.170  -6.318 -14.773
  441    HB2  ARG  59           HB3      ARG  59   0.048  -6.852 -15.574
  442    HB3  ARG  59           HB2      ARG  59   0.184  -5.879 -14.120
  443    HG2  ARG  59           HG3      ARG  59   0.634  -7.911 -12.821
  444    HG3  ARG  59           HG2      ARG  59   0.548  -8.859 -14.303
  445    HD2  ARG  59           HD3      ARG  59   2.435  -7.580 -15.218
  446    HD3  ARG  59           HD2      ARG  59   2.514  -6.644 -13.726
  447    HE   ARG  59           HE       ARG  59   2.830  -9.559 -13.607
  448   HH11  ARG  59          HH11      ARG  59   4.260  -6.374 -13.343
  449   HH12  ARG  59          HH12      ARG  59   5.650  -6.932 -12.471
  450   HH21  ARG  59          HH21      ARG  59   4.654 -10.306 -12.482
  451   HH22  ARG  59          HH22      ARG  59   5.892  -9.178 -12.000
  452    H    ALA  60           H        ALA  60  -2.614  -8.850 -12.806
  453    HA   ALA  60           HA       ALA  60  -3.657 -10.470 -14.950
  454    HB1  ALA  60           HB1      ALA  60  -1.350 -11.311 -14.786
  455    HB2  ALA  60           HB2      ALA  60  -2.513 -12.524 -14.249
  456    HB3  ALA  60           HB3      ALA  60  -1.584 -11.607 -13.063
  457    H    SER  61           H        SER  61  -5.512 -11.429 -14.282
  458    HA   SER  61           HA       SER  61  -6.342 -11.056 -11.536
  459    HB2  SER  61           HB3      SER  61  -8.480 -12.131 -12.392
  460    HB3  SER  61           HB2      SER  61  -8.019 -10.624 -13.183
  461    HG   SER  61           HG       SER  61  -8.645 -12.314 -14.652
  462    H    ASN  62           H        ASN  62  -5.304 -13.598 -13.652
  463    HA   ASN  62           HA       ASN  62  -4.924 -15.350 -11.346
  464    HB2  ASN  62           HB3      ASN  62  -6.358 -16.106 -13.896
  465    HB3  ASN  62           HB2      ASN  62  -5.565 -17.312 -12.891
  466   HD21  ASN  62          HD21      ASN  62  -6.233 -16.050 -10.381
  467   HD22  ASN  62          HD22      ASN  62  -7.926 -16.299 -10.137
  468    HA   PRO  63           HA       PRO  63  -1.058 -14.687 -13.802
  469    HB2  PRO  63           HB3      PRO  63   0.485 -15.687 -11.690
  470    HB3  PRO  63           HB2      PRO  63   0.166 -13.980 -12.025
  471    HG2  PRO  63           HG3      PRO  63  -1.136 -15.820 -10.083
  472    HG3  PRO  63           HG2      PRO  63  -0.794 -14.090  -9.936
  473    HD2  PRO  63           HD3      PRO  63  -3.282 -14.993 -10.419
  474    HD3  PRO  63           HD2      PRO  63  -2.686 -13.479 -11.149
  475    H    VAL  64           H        VAL  64  -2.048 -17.474 -11.877
  476    HA   VAL  64           HA       VAL  64  -0.767 -19.211 -13.882
  477    HB   VAL  64           HB       VAL  64  -0.645 -20.976 -12.162
  478   HG11  VAL  64          HG11      VAL  64   0.696 -18.404 -11.340
  479   HG12  VAL  64          HG12      VAL  64   1.299 -19.561 -12.526
  480   HG13  VAL  64          HG13      VAL  64   1.173 -20.022 -10.828
  481   HG21  VAL  64          HG21      VAL  64  -1.609 -18.830 -10.281
  482   HG22  VAL  64          HG22      VAL  64  -0.985 -20.406  -9.796
  483   HG23  VAL  64          HG23      VAL  64  -2.475 -20.299 -10.733
  484    H    GLU  65           H        GLU  65  -1.955 -21.202 -14.360
  485    HA   GLU  65           HA       GLU  65  -4.744 -20.580 -14.695
  486    HB2  GLU  65           HB3      GLU  65  -3.243 -21.653 -16.438
  487    HB3  GLU  65           HB2      GLU  65  -3.347 -23.128 -15.490
  488    HG2  GLU  65           HG3      GLU  65  -5.779 -23.116 -15.764
  489    HG3  GLU  65           HG2      GLU  65  -5.649 -21.662 -16.750
  490    H    SER  66           H        SER  66  -4.861 -20.613 -12.260
  491    HA   SER  66           HA       SER  66  -6.423 -22.752 -11.365
  492    HB2  SER  66           HB3      SER  66  -4.849 -23.611  -9.567
  493    HB3  SER  66           HB2      SER  66  -4.424 -24.086 -11.213
  494    HG   SER  66           HG       SER  66  -2.679 -22.878 -11.136
  495    H    GLY  67           H        GLY  67  -4.551 -19.914 -10.859
  496    HA2  GLY  67           HA3      GLY  67  -6.279 -18.368  -9.542
  497    HA3  GLY  67           HA2      GLY  67  -5.645 -19.363  -8.232
  498    H    CYS  68           H        CYS  68  -3.977 -18.525  -7.184
  499    HA   CYS  68           HA       CYS  68  -2.234 -16.637  -8.621
  500    HB2  CYS  68           HB3      CYS  68  -2.810 -16.848  -5.653
  501    HB3  CYS  68           HB2      CYS  68  -1.649 -15.728  -6.375
  502    H    ARG  69           H        ARG  69   0.043 -16.581  -7.466
  503    HA   ARG  69           HA       ARG  69   1.222 -19.071  -8.139
  504    HB2  ARG  69           HB3      ARG  69   2.458 -16.763  -6.615
  505    HB3  ARG  69           HB2      ARG  69   3.338 -18.080  -7.376
  506    HG2  ARG  69           HG3      ARG  69   2.469 -17.283  -9.583
  507    HG3  ARG  69           HG2      ARG  69   1.781 -15.890  -8.737
  508    HD2  ARG  69           HD3      ARG  69   4.068 -15.390  -7.857
  509    HD3  ARG  69           HD2      ARG  69   4.695 -16.663  -8.906
  510    HE   ARG  69           HE       ARG  69   3.176 -14.687 -10.335
  511   HH11  ARG  69          HH11      ARG  69   6.311 -15.476  -9.004
  512   HH12  ARG  69          HH12      ARG  69   7.173 -14.378 -10.025
  513   HH21  ARG  69          HH21      ARG  69   4.300 -13.225 -11.690
  514   HH22  ARG  69          HH22      ARG  69   6.030 -13.096 -11.561
  515    H    GLY  70           H        GLY  70   1.296 -20.857  -6.929
  516    HA2  GLY  70           HA3      GLY  70   2.118 -22.102  -5.127
  517    HA3  GLY  70           HA2      GLY  70   2.238 -20.621  -4.193
  518    H    ILE  71           H        ILE  71  -0.789 -20.584  -5.461
  519    HA   ILE  71           HA       ILE  71  -1.977 -21.325  -2.949
  520    HB   ILE  71           HB       ILE  71  -3.313 -20.539  -5.544
  521   HG12  ILE  71          HG13      ILE  71  -1.861 -18.756  -4.723
  522   HG13  ILE  71          HG12      ILE  71  -3.551 -18.317  -4.500
  523   HG21  ILE  71          HG21      ILE  71  -4.402 -20.668  -2.736
  524   HG22  ILE  71          HG22      ILE  71  -4.824 -21.737  -4.072
  525   HG23  ILE  71          HG23      ILE  71  -5.258 -20.030  -4.139
  526   HD11  ILE  71          HD11      ILE  71  -2.258 -17.666  -2.574
  527   HD12  ILE  71          HD12      ILE  71  -1.667 -19.315  -2.378
  528   HD13  ILE  71          HD13      ILE  71  -3.376 -18.958  -2.130
  529    H    ASP  72           H        ASP  72  -3.101 -23.092  -2.455
  530    HA   ASP  72           HA       ASP  72  -2.675 -25.527  -3.688
  531    HB2  ASP  72           HB3      ASP  72  -3.363 -25.414  -1.387
  532    HB3  ASP  72           HB2      ASP  72  -4.892 -24.661  -1.831
  533    H    SER  73           H        SER  73  -5.382 -23.327  -4.094
  534    HA   SER  73           HA       SER  73  -6.752 -22.968  -5.862
  535    HB2  SER  73           HB3      SER  73  -4.900 -23.654  -7.343
  536    HB3  SER  73           HB2      SER  73  -5.401 -25.337  -7.176
  537    HG   SER  73           HG       SER  73  -6.847 -23.201  -8.369
  538    H    LYS  74           H        LYS  74  -6.429 -26.334  -4.819
  539    HA   LYS  74           HA       LYS  74  -9.046 -27.081  -5.715
  540    HB2  LYS  74           HB3      LYS  74  -7.250 -28.433  -3.695
  541    HB3  LYS  74           HB2      LYS  74  -8.655 -29.151  -4.458
  542    HG2  LYS  74           HG3      LYS  74  -7.511 -28.917  -6.655
  543    HG3  LYS  74           HG2      LYS  74  -6.076 -28.362  -5.787
  544    HD2  LYS  74           HD3      LYS  74  -7.432 -31.034  -5.481
  545    HD3  LYS  74           HD2      LYS  74  -5.890 -30.731  -6.274
  546    HE2  LYS  74           HE3      LYS  74  -4.966 -29.948  -4.141
  547    HE3  LYS  74           HE2      LYS  74  -6.510 -30.277  -3.362
  548    HZ1  LYS  74           HZ1      LYS  74  -5.002 -32.075  -2.964
  549    HZ2  LYS  74           HZ2      LYS  74  -4.715 -32.275  -4.616
  550    HZ3  LYS  74           HZ3      LYS  74  -6.241 -32.622  -3.974
  551    H    HIS  75           H        HIS  75  -7.614 -26.148  -2.634
  552    HA   HIS  75           HA       HIS  75 -10.229 -26.230  -1.336
  553    HB2  HIS  75           HB3      HIS  75  -7.436 -25.712  -0.314
  554    HB3  HIS  75           HB2      HIS  75  -8.863 -25.507   0.694
  555    HD1  HIS  75           HD1      HIS  75  -9.698 -27.535   1.865
  556    HD2  HIS  75           HD2      HIS  75  -7.126 -28.474  -1.263
  557    HE1  HIS  75           HE1      HIS  75  -9.317 -30.015   2.026
  558    HE2  HIS  75           HE2      HIS  75  -7.610 -30.521   0.240
  559    H    TRP  76           H        TRP  76  -8.318 -24.014  -3.017
  560    HA   TRP  76           HA       TRP  76  -9.903 -21.773  -2.001
  561    HB2  TRP  76           HB3      TRP  76  -6.881 -21.741  -2.222
  562    HB3  TRP  76           HB2      TRP  76  -7.887 -20.344  -1.858
  563    HD1  TRP  76           HD1      TRP  76  -5.971 -23.037  -0.226
  564    HE1  TRP  76           HE1      TRP  76  -6.452 -23.089   2.300
  565    HE3  TRP  76           HE3      TRP  76 -10.077 -19.995  -0.113
  566    HZ2  TRP  76           HZ2      TRP  76  -8.319 -21.987   4.101
  567    HZ3  TRP  76           HZ3      TRP  76 -11.154 -19.547   2.052
  568    HH2  TRP  76           HH2      TRP  76 -10.292 -20.525   4.116
  569    H    ASN  77           H        ASN  77 -10.893 -21.006  -3.835
  570    HA   ASN  77           HA       ASN  77  -9.372 -20.894  -6.314
  571    HB2  ASN  77           HB3      ASN  77 -11.801 -21.394  -6.408
  572    HB3  ASN  77           HB2      ASN  77 -12.140 -19.830  -5.681
  573   HD21  ASN  77          HD21      ASN  77 -11.010 -21.473  -8.543
  574   HD22  ASN  77          HD22      ASN  77 -11.215 -20.134  -9.623
  575    H    SER  78           H        SER  78  -8.534 -19.015  -7.185
  576    HA   SER  78           HA       SER  78  -8.203 -16.888  -5.185
  577    HB2  SER  78           HB3      SER  78  -6.266 -17.520  -7.401
  578    HB3  SER  78           HB2      SER  78  -5.973 -16.621  -5.914
  579    HG   SER  78           HG       SER  78  -6.596 -18.757  -4.897
  580    H    TYR  79           H        TYR  79  -8.351 -14.777  -5.753
  581    HA   TYR  79           HA       TYR  79  -8.499 -14.028  -8.556
  582    HB2  TYR  79           HB3      TYR  79 -10.849 -14.412  -8.024
  583    HB3  TYR  79           HB2      TYR  79 -10.715 -13.409  -6.579
  584    HD1  TYR  79           HD1      TYR  79 -11.364 -11.181  -6.712
  585    HD2  TYR  79           HD2      TYR  79 -10.239 -13.205 -10.282
  586    HE1  TYR  79           HE1      TYR  79 -11.997  -9.204  -8.024
  587    HE2  TYR  79           HE2      TYR  79 -10.870 -11.231 -11.603
  588    HH   TYR  79           HH       TYR  79 -12.318  -9.274 -11.413
  589    H    CYS  80           H        CYS  80  -7.579 -12.075  -8.909
  590    HA   CYS  80           HA       CYS  80  -6.333 -10.802  -6.620
  591    HB2  CYS  80           HB3      CYS  80  -6.035 -10.260  -9.583
  592    HB3  CYS  80           HB2      CYS  80  -5.047  -9.546  -8.305
  593    H    THR  81           H        THR  81  -6.940  -8.958  -5.728
  594    HA   THR  81           HA       THR  81  -8.679  -7.122  -7.220
  595    HB   THR  81           HB       THR  81  -9.187  -8.019  -4.367
  596    HG1  THR  81           HG1      THR  81  -9.949  -9.058  -6.728
  597   HG21  THR  81          HG21      THR  81 -10.774  -6.157  -6.143
  598   HG22  THR  81          HG22      THR  81  -9.802  -5.673  -4.754
  599   HG23  THR  81          HG23      THR  81 -11.230  -6.682  -4.521
  600    H    THR  82           H        THR  82  -8.093  -5.005  -6.944
  601    HA   THR  82           HA       THR  82  -5.762  -4.472  -5.351
  602    HB   THR  82           HB       THR  82  -6.064  -2.118  -6.219
  603    HG1  THR  82           HG1      THR  82  -7.893  -1.676  -7.139
  604   HG21  THR  82          HG21      THR  82  -4.546  -3.674  -7.302
  605   HG22  THR  82          HG22      THR  82  -5.372  -2.691  -8.510
  606   HG23  THR  82          HG23      THR  82  -5.880  -4.355  -8.232
  607    H    THR  83           H        THR  83  -5.702  -3.649  -3.369
  608    HA   THR  83           HA       THR  83  -8.177  -2.800  -2.113
  609    HB   THR  83           HB       THR  83  -6.738  -4.198  -0.752
  610    HG1  THR  83           HG1      THR  83  -6.577  -2.815   1.066
  611   HG21  THR  83          HG21      THR  83  -4.571  -3.754  -1.695
  612   HG22  THR  83          HG22      THR  83  -4.526  -3.371   0.026
  613   HG23  THR  83          HG23      THR  83  -4.637  -2.073  -1.165
  614    H    HIS  84           H        HIS  84  -8.549  -0.701  -1.344
  615    HA   HIS  84           HA       HIS  84  -6.869   1.303  -2.690
  616    HB2  HIS  84           HB3      HIS  84  -9.057   2.552  -3.151
  617    HB3  HIS  84           HB2      HIS  84  -8.740   1.121  -4.127
  618    HD1  HIS  84           HD1      HIS  84 -10.982   2.395  -1.394
  619    HD2  HIS  84           HD2      HIS  84 -10.530  -0.984  -3.773
  620    HE1  HIS  84           HE1      HIS  84 -13.072   1.047  -1.059
  621    HE2  HIS  84           HE2      HIS  84 -12.680  -1.080  -2.341
  622    H    THR  85           H        THR  85  -6.685   3.297  -1.760
  623    HA   THR  85           HA       THR  85  -7.900   3.636   0.903
  624    HB   THR  85           HB       THR  85  -5.455   2.976   1.022
  625    HG1  THR  85           HG1      THR  85  -5.417   4.144   2.793
  626   HG21  THR  85          HG21      THR  85  -3.792   4.693   0.456
  627   HG22  THR  85          HG22      THR  85  -5.068   5.700  -0.227
  628   HG23  THR  85          HG23      THR  85  -4.674   4.152  -0.973
  629    H    PHE  86           H        PHE  86  -7.526   6.075   1.576
  630    HA   PHE  86           HA       PHE  86  -8.169   7.721  -0.781
  631    HB2  PHE  86           HB3      PHE  86  -9.367   7.772   1.989
  632    HB3  PHE  86           HB2      PHE  86  -9.483   9.155   0.900
  633    HD1  PHE  86           HD1      PHE  86 -10.805   5.919   1.754
  634    HD2  PHE  86           HD2      PHE  86 -10.622   8.874  -1.300
  635    HE1  PHE  86           HE1      PHE  86 -12.774   4.918   0.676
  636    HE2  PHE  86           HE2      PHE  86 -12.590   7.881  -2.386
  637    HZ   PHE  86           HZ       PHE  86 -13.671   5.902  -1.402
  638    H    VAL  87           H        VAL  87  -6.673   9.152  -1.207
  639    HA   VAL  87           HA       VAL  87  -5.097  10.276   1.020
  640    HB   VAL  87           HB       VAL  87  -3.327  10.749  -0.682
  641   HG11  VAL  87          HG11      VAL  87  -3.117   8.810   0.747
  642   HG12  VAL  87          HG12      VAL  87  -2.534   8.423  -0.872
  643   HG13  VAL  87          HG13      VAL  87  -4.120   7.861  -0.349
  644   HG21  VAL  87          HG21      VAL  87  -4.722  10.730  -2.689
  645   HG22  VAL  87          HG22      VAL  87  -5.021   9.004  -2.470
  646   HG23  VAL  87          HG23      VAL  87  -3.393   9.579  -2.829
  647    H    LYS  88           H        LYS  88  -4.921  12.499   1.162
  648    HA   LYS  88           HA       LYS  88  -6.819  13.974  -0.458
  649    HB2  LYS  88           HB3      LYS  88  -6.418  15.840   1.091
  650    HB3  LYS  88           HB2      LYS  88  -6.871  14.368   1.933
  651    HG2  LYS  88           HG3      LYS  88  -4.478  14.000   2.464
  652    HG3  LYS  88           HG2      LYS  88  -4.117  15.555   1.719
  653    HD2  LYS  88           HD3      LYS  88  -5.650  16.635   3.303
  654    HD3  LYS  88           HD2      LYS  88  -5.920  15.078   4.082
  655    HE2  LYS  88           HE3      LYS  88  -3.490  14.959   4.557
  656    HE3  LYS  88           HE2      LYS  88  -3.316  16.578   3.881
  657    HZ1  LYS  88           HZ1      LYS  88  -5.070  15.913   6.183
  658    HZ2  LYS  88           HZ2      LYS  88  -4.714  17.458   5.588
  659    HZ3  LYS  88           HZ3      LYS  88  -3.504  16.542   6.327
  660    H    ALA  89           H        ALA  89  -6.278  14.878  -2.253
  661    HA   ALA  89           HA       ALA  89  -3.538  15.918  -2.591
  662    HB1  ALA  89           HB1      ALA  89  -3.567  15.173  -4.911
  663    HB2  ALA  89           HB2      ALA  89  -5.186  14.505  -4.693
  664    HB3  ALA  89           HB3      ALA  89  -3.819  13.803  -3.828
  665    H    LEU  90           H        LEU  90  -3.362  17.727  -4.026
  666    HA   LEU  90           HA       LEU  90  -5.593  19.493  -3.807
  667    HB2  LEU  90           HB3      LEU  90  -3.163  20.191  -3.705
  668    HB3  LEU  90           HB2      LEU  90  -3.094  19.932  -5.444
  669    HG   LEU  90           HG       LEU  90  -4.962  21.619  -5.670
  670   HD11  LEU  90          HD11      LEU  90  -5.288  23.163  -3.792
  671   HD12  LEU  90          HD12      LEU  90  -4.281  22.128  -2.779
  672   HD13  LEU  90          HD13      LEU  90  -5.816  21.527  -3.406
  673   HD21  LEU  90          HD21      LEU  90  -2.606  22.162  -6.115
  674   HD22  LEU  90          HD22      LEU  90  -2.405  22.611  -4.420
  675   HD23  LEU  90          HD23      LEU  90  -3.494  23.536  -5.453
  676    H    THR  91           H        THR  91  -7.270  19.369  -5.052
  677    HA   THR  91           HA       THR  91  -6.940  18.604  -7.877
  678    HB   THR  91           HB       THR  91  -9.330  17.902  -7.775
  679    HG1  THR  91           HG1      THR  91  -8.969  18.682  -5.077
  680   HG21  THR  91          HG21      THR  91  -7.581  16.227  -7.509
  681   HG22  THR  91          HG22      THR  91  -8.958  15.841  -6.480
  682   HG23  THR  91          HG23      THR  91  -7.506  16.554  -5.779
  683    H    THR  92           H        THR  92  -8.470  19.673  -9.379
  684    HA   THR  92           HA       THR  92  -9.094  22.360  -8.381
  685    HB   THR  92           HB       THR  92  -7.367  22.421 -10.102
  686    HG1  THR  92           HG1      THR  92  -9.293  23.974  -9.951
  687   HG21  THR  92          HG21      THR  92  -7.893  21.829 -12.430
  688   HG22  THR  92          HG22      THR  92  -9.439  21.165 -11.901
  689   HG23  THR  92          HG23      THR  92  -7.932  20.423 -11.367
  690    H    ASP  93           H        ASP  93 -11.095  22.906  -8.215
  691    HA   ASP  93           HA       ASP  93 -13.143  21.460  -9.752
  692    HB2  ASP  93           HB3      ASP  93 -13.403  21.371  -7.286
  693    HB3  ASP  93           HB2      ASP  93 -13.441  23.130  -7.236
  694    H    GLU  94           H        GLU  94 -13.270  22.534 -11.608
  695    HA   GLU  94           HA       GLU  94 -13.733  24.137 -13.128
  696    HB2  GLU  94           HB3      GLU  94 -14.723  25.690 -10.733
  697    HB3  GLU  94           HB2      GLU  94 -14.924  26.208 -12.402
  698    HG2  GLU  94           HG3      GLU  94 -16.065  23.731 -11.134
  699    HG3  GLU  94           HG2      GLU  94 -16.945  25.186 -11.583
  700    H    LYS  95           H        LYS  95 -12.903  26.384 -10.518
  701    HA   LYS  95           HA       LYS  95 -10.351  26.915 -11.883
  702    HB2  LYS  95           HB3      LYS  95 -12.246  28.954 -10.698
  703    HB3  LYS  95           HB2      LYS  95 -10.626  29.315 -11.271
  704    HG2  LYS  95           HG3      LYS  95 -11.255  28.683 -13.529
  705    HG3  LYS  95           HG2      LYS  95 -12.869  28.241 -12.968
  706    HD2  LYS  95           HD3      LYS  95 -13.237  30.556 -12.250
  707    HD3  LYS  95           HD2      LYS  95 -11.642  30.994 -12.862
  708    HE2  LYS  95           HE3      LYS  95 -12.330  30.361 -15.113
  709    HE3  LYS  95           HE2      LYS  95 -13.911  29.878 -14.499
  710    HZ1  LYS  95           HZ1      LYS  95 -13.963  32.087 -15.490
  711    HZ2  LYS  95           HZ2      LYS  95 -12.794  32.628 -14.396
  712    HZ3  LYS  95           HZ3      LYS  95 -14.320  32.161 -13.838
  713    H    GLN  96           H        GLN  96 -11.944  26.086  -9.035
  714    HA   GLN  96           HA       GLN  96 -10.068  27.356  -7.226
  715    HB2  GLN  96           HB3      GLN  96 -12.433  25.526  -6.785
  716    HB3  GLN  96           HB2      GLN  96 -11.376  26.033  -5.480
  717    HG2  GLN  96           HG3      GLN  96 -13.288  27.420  -5.429
  718    HG3  GLN  96           HG2      GLN  96 -11.949  28.395  -6.027
  719   HE21  GLN  96          HE21      GLN  96 -11.999  29.161  -8.112
  720   HE22  GLN  96          HE22      GLN  96 -13.409  29.073  -9.110
  721    H    ALA  97           H        ALA  97  -8.779  26.159  -5.722
  722    HA   ALA  97           HA       ALA  97  -8.133  23.418  -6.589
  723    HB1  ALA  97           HB1      ALA  97  -6.328  24.959  -7.202
  724    HB2  ALA  97           HB2      ALA  97  -5.808  23.816  -5.963
  725    HB3  ALA  97           HB3      ALA  97  -6.199  25.477  -5.520
  726    H    ALA  98           H        ALA  98  -8.641  21.977  -5.061
  727    HA   ALA  98           HA       ALA  98  -8.436  22.781  -2.240
  728    HB1  ALA  98           HB1      ALA  98 -10.818  21.392  -3.467
  729    HB2  ALA  98           HB2      ALA  98 -10.768  23.066  -2.914
  730    HB3  ALA  98           HB3      ALA  98 -10.598  21.749  -1.754
  731    H    TRP  99           H        TRP  99  -7.929  21.166  -0.812
  732    HA   TRP  99           HA       TRP  99  -6.659  18.825  -1.899
  733    HB2  TRP  99           HB3      TRP  99  -7.166  19.660   0.970
  734    HB3  TRP  99           HB2      TRP  99  -6.164  18.304   0.480
  735    HD1  TRP  99           HD1      TRP  99  -6.245  22.153  -0.008
  736    HE1  TRP  99           HE1      TRP  99  -3.813  22.990  -0.103
  737    HE3  TRP  99           HE3      TRP  99  -3.835  17.658   0.272
  738    HZ2  TRP  99           HZ2      TRP  99  -1.215  21.888  -0.050
  739    HZ3  TRP  99           HZ3      TRP  99  -1.373  17.635   0.251
  740    HH2  TRP  99           HH2      TRP  99  -0.093  19.708   0.092
  741    H    ARG 100           H        ARG 100  -8.009  17.296  -2.677
  742    HA   ARG 100           HA       ARG 100 -10.339  16.574  -1.031
  743    HB2  ARG 100           HB3      ARG 100  -9.859  16.330  -4.001
  744    HB3  ARG 100           HB2      ARG 100 -11.200  15.538  -3.185
  745    HG2  ARG 100           HG3      ARG 100 -10.697  18.508  -3.313
  746    HG3  ARG 100           HG2      ARG 100 -11.915  17.608  -4.220
  747    HD2  ARG 100           HD3      ARG 100 -11.788  18.053  -1.242
  748    HD3  ARG 100           HD2      ARG 100 -13.023  18.615  -2.366
  749    HE   ARG 100           HE       ARG 100 -13.250  15.993  -2.700
  750   HH11  ARG 100          HH11      ARG 100 -12.936  17.832   0.277
  751   HH12  ARG 100          HH12      ARG 100 -13.834  16.683   1.218
  752   HH21  ARG 100          HH21      ARG 100 -14.423  14.502  -1.477
  753   HH22  ARG 100          HH22      ARG 100 -14.668  14.787   0.227
  754    H    PHE 101           H        PHE 101 -10.796  14.456  -0.599
  755    HA   PHE 101           HA       PHE 101  -8.501  12.694  -0.547
  756    HB2  PHE 101           HB3      PHE 101 -11.308  12.407   0.560
  757    HB3  PHE 101           HB2      PHE 101 -10.070  11.171   0.719
  758    HD1  PHE 101           HD1      PHE 101 -10.800  14.731   1.550
  759    HD2  PHE 101           HD2      PHE 101  -8.570  11.223   2.479
  760    HE1  PHE 101           HE1      PHE 101  -9.976  15.800   3.604
  761    HE2  PHE 101           HE2      PHE 101  -7.741  12.290   4.532
  762    HZ   PHE 101           HZ       PHE 101  -8.444  14.581   5.097
  763    H    ILE 102           H        ILE 102  -8.050  11.517  -2.251
  764    HA   ILE 102           HA       ILE 102 -10.260  10.475  -3.897
  765    HB   ILE 102           HB       ILE 102  -8.622  10.369  -5.764
  766   HG12  ILE 102          HG13      ILE 102  -6.845  11.987  -3.929
  767   HG13  ILE 102          HG12      ILE 102  -6.574  10.301  -4.349
  768   HG21  ILE 102          HG21      ILE 102  -8.590  12.793  -6.209
  769   HG22  ILE 102          HG22      ILE 102  -9.051  13.085  -4.532
  770   HG23  ILE 102          HG23      ILE 102 -10.153  12.231  -5.614
  771   HD11  ILE 102          HD11      ILE 102  -6.550  12.639  -6.245
  772   HD12  ILE 102          HD12      ILE 102  -6.324  10.950  -6.699
  773   HD13  ILE 102          HD13      ILE 102  -5.148  11.747  -5.651
  774    H    ARG 103           H        ARG 103 -10.091   8.355  -4.690
  775    HA   ARG 103           HA       ARG 103  -8.698   6.620  -2.827
  776    HB2  ARG 103           HB3      ARG 103 -10.012   4.806  -3.783
  777    HB3  ARG 103           HB2      ARG 103 -11.060   6.162  -3.387
  778    HG2  ARG 103           HG3      ARG 103 -11.143   6.814  -5.718
  779    HG3  ARG 103           HG2      ARG 103 -10.025   5.520  -6.140
  780    HD2  ARG 103           HD3      ARG 103 -11.684   3.876  -5.291
  781    HD3  ARG 103           HD2      ARG 103 -12.811   5.209  -5.023
  782    HE   ARG 103           HE       ARG 103 -11.779   5.059  -7.709
  783   HH11  ARG 103          HH11      ARG 103 -14.258   3.922  -5.520
  784   HH12  ARG 103          HH12      ARG 103 -15.398   3.585  -6.782
  785   HH21  ARG 103          HH21      ARG 103 -13.262   4.604  -9.377
  786   HH22  ARG 103          HH22      ARG 103 -14.832   3.977  -8.985
  787    H    ILE 104           H        ILE 104  -6.944   5.459  -3.238
  788    HA   ILE 104           HA       ILE 104  -6.163   5.012  -6.039
  789    HB   ILE 104           HB       ILE 104  -3.771   5.209  -5.382
  790   HG12  ILE 104          HG13      ILE 104  -4.842   6.441  -2.839
  791   HG13  ILE 104          HG12      ILE 104  -4.136   4.835  -2.947
  792   HG21  ILE 104          HG21      ILE 104  -4.864   7.066  -6.495
  793   HG22  ILE 104          HG22      ILE 104  -3.696   7.658  -5.315
  794   HG23  ILE 104          HG23      ILE 104  -5.419   7.692  -4.942
  795   HD11  ILE 104          HD11      ILE 104  -2.552   6.462  -2.082
  796   HD12  ILE 104          HD12      ILE 104  -2.719   7.414  -3.556
  797   HD13  ILE 104          HD13      ILE 104  -2.013   5.800  -3.626
  798    H    ASP 105           H        ASP 105  -4.989   3.075  -6.408
  799    HA   ASP 105           HA       ASP 105  -5.676   0.966  -4.527
  800    HB2  ASP 105           HB3      ASP 105  -4.369   0.812  -7.263
  801    HB3  ASP 105           HB2      ASP 105  -4.896  -0.571  -6.307
  802    H    THR 106           H        THR 106  -4.293   0.242  -3.048
  803    HA   THR 106           HA       THR 106  -1.564   1.259  -3.134
  804    HB   THR 106           HB       THR 106  -1.479   0.281  -0.778
  805    HG1  THR 106           HG1      THR 106  -3.919   0.197  -0.092
  806   HG21  THR 106          HG21      THR 106  -2.783   2.123   0.180
  807   HG22  THR 106          HG22      THR 106  -3.563   2.383  -1.380
  808   HG23  THR 106          HG23      THR 106  -1.833   2.665  -1.204
  809    H    ALA 107           H        ALA 107  -3.278  -1.826  -3.069
  810    HA   ALA 107           HA       ALA 107  -0.902  -3.169  -4.033
  811    HB1  ALA 107           HB1      ALA 107  -0.578  -3.239  -1.615
  812    HB2  ALA 107           HB2      ALA 107  -0.885  -4.851  -2.262
  813    HB3  ALA 107           HB3      ALA 107  -2.166  -3.981  -1.419
  814    H    CYS 108           H        CYS 108  -1.323  -5.324  -4.766
  815    HA   CYS 108           HA       CYS 108  -4.152  -5.788  -5.394
  816    HB2  CYS 108           HB3      CYS 108  -2.719  -5.591  -7.368
  817    HB3  CYS 108           HB2      CYS 108  -1.641  -6.835  -6.732
  818    H    VAL 109           H        VAL 109  -5.089  -7.171  -4.054
  819    HA   VAL 109           HA       VAL 109  -3.410  -9.139  -2.677
  820    HB   VAL 109           HB       VAL 109  -5.178  -9.364  -1.049
  821   HG11  VAL 109          HG11      VAL 109  -3.661  -7.509  -0.713
  822   HG12  VAL 109          HG12      VAL 109  -5.279  -7.079  -0.157
  823   HG13  VAL 109          HG13      VAL 109  -4.684  -6.464  -1.699
  824   HG21  VAL 109          HG21      VAL 109  -6.800  -7.484  -2.765
  825   HG22  VAL 109          HG22      VAL 109  -7.264  -8.088  -1.175
  826   HG23  VAL 109          HG23      VAL 109  -7.111  -9.205  -2.532
  827    H    CYS 110           H        CYS 110  -4.091 -11.327  -2.518
  828    HA   CYS 110           HA       CYS 110  -5.800 -12.169  -4.755
  829    HB2  CYS 110           HB3      CYS 110  -3.488 -13.018  -4.867
  830    HB3  CYS 110           HB2      CYS 110  -3.671 -13.737  -3.274
  831    H    VAL 111           H        VAL 111  -7.816 -12.411  -4.004
  832    HA   VAL 111           HA       VAL 111  -8.287 -13.243  -1.284
  833    HB   VAL 111           HB       VAL 111 -10.668 -13.086  -1.796
  834   HG11  VAL 111          HG11      VAL 111  -9.088 -10.777  -2.917
  835   HG12  VAL 111          HG12      VAL 111  -9.520 -11.032  -1.225
  836   HG13  VAL 111          HG13      VAL 111 -10.778 -10.711  -2.418
  837   HG21  VAL 111          HG21      VAL 111 -11.482 -12.446  -3.995
  838   HG22  VAL 111          HG22      VAL 111 -10.631 -13.991  -4.067
  839   HG23  VAL 111          HG23      VAL 111  -9.842 -12.519  -4.637
  840    H    LEU 112           H        LEU 112  -8.881 -15.233  -0.571
  841    HA   LEU 112           HA       LEU 112  -8.829 -17.374  -2.590
  842    HB2  LEU 112           HB3      LEU 112  -8.050 -17.455   0.331
  843    HB3  LEU 112           HB2      LEU 112  -8.037 -18.835  -0.747
  844    HG   LEU 112           HG       LEU 112  -6.258 -16.400  -0.910
  845   HD11  LEU 112          HD11      LEU 112  -4.476 -18.049  -0.520
  846   HD12  LEU 112          HD12      LEU 112  -5.699 -19.298  -0.304
  847   HD13  LEU 112          HD13      LEU 112  -5.611 -17.946   0.825
  848   HD21  LEU 112          HD21      LEU 112  -5.152 -17.604  -2.769
  849   HD22  LEU 112          HD22      LEU 112  -6.789 -17.078  -3.154
  850   HD23  LEU 112          HD23      LEU 112  -6.474 -18.769  -2.762
  851    H    SER 113           H        SER 113 -10.482 -18.740  -2.727
  852    HA   SER 113           HA       SER 113 -11.990 -19.702  -0.573
  853    HB2  SER 113           HB3      SER 113 -14.219 -18.678  -1.166
  854    HB3  SER 113           HB2      SER 113 -13.074 -17.550  -0.439
  855    HG   SER 113           HG       SER 113 -12.544 -17.178  -2.839
  856    H    ARG 114           H        ARG 114 -12.111 -21.748  -1.404
  857    HA   ARG 114           HA       ARG 114 -13.262 -22.015  -4.101
  858    HB2  ARG 114           HB3      ARG 114 -11.246 -23.437  -3.045
  859    HB3  ARG 114           HB2      ARG 114 -12.587 -24.417  -2.469
  860    HG2  ARG 114           HG3      ARG 114 -12.207 -23.674  -5.360
  861    HG3  ARG 114           HG2      ARG 114 -11.555 -25.145  -4.638
  862    HD2  ARG 114           HD3      ARG 114 -14.474 -24.389  -4.655
  863    HD3  ARG 114           HD2      ARG 114 -13.716 -25.468  -5.823
  864    HE   ARG 114           HE       ARG 114 -13.065 -26.617  -3.483
  865   HH11  ARG 114          HH11      ARG 114 -16.118 -25.460  -4.743
  866   HH12  ARG 114          HH12      ARG 114 -17.061 -26.642  -3.899
  867   HH21  ARG 114          HH21      ARG 114 -14.299 -28.187  -2.387
  868   HH22  ARG 114          HH22      ARG 114 -16.028 -28.196  -2.559
  869    H    LYS 115           H        LYS 115 -13.822 -22.469  -0.736
  870    HA   LYS 115           HA       LYS 115 -16.616 -23.234  -1.249
  871    HB2  LYS 115           HB3      LYS 115 -14.880 -23.928   1.140
  872    HB3  LYS 115           HB2      LYS 115 -16.557 -24.396   0.930
  873    HG2  LYS 115           HG3      LYS 115 -15.940 -25.739  -1.020
  874    HG3  LYS 115           HG2      LYS 115 -14.250 -25.278  -0.787
  875    HD2  LYS 115           HD3      LYS 115 -15.945 -26.780   1.201
  876    HD3  LYS 115           HD2      LYS 115 -14.732 -27.496   0.140
  877    HE2  LYS 115           HE3      LYS 115 -13.017 -26.073   1.204
  878    HE3  LYS 115           HE2      LYS 115 -14.249 -25.456   2.303
  879    HZ1  LYS 115           HZ1      LYS 115 -13.401 -28.291   2.085
  880    HZ2  LYS 115           HZ2      LYS 115 -14.566 -27.693   3.152
  881    HZ3  LYS 115           HZ3      LYS 115 -12.951 -27.226   3.316
  882    H    ALA 116           H        ALA 116 -18.172 -22.265   0.116
  883    HA   ALA 116           HA       ALA 116 -17.565 -19.563   0.826
  884    HB1  ALA 116           HB1      ALA 116 -20.086 -21.144   1.328
  885    HB2  ALA 116           HB2      ALA 116 -19.732 -20.214  -0.128
  886    HB3  ALA 116           HB3      ALA 116 -19.914 -19.391   1.421
  887    H    THR 117           H        THR 117 -17.404 -22.518   2.468
  888    HA   THR 117           HA       THR 117 -17.497 -21.233   5.091
  889    HB   THR 117           HB       THR 117 -17.144 -23.648   5.891
  890    HG1  THR 117           HG1      THR 117 -18.141 -24.321   3.321
  891   HG21  THR 117          HG21      THR 117 -19.661 -22.935   4.381
  892   HG22  THR 117          HG22      THR 117 -19.295 -22.508   6.052
  893   HG23  THR 117          HG23      THR 117 -19.522 -24.198   5.604
  894    H    ARG 118           H        ARG 118 -15.715 -21.139   6.438
  895    HA   ARG 118           HA       ARG 118 -13.187 -22.216   5.575
  896    HB2  ARG 118           HB3      ARG 118 -12.265 -19.710   5.916
  897    HB3  ARG 118           HB2      ARG 118 -12.706 -20.361   4.351
  898    HG2  ARG 118           HG3      ARG 118 -13.602 -18.157   4.559
  899    HG3  ARG 118           HG2      ARG 118 -14.930 -19.310   4.570
  900    HD2  ARG 118           HD3      ARG 118 -15.369 -17.635   6.228
  901    HD3  ARG 118           HD2      ARG 118 -14.971 -19.137   7.060
  902    HE   ARG 118           HE       ARG 118 -12.598 -17.777   6.855
  903   HH11  ARG 118          HH11      ARG 118 -15.744 -17.133   8.251
  904   HH12  ARG 118          HH12      ARG 118 -15.118 -16.113   9.508
  905   HH21  ARG 118          HH21      ARG 118 -11.767 -16.437   8.499
  906   HH22  ARG 118          HH22      ARG 118 -12.845 -15.720   9.653
  907    H1   SER   1           H1       SER   1 -28.044 -11.487  16.954
  908    H2   SER   1           H2       SER   1 -28.641  -9.938  16.632
  909    H3   SER   1           H3       SER   1 -26.996 -10.163  16.939
  910    HA   SER   1           HA       SER   1 -28.467 -11.231  14.619
  911    HB2  SER   1           HB3      SER   1 -26.983  -9.594  13.376
  912    HB3  SER   1           HB2      SER   1 -28.240  -8.859  14.368
  913    HG   SER   1           HG       SER   1 -26.700  -7.834  15.339
  914    H    SER   2           H        SER   2 -27.227 -12.469  13.188
  915    HA   SER   2           HA       SER   2 -24.454 -13.030  13.909
  916    HB2  SER   2           HB3      SER   2 -26.570 -15.184  13.662
  917    HB3  SER   2           HB2      SER   2 -24.838 -15.479  13.814
  918    HG   SER   2           HG       SER   2 -25.560 -13.825  15.765
  919    H    THR   3           H        THR   3 -26.053 -11.773  11.667
  920    HA   THR   3           HA       THR   3 -25.481 -13.533   9.429
  921    HB   THR   3           HB       THR   3 -26.315 -11.408   8.148
  922    HG1  THR   3           HG1      THR   3 -26.651  -9.832   9.532
  923   HG21  THR   3          HG21      THR   3 -28.642 -12.125   8.466
  924   HG22  THR   3          HG22      THR   3 -28.157 -13.063   9.875
  925   HG23  THR   3          HG23      THR   3 -27.559 -13.501   8.276
  926    H    HIS   4           H        HIS   4 -23.192 -13.601   9.617
  927    HA   HIS   4           HA       HIS   4 -21.901 -11.129   8.689
  928    HB2  HIS   4           HB3      HIS   4 -19.819 -11.971   9.902
  929    HB3  HIS   4           HB2      HIS   4 -21.117 -11.349  10.904
  930    HD1  HIS   4           HD1      HIS   4 -22.014 -12.861  12.680
  931    HD2  HIS   4           HD2      HIS   4 -19.593 -14.871   9.966
  932    HE1  HIS   4           HE1      HIS   4 -21.702 -15.165  13.631
  933    HE2  HIS   4           HE2      HIS   4 -20.326 -16.394  11.921
  934    HA   PRO   5           HA       PRO   5 -20.885 -14.042   5.416
  935    HB2  PRO   5           HB3      PRO   5 -20.563 -12.236   3.473
  936    HB3  PRO   5           HB2      PRO   5 -22.176 -12.628   4.090
  937    HG2  PRO   5           HG3      PRO   5 -20.433 -10.273   4.694
  938    HG3  PRO   5           HG2      PRO   5 -22.184 -10.327   4.431
  939    HD2  PRO   5           HD3      PRO   5 -20.957 -10.250   6.913
  940    HD3  PRO   5           HD2      PRO   5 -22.604 -10.842   6.615
  941    H    VAL   6           H        VAL   6 -18.916 -13.760   7.217
  942    HA   VAL   6           HA       VAL   6 -16.666 -13.626   7.576
  943    HB   VAL   6           HB       VAL   6 -16.380 -13.680   4.568
  944   HG11  VAL   6          HG11      VAL   6 -14.581 -14.684   6.771
  945   HG12  VAL   6          HG12      VAL   6 -14.321 -13.238   5.793
  946   HG13  VAL   6          HG13      VAL   6 -14.274 -14.831   5.041
  947   HG21  VAL   6          HG21      VAL   6 -16.346 -16.123   4.726
  948   HG22  VAL   6          HG22      VAL   6 -17.900 -15.460   5.231
  949   HG23  VAL   6          HG23      VAL   6 -16.742 -16.012   6.440
  950    H    PHE   7           H        PHE   7 -17.535 -11.366   8.114
  951    HA   PHE   7           HA       PHE   7 -17.481  -9.109   8.089
  952    HB2  PHE   7           HB3      PHE   7 -14.970  -9.535   6.457
  953    HB3  PHE   7           HB2      PHE   7 -15.485  -7.985   7.102
  954    HD1  PHE   7           HD1      PHE   7 -13.842 -11.117   7.811
  955    HD2  PHE   7           HD2      PHE   7 -15.578  -7.651   9.566
  956    HE1  PHE   7           HE1      PHE   7 -12.669 -11.601   9.914
  957    HE2  PHE   7           HE2      PHE   7 -14.405  -8.126  11.674
  958    HZ   PHE   7           HZ       PHE   7 -12.948 -10.102  11.853
  959    H    HIS   8           H        HIS   8 -16.021  -9.304   4.879
  960    HA   HIS   8           HA       HIS   8 -18.642  -9.184   3.639
  961    HB2  HIS   8           HB3      HIS   8 -18.045  -7.256   2.190
  962    HB3  HIS   8           HB2      HIS   8 -18.190  -6.822   3.885
  963    HD1  HIS   8           HD1      HIS   8 -16.362  -5.410   4.751
  964    HD2  HIS   8           HD2      HIS   8 -15.175  -7.591   1.419
  965    HE1  HIS   8           HE1      HIS   8 -14.051  -4.593   4.197
  966    HE2  HIS   8           HE2      HIS   8 -13.315  -5.989   2.234
  967    H    MET   9           H        MET   9 -16.304 -10.946   3.911
  968    HA   MET   9           HA       MET   9 -14.900 -12.275   2.729
  969    HB2  MET   9           HB3      MET   9 -16.045 -13.512   0.895
  970    HB3  MET   9           HB2      MET   9 -16.946 -13.441   2.396
  971    HG2  MET   9           HG3      MET   9 -18.383 -11.715   1.464
  972    HG3  MET   9           HG2      MET   9 -17.455 -11.735  -0.032
  973    HE1  MET   9           HE1      MET   9 -19.794 -15.432   1.443
  974    HE2  MET   9           HE2      MET   9 -19.646 -13.950   2.389
  975    HE3  MET   9           HE3      MET   9 -18.221 -14.941   2.073
  976    H    GLY  10           H        GLY  10 -14.055  -9.817   2.239
  977    HA2  GLY  10           HA3      GLY  10 -13.192 -10.050  -0.582
  978    HA3  GLY  10           HA2      GLY  10 -13.687  -8.490   0.061
  979    H    GLU  11           H        GLU  11 -12.469  -9.633   2.677
  980    HA   GLU  11           HA       GLU  11  -9.774  -8.636   2.117
  981    HB2  GLU  11           HB3      GLU  11  -9.608  -8.386   4.597
  982    HB3  GLU  11           HB2      GLU  11 -10.888  -7.422   3.866
  983    HG2  GLU  11           HG3      GLU  11 -11.450 -10.103   5.090
  984    HG3  GLU  11           HG2      GLU  11 -11.391  -8.635   6.061
  985    H    PHE  12           H        PHE  12 -10.306 -11.201   1.232
  986    HA   PHE  12           HA       PHE  12  -9.310 -13.104   3.150
  987    HB2  PHE  12           HB3      PHE  12  -9.926 -13.275   0.207
  988    HB3  PHE  12           HB2      PHE  12  -9.109 -14.586   1.053
  989    HD1  PHE  12           HD1      PHE  12 -12.179 -13.529  -0.078
  990    HD2  PHE  12           HD2      PHE  12 -10.340 -15.183   3.383
  991    HE1  PHE  12           HE1      PHE  12 -14.347 -14.439   0.637
  992    HE2  PHE  12           HE2      PHE  12 -12.507 -16.095   4.105
  993    HZ   PHE  12           HZ       PHE  12 -14.516 -15.723   2.731
  994    H    SER  13           H        SER  13  -7.433 -11.698   3.609
  995    HA   SER  13           HA       SER  13  -5.291 -11.634   1.702
  996    HB2  SER  13           HB3      SER  13  -5.510  -9.876   3.419
  997    HB3  SER  13           HB2      SER  13  -5.293 -11.079   4.684
  998    HG   SER  13           HG       SER  13  -3.242 -10.797   4.454
  999    H    VAL  14           H        VAL  14  -3.672 -13.066   1.459
 1000    HA   VAL  14           HA       VAL  14  -3.915 -15.677   2.499
 1001    HB   VAL  14           HB       VAL  14  -1.738 -16.141   1.445
 1002   HG11  VAL  14          HG11      VAL  14  -3.563 -14.465  -0.273
 1003   HG12  VAL  14          HG12      VAL  14  -3.760 -16.180   0.083
 1004   HG13  VAL  14          HG13      VAL  14  -2.374 -15.628  -0.859
 1005   HG21  VAL  14          HG21      VAL  14  -0.525 -14.402   0.243
 1006   HG22  VAL  14          HG22      VAL  14  -0.614 -14.025   1.964
 1007   HG23  VAL  14          HG23      VAL  14  -1.665 -13.187   0.822
 1008    H    CYS  15           H        CYS  15  -2.347 -12.856   3.661
 1009    HA   CYS  15           HA       CYS  15  -1.239 -14.426   5.883
 1010    HB2  CYS  15           HB3      CYS  15   0.606 -13.451   4.657
 1011    HB3  CYS  15           HB2      CYS  15  -0.166 -11.863   4.682
 1012    H    ASP  16           H        ASP  16  -1.861 -13.877   7.877
 1013    HA   ASP  16           HA       ASP  16  -4.087 -12.181   8.256
 1014    HB2  ASP  16           HB3      ASP  16  -2.267 -13.725  10.051
 1015    HB3  ASP  16           HB2      ASP  16  -3.289 -12.485  10.772
 1016    H    SER  17           H        SER  17  -4.113 -10.073   8.282
 1017    HA   SER  17           HA       SER  17  -1.903  -8.598   9.485
 1018    HB2  SER  17           HB3      SER  17  -2.150  -7.001   7.436
 1019    HB3  SER  17           HB2      SER  17  -1.188  -8.476   7.268
 1020    HG   SER  17           HG       SER  17  -2.917  -9.453   6.237
 1021    H    VAL  18           H        VAL  18  -2.435  -6.360   9.936
 1022    HA   VAL  18           HA       VAL  18  -5.331  -5.898  10.151
 1023    HB   VAL  18           HB       VAL  18  -4.535  -6.481  12.339
 1024   HG11  VAL  18          HG11      VAL  18  -2.438  -4.350  11.977
 1025   HG12  VAL  18          HG12      VAL  18  -2.175  -6.091  12.081
 1026   HG13  VAL  18          HG13      VAL  18  -2.769  -5.205  13.485
 1027   HG21  VAL  18          HG21      VAL  18  -5.061  -4.440  13.603
 1028   HG22  VAL  18          HG22      VAL  18  -6.189  -4.724  12.279
 1029   HG23  VAL  18          HG23      VAL  18  -4.926  -3.503  12.115
 1030    H    SER  19           H        SER  19  -5.944  -4.144   9.077
 1031    HA   SER  19           HA       SER  19  -3.981  -2.103   8.388
 1032    HB2  SER  19           HB3      SER  19  -6.870  -2.416   7.515
 1033    HB3  SER  19           HB2      SER  19  -5.724  -1.234   6.878
 1034    HG   SER  19           HG       SER  19  -4.489  -2.905   6.039
 1035    H    VAL  20           H        VAL  20  -3.773  -0.299   9.527
 1036    HA   VAL  20           HA       VAL  20  -5.970   0.454  11.345
 1037    HB   VAL  20           HB       VAL  20  -2.997   0.808  11.749
 1038   HG11  VAL  20          HG11      VAL  20  -4.226   2.620  12.764
 1039   HG12  VAL  20          HG12      VAL  20  -3.588   1.545  14.009
 1040   HG13  VAL  20          HG13      VAL  20  -5.295   1.473  13.571
 1041   HG21  VAL  20          HG21      VAL  20  -3.247  -0.829  13.554
 1042   HG22  VAL  20          HG22      VAL  20  -3.662  -1.514  11.982
 1043   HG23  VAL  20          HG23      VAL  20  -4.938  -1.051  13.108
 1044    H    TRP  21           H        TRP  21  -6.661   2.518  11.301
 1045    HA   TRP  21           HA       TRP  21  -5.235   4.419   9.581
 1046    HB2  TRP  21           HB3      TRP  21  -8.046   4.433  10.710
 1047    HB3  TRP  21           HB2      TRP  21  -7.333   5.819   9.892
 1048    HD1  TRP  21           HD1      TRP  21  -8.706   2.315   9.205
 1049    HE1  TRP  21           HE1      TRP  21  -9.122   2.074   6.676
 1050    HE3  TRP  21           HE3      TRP  21  -6.540   6.668   7.601
 1051    HZ2  TRP  21           HZ2      TRP  21  -8.600   3.533   4.318
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.543   7.168   5.189
 1053    HH2  TRP  21           HH2      TRP  21  -7.551   5.633   3.586
 1054    H    VAL  22           H        VAL  22  -3.614   5.166  10.836
 1055    HA   VAL  22           HA       VAL  22  -3.988   5.686  13.637
 1056    HB   VAL  22           HB       VAL  22  -1.626   6.443  11.914
 1057   HG11  VAL  22          HG11      VAL  22  -1.662   7.556  14.067
 1058   HG12  VAL  22          HG12      VAL  22  -0.385   6.340  14.031
 1059   HG13  VAL  22          HG13      VAL  22  -1.893   6.011  14.885
 1060   HG21  VAL  22          HG21      VAL  22  -0.610   4.333  12.647
 1061   HG22  VAL  22          HG22      VAL  22  -2.059   4.063  11.681
 1062   HG23  VAL  22          HG23      VAL  22  -2.123   3.886  13.435
 1063    H    GLY  23           H        GLY  23  -4.991   7.442  14.339
 1064    HA2  GLY  23           HA3      GLY  23  -5.064   9.837  12.659
 1065    HA3  GLY  23           HA2      GLY  23  -6.058   9.530  14.082
 1066    H    ASP  24           H        ASP  24  -3.140   8.643  15.091
 1067    HA   ASP  24           HA       ASP  24  -2.085  11.306  15.622
 1068    HB2  ASP  24           HB3      ASP  24  -3.665  10.830  17.486
 1069    HB3  ASP  24           HB2      ASP  24  -2.742   9.377  17.866
 1070    H    LYS  25           H        LYS  25  -0.707  10.055  13.993
 1071    HA   LYS  25           HA       LYS  25   1.186   8.228  15.192
 1072    HB2  LYS  25           HB3      LYS  25   0.417   8.141  12.775
 1073    HB3  LYS  25           HB2      LYS  25   1.345   9.608  12.508
 1074    HG2  LYS  25           HG3      LYS  25   3.393   8.455  13.088
 1075    HG3  LYS  25           HG2      LYS  25   2.484   6.981  13.435
 1076    HD2  LYS  25           HD3      LYS  25   1.700   6.955  11.093
 1077    HD3  LYS  25           HD2      LYS  25   2.693   8.375  10.769
 1078    HE2  LYS  25           HE3      LYS  25   3.849   6.381  10.020
 1079    HE3  LYS  25           HE2      LYS  25   4.701   7.086  11.396
 1080    HZ1  LYS  25           HZ1      LYS  25   3.709   5.438  12.828
 1081    HZ2  LYS  25           HZ2      LYS  25   4.510   4.673  11.555
 1082    HZ3  LYS  25           HZ3      LYS  25   2.819   4.786  11.544
 1083    H    THR  26           H        THR  26   2.369   9.277  16.760
 1084    HA   THR  26           HA       THR  26   2.893  12.060  16.587
 1085    HB   THR  26           HB       THR  26   2.552  10.957  18.756
 1086    HG1  THR  26           HG1      THR  26   3.997  12.913  18.355
 1087   HG21  THR  26          HG21      THR  26   5.253   9.707  18.239
 1088   HG22  THR  26          HG22      THR  26   3.714   8.860  18.393
 1089   HG23  THR  26          HG23      THR  26   4.407   9.689  19.786
 1090    H    THR  27           H        THR  27   4.754   9.248  15.707
 1091    HA   THR  27           HA       THR  27   6.820  11.036  14.690
 1092    HB   THR  27           HB       THR  27   8.548   9.265  15.447
 1093    HG1  THR  27           HG1      THR  27   6.275   8.460  16.763
 1094   HG21  THR  27          HG21      THR  27   8.906  10.449  17.567
 1095   HG22  THR  27          HG22      THR  27   7.291  11.149  17.440
 1096   HG23  THR  27          HG23      THR  27   8.529  11.561  16.251
 1097    H    ALA  28           H        ALA  28   7.866  10.336  12.883
 1098    HA   ALA  28           HA       ALA  28   7.360   7.623  11.918
 1099    HB1  ALA  28           HB1      ALA  28   6.759  10.077  10.272
 1100    HB2  ALA  28           HB2      ALA  28   5.559   8.990  10.967
 1101    HB3  ALA  28           HB3      ALA  28   6.662   8.405   9.721
 1102    H    THR  29           H        THR  29   8.693   7.191   9.932
 1103    HA   THR  29           HA       THR  29  11.335   8.357  10.343
 1104    HB   THR  29           HB       THR  29  10.628   5.995   8.600
 1105    HG1  THR  29           HG1      THR  29  10.783   6.247  11.350
 1106   HG21  THR  29          HG21      THR  29  12.829   7.012   8.196
 1107   HG22  THR  29          HG22      THR  29  12.989   5.413   8.924
 1108   HG23  THR  29          HG23      THR  29  13.214   6.856   9.911
 1109    H    ASP  30           H        ASP  30  12.058   9.854   9.070
 1110    HA   ASP  30           HA       ASP  30  10.661  10.773   6.754
 1111    HB2  ASP  30           HB3      ASP  30  12.031  12.177   8.381
 1112    HB3  ASP  30           HB2      ASP  30  13.472  11.488   7.633
 1113    H    ILE  31           H        ILE  31  11.550  10.904   4.611
 1114    HA   ILE  31           HA       ILE  31  12.596   8.479   3.630
 1115    HB   ILE  31           HB       ILE  31  11.169  10.000   2.300
 1116   HG12  ILE  31          HG13      ILE  31  13.880   9.545   1.027
 1117   HG13  ILE  31          HG12      ILE  31  12.606   8.336   1.155
 1118   HG21  ILE  31          HG21      ILE  31  13.605  11.774   2.239
 1119   HG22  ILE  31          HG22      ILE  31  12.060  12.130   3.012
 1120   HG23  ILE  31          HG23      ILE  31  12.159  11.998   1.256
 1121   HD11  ILE  31          HD11      ILE  31  11.162   9.724  -0.250
 1122   HD12  ILE  31          HD12      ILE  31  12.669   9.302  -1.063
 1123   HD13  ILE  31          HD13      ILE  31  12.453  10.916  -0.387
 1124    H    LYS  32           H        LYS  32  14.106  11.258   4.944
 1125    HA   LYS  32           HA       LYS  32  16.686  10.733   3.732
 1126    HB2  LYS  32           HB3      LYS  32  15.847  12.673   5.885
 1127    HB3  LYS  32           HB2      LYS  32  17.441  12.614   5.146
 1128    HG2  LYS  32           HG3      LYS  32  16.471  13.169   2.983
 1129    HG3  LYS  32           HG2      LYS  32  14.864  13.196   3.705
 1130    HD2  LYS  32           HD3      LYS  32  15.550  15.019   5.163
 1131    HD3  LYS  32           HD2      LYS  32  17.164  14.996   4.453
 1132    HE2  LYS  32           HE3      LYS  32  14.593  15.572   2.992
 1133    HE3  LYS  32           HE2      LYS  32  15.773  16.778   3.506
 1134    HZ1  LYS  32           HZ1      LYS  32  17.411  15.679   2.063
 1135    HZ2  LYS  32           HZ2      LYS  32  16.085  16.263   1.196
 1136    HZ3  LYS  32           HZ3      LYS  32  16.214  14.610   1.522
 1137    H    GLY  33           H        GLY  33  14.949   9.358   6.182
 1138    HA2  GLY  33           HA3      GLY  33  15.708   7.597   7.538
 1139    HA3  GLY  33           HA2      GLY  33  17.361   8.162   7.315
 1140    H    LYS  34           H        LYS  34  14.893  10.409   8.161
 1141    HA   LYS  34           HA       LYS  34  16.136  10.778  10.785
 1142    HB2  LYS  34           HB3      LYS  34  14.213  12.548   9.265
 1143    HB3  LYS  34           HB2      LYS  34  14.982  12.952  10.790
 1144    HG2  LYS  34           HG3      LYS  34  16.437  12.460   8.204
 1145    HG3  LYS  34           HG2      LYS  34  16.025  14.044   8.851
 1146    HD2  LYS  34           HD3      LYS  34  17.342  13.515  10.875
 1147    HD3  LYS  34           HD2      LYS  34  17.828  11.996  10.123
 1148    HE2  LYS  34           HE3      LYS  34  18.922  13.194   8.331
 1149    HE3  LYS  34           HE2      LYS  34  18.340  14.726   8.971
 1150    HZ1  LYS  34           HZ1      LYS  34  20.639  14.337   9.576
 1151    HZ2  LYS  34           HZ2      LYS  34  20.224  12.887  10.340
 1152    HZ3  LYS  34           HZ3      LYS  34  19.663  14.359  10.959
 1153    H    GLU  35           H        GLU  35  14.699  11.296  12.595
 1154    HA   GLU  35           HA       GLU  35  12.111   9.916  12.409
 1155    HB2  GLU  35           HB3      GLU  35  13.605   9.022  14.135
 1156    HB3  GLU  35           HB2      GLU  35  13.775  10.626  14.833
 1157    HG2  GLU  35           HG3      GLU  35  11.488  10.647  15.515
 1158    HG3  GLU  35           HG2      GLU  35  11.163   9.153  14.641
 1159    H    VAL  36           H        VAL  36  10.431  11.227  12.165
 1160    HA   VAL  36           HA       VAL  36  10.744  14.010  13.071
 1161    HB   VAL  36           HB       VAL  36   9.164  14.620  11.225
 1162   HG11  VAL  36          HG11      VAL  36  11.774  13.329  10.450
 1163   HG12  VAL  36          HG12      VAL  36  11.536  14.999  10.967
 1164   HG13  VAL  36          HG13      VAL  36  10.857  14.443   9.436
 1165   HG21  VAL  36          HG21      VAL  36   9.713  11.799  10.316
 1166   HG22  VAL  36          HG22      VAL  36   8.882  13.041   9.379
 1167   HG23  VAL  36          HG23      VAL  36   8.160  12.429  10.868
 1168    H    THR  37           H        THR  37   9.016  15.083  13.937
 1169    HA   THR  37           HA       THR  37   7.045  13.400  15.230
 1170    HB   THR  37           HB       THR  37   7.461  16.381  15.495
 1171    HG1  THR  37           HG1      THR  37   8.428  15.298  17.617
 1172   HG21  THR  37          HG21      THR  37   6.322  16.102  17.645
 1173   HG22  THR  37          HG22      THR  37   6.115  14.382  17.318
 1174   HG23  THR  37          HG23      THR  37   5.296  15.576  16.311
 1175    H    VAL  38           H        VAL  38   5.235  12.971  14.150
 1176    HA   VAL  38           HA       VAL  38   4.360  14.724  12.006
 1177    HB   VAL  38           HB       VAL  38   3.147  12.110  12.910
 1178   HG11  VAL  38          HG11      VAL  38   2.226  12.057  10.627
 1179   HG12  VAL  38          HG12      VAL  38   2.880  13.672  10.349
 1180   HG13  VAL  38          HG13      VAL  38   1.632  13.423  11.571
 1181   HG21  VAL  38          HG21      VAL  38   5.477  11.774  12.284
 1182   HG22  VAL  38          HG22      VAL  38   5.193  12.595  10.750
 1183   HG23  VAL  38          HG23      VAL  38   4.393  11.062  11.089
 1184    H    LEU  39           H        LEU  39   2.612  16.025  12.083
 1185    HA   LEU  39           HA       LEU  39   1.442  16.466  14.704
 1186    HB2  LEU  39           HB3      LEU  39   1.088  17.972  12.108
 1187    HB3  LEU  39           HB2      LEU  39   0.487  18.486  13.673
 1188    HG   LEU  39           HG       LEU  39   3.403  18.151  12.978
 1189   HD11  LEU  39          HD11      LEU  39   1.718  20.636  13.222
 1190   HD12  LEU  39          HD12      LEU  39   2.422  19.989  11.741
 1191   HD13  LEU  39          HD13      LEU  39   3.471  20.599  13.020
 1192   HD21  LEU  39          HD21      LEU  39   2.036  19.290  15.408
 1193   HD22  LEU  39          HD22      LEU  39   3.769  19.358  15.089
 1194   HD23  LEU  39          HD23      LEU  39   2.978  17.801  15.335
 1195    H    ALA  40           H        ALA  40   0.624  14.934  11.778
 1196    HA   ALA  40           HA       ALA  40  -1.160  13.706  11.097
 1197    HB1  ALA  40           HB1      ALA  40  -2.939  13.114  12.627
 1198    HB2  ALA  40           HB2      ALA  40  -2.413  14.359  13.759
 1199    HB3  ALA  40           HB3      ALA  40  -1.375  12.972  13.430
 1200    H    GLU  41           H        GLU  41  -1.740  16.844  12.460
 1201    HA   GLU  41           HA       GLU  41  -3.939  17.311  10.569
 1202    HB2  GLU  41           HB3      GLU  41  -2.995  18.989  12.908
 1203    HB3  GLU  41           HB2      GLU  41  -4.406  19.312  11.913
 1204    HG2  GLU  41           HG3      GLU  41  -5.462  17.285  12.713
 1205    HG3  GLU  41           HG2      GLU  41  -4.032  16.901  13.670
 1206    H    VAL  42           H        VAL  42  -3.838  19.293   9.290
 1207    HA   VAL  42           HA       VAL  42  -1.065  20.170   8.899
 1208    HB   VAL  42           HB       VAL  42  -1.503  20.519   6.531
 1209   HG11  VAL  42          HG11      VAL  42  -1.719  18.170   5.848
 1210   HG12  VAL  42          HG12      VAL  42  -2.254  17.760   7.478
 1211   HG13  VAL  42          HG13      VAL  42  -0.624  18.375   7.214
 1212   HG21  VAL  42          HG21      VAL  42  -3.549  19.727   5.467
 1213   HG22  VAL  42          HG22      VAL  42  -3.890  21.020   6.617
 1214   HG23  VAL  42          HG23      VAL  42  -4.232  19.344   7.047
 1215    H    ASN  43           H        ASN  43  -0.743  22.140   9.506
 1216    HA   ASN  43           HA       ASN  43  -2.934  24.074   9.526
 1217    HB2  ASN  43           HB3      ASN  43  -0.144  24.189  10.712
 1218    HB3  ASN  43           HB2      ASN  43  -1.311  25.502  10.803
 1219   HD21  ASN  43          HD21      ASN  43  -0.401  22.387  12.012
 1220   HD22  ASN  43          HD22      ASN  43  -1.560  22.318  13.293
 1221    H    ILE  44           H        ILE  44  -3.168  24.831   7.487
 1222    HA   ILE  44           HA       ILE  44  -0.773  25.532   5.971
 1223    HB   ILE  44           HB       ILE  44  -3.671  25.598   5.106
 1224   HG12  ILE  44          HG13      ILE  44  -1.499  23.583   4.468
 1225   HG13  ILE  44          HG12      ILE  44  -2.804  23.319   5.624
 1226   HG21  ILE  44          HG21      ILE  44  -1.131  25.861   3.502
 1227   HG22  ILE  44          HG22      ILE  44  -2.284  27.151   3.842
 1228   HG23  ILE  44          HG23      ILE  44  -2.762  25.784   2.837
 1229   HD11  ILE  44          HD11      ILE  44  -3.125  23.776   2.665
 1230   HD12  ILE  44          HD12      ILE  44  -4.438  23.525   3.817
 1231   HD13  ILE  44          HD13      ILE  44  -3.276  22.234   3.508
 1232    H    ASN  45           H        ASN  45  -3.851  27.251   5.834
 1233    HA   ASN  45           HA       ASN  45  -2.491  29.650   6.870
 1234    HB2  ASN  45           HB3      ASN  45  -4.491  29.501   4.597
 1235    HB3  ASN  45           HB2      ASN  45  -3.922  30.997   5.324
 1236   HD21  ASN  45          HD21      ASN  45  -1.172  30.148   5.627
 1237   HD22  ASN  45          HD22      ASN  45  -0.492  30.113   4.035
 1238    H    ASN  46           H        ASN  46  -5.787  28.697   5.960
 1239    HA   ASN  46           HA       ASN  46  -6.635  29.225   8.718
 1240    HB2  ASN  46           HB3      ASN  46  -8.022  30.208   6.212
 1241    HB3  ASN  46           HB2      ASN  46  -8.728  30.263   7.822
 1242   HD21  ASN  46          HD21      ASN  46  -7.905  31.712   9.338
 1243   HD22  ASN  46          HD22      ASN  46  -6.913  33.052   8.880
 1244    H    SER  47           H        SER  47  -6.055  26.735   7.887
 1245    HA   SER  47           HA       SER  47  -8.571  25.380   8.034
 1246    HB2  SER  47           HB3      SER  47  -8.381  25.927   5.580
 1247    HB3  SER  47           HB2      SER  47  -6.913  24.950   5.532
 1248    HG   SER  47           HG       SER  47  -9.292  23.849   6.551
 1249    H    VAL  48           H        VAL  48  -8.233  23.652   9.258
 1250    HA   VAL  48           HA       VAL  48  -5.586  22.362   9.217
 1251    HB   VAL  48           HB       VAL  48  -7.317  22.712  11.670
 1252   HG11  VAL  48          HG11      VAL  48  -4.501  21.693  11.359
 1253   HG12  VAL  48          HG12      VAL  48  -5.927  20.727  11.736
 1254   HG13  VAL  48          HG13      VAL  48  -5.349  21.929  12.888
 1255   HG21  VAL  48          HG21      VAL  48  -5.652  24.327  12.448
 1256   HG22  VAL  48          HG22      VAL  48  -6.448  24.872  10.973
 1257   HG23  VAL  48          HG23      VAL  48  -4.817  24.207  10.900
 1258    H    PHE  49           H        PHE  49  -6.156  20.600   7.988
 1259    HA   PHE  49           HA       PHE  49  -8.328  18.936   9.062
 1260    HB2  PHE  49           HB3      PHE  49  -8.556  18.055   6.672
 1261    HB3  PHE  49           HB2      PHE  49  -9.160  19.676   6.991
 1262    HD1  PHE  49           HD1      PHE  49  -7.820  21.650   6.233
 1263    HD2  PHE  49           HD2      PHE  49  -6.854  17.663   5.092
 1264    HE1  PHE  49           HE1      PHE  49  -6.474  22.512   4.363
 1265    HE2  PHE  49           HE2      PHE  49  -5.502  18.529   3.226
 1266    HZ   PHE  49           HZ       PHE  49  -5.313  20.950   2.859
 1267    H    ARG  50           H        ARG  50  -8.053  16.771   9.201
 1268    HA   ARG  50           HA       ARG  50  -5.309  15.898   9.480
 1269    HB2  ARG  50           HB3      ARG  50  -7.958  14.596  10.137
 1270    HB3  ARG  50           HB2      ARG  50  -6.406  13.824  10.416
 1271    HG2  ARG  50           HG3      ARG  50  -5.776  15.595  11.940
 1272    HG3  ARG  50           HG2      ARG  50  -7.306  16.421  11.640
 1273    HD2  ARG  50           HD3      ARG  50  -7.029  13.655  12.805
 1274    HD3  ARG  50           HD2      ARG  50  -7.282  15.123  13.747
 1275    HE   ARG  50           HE       ARG  50  -9.277  14.677  11.716
 1276   HH11  ARG  50          HH11      ARG  50  -8.316  14.031  15.014
 1277   HH12  ARG  50          HH12      ARG  50  -9.925  13.671  15.550
 1278   HH21  ARG  50          HH21      ARG  50 -11.408  14.217  12.419
 1279   HH22  ARG  50          HH22      ARG  50 -11.687  13.792  14.076
 1280    H    GLN  51           H        GLN  51  -5.595  13.177   9.051
 1281    HA   GLN  51           HA       GLN  51  -6.351  12.759   6.287
 1282    HB2  GLN  51           HB3      GLN  51  -4.166  13.572   5.865
 1283    HB3  GLN  51           HB2      GLN  51  -3.491  12.726   7.248
 1284    HG2  GLN  51           HG3      GLN  51  -2.806  11.681   5.173
 1285    HG3  GLN  51           HG2      GLN  51  -3.818  10.591   6.117
 1286   HE21  GLN  51          HE21      GLN  51  -4.484   9.356   4.413
 1287   HE22  GLN  51          HE22      GLN  51  -5.529   9.940   3.158
 1288    H    TYR  52           H        TYR  52  -4.749  11.471   9.165
 1289    HA   TYR  52           HA       TYR  52  -4.786   9.460  10.198
 1290    HB2  TYR  52           HB3      TYR  52  -7.131   8.972   8.357
 1291    HB3  TYR  52           HB2      TYR  52  -6.518   7.728   9.439
 1292    HD1  TYR  52           HD1      TYR  52  -7.908  11.186   9.412
 1293    HD2  TYR  52           HD2      TYR  52  -7.202   7.644  11.660
 1294    HE1  TYR  52           HE1      TYR  52  -9.289  12.077  11.240
 1295    HE2  TYR  52           HE2      TYR  52  -8.581   8.526  13.493
 1296    HH   TYR  52           HH       TYR  52  -9.320  10.730  14.342
 1297    H    PHE  53           H        PHE  53  -3.272   7.990   9.981
 1298    HA   PHE  53           HA       PHE  53  -2.267   7.530   7.277
 1299    HB2  PHE  53           HB3      PHE  53  -0.939   7.011   9.949
 1300    HB3  PHE  53           HB2      PHE  53  -0.169   6.885   8.366
 1301    HD1  PHE  53           HD1      PHE  53   0.012   8.959   6.952
 1302    HD2  PHE  53           HD2      PHE  53  -1.073   9.063  11.062
 1303    HE1  PHE  53           HE1      PHE  53   0.567  11.351   7.030
 1304    HE2  PHE  53           HE2      PHE  53  -0.517  11.457  11.154
 1305    HZ   PHE  53           HZ       PHE  53   0.298  12.605   9.135
 1306    H    PHE  54           H        PHE  54  -2.721   5.742   6.291
 1307    HA   PHE  54           HA       PHE  54  -3.882   3.517   7.706
 1308    HB2  PHE  54           HB3      PHE  54  -4.098   2.594   5.320
 1309    HB3  PHE  54           HB2      PHE  54  -5.009   4.049   5.697
 1310    HD1  PHE  54           HD1      PHE  54  -2.490   2.569   3.591
 1311    HD2  PHE  54           HD2      PHE  54  -4.132   6.269   4.914
 1312    HE1  PHE  54           HE1      PHE  54  -1.460   3.713   1.673
 1313    HE2  PHE  54           HE2      PHE  54  -3.100   7.416   2.999
 1314    HZ   PHE  54           HZ       PHE  54  -1.762   6.136   1.375
 1315    H    GLU  55           H        GLU  55  -2.540   2.195   8.704
 1316    HA   GLU  55           HA       GLU  55  -0.174   1.248   7.223
 1317    HB2  GLU  55           HB3      GLU  55  -0.469   1.510  10.228
 1318    HB3  GLU  55           HB2      GLU  55   0.942   0.886   9.386
 1319    HG2  GLU  55           HG3      GLU  55   1.141   3.144   8.278
 1320    HG3  GLU  55           HG2      GLU  55  -0.107   3.709   9.393
 1321    H    THR  56           H        THR  56  -0.469  -0.753   6.561
 1322    HA   THR  56           HA       THR  56  -2.155  -2.562   8.126
 1323    HB   THR  56           HB       THR  56  -0.886  -3.014   5.414
 1324    HG1  THR  56           HG1      THR  56  -2.504  -1.840   4.725
 1325   HG21  THR  56          HG21      THR  56  -1.349  -5.100   6.590
 1326   HG22  THR  56          HG22      THR  56  -2.485  -4.885   5.257
 1327   HG23  THR  56          HG23      THR  56  -3.000  -4.571   6.915
 1328    H    LYS  57           H        LYS  57  -1.222  -3.758   9.614
 1329    HA   LYS  57           HA       LYS  57   1.664  -4.292   9.390
 1330    HB2  LYS  57           HB3      LYS  57   0.894  -2.926  11.323
 1331    HB3  LYS  57           HB2      LYS  57  -0.109  -4.274  11.844
 1332    HG2  LYS  57           HG3      LYS  57   1.872  -5.637  12.197
 1333    HG3  LYS  57           HG2      LYS  57   2.894  -4.321  11.622
 1334    HD2  LYS  57           HD3      LYS  57   1.073  -4.162  14.011
 1335    HD3  LYS  57           HD2      LYS  57   2.806  -4.476  14.087
 1336    HE2  LYS  57           HE3      LYS  57   1.506  -2.004  12.960
 1337    HE3  LYS  57           HE2      LYS  57   2.286  -2.129  14.533
 1338    HZ1  LYS  57           HZ1      LYS  57   4.367  -2.656  13.390
 1339    HZ2  LYS  57           HZ2      LYS  57   3.776  -1.140  12.941
 1340    HZ3  LYS  57           HZ3      LYS  57   3.607  -2.452  11.893
 1341    H    CYS  58           H        CYS  58   2.432  -6.351   9.547
 1342    HA   CYS  58           HA       CYS  58   0.618  -8.527   9.162
 1343    HB2  CYS  58           HB3      CYS  58   3.573  -8.660   9.825
 1344    HB3  CYS  58           HB2      CYS  58   2.604  -9.927   9.087
 1345    H    ARG  59           H        ARG  59  -0.622  -9.185  10.829
 1346    HA   ARG  59           HA       ARG  59   0.344  -8.961  13.549
 1347    HB2  ARG  59           HB3      ARG  59  -1.873  -9.637  14.234
 1348    HB3  ARG  59           HB2      ARG  59  -2.007  -8.407  12.986
 1349    HG2  ARG  59           HG3      ARG  59  -2.455 -10.160  11.332
 1350    HG3  ARG  59           HG2      ARG  59  -2.373 -11.370  12.611
 1351    HD2  ARG  59           HD3      ARG  59  -4.257 -10.274  13.745
 1352    HD3  ARG  59           HD2      ARG  59  -4.333  -9.084  12.447
 1353    HE   ARG  59           HE       ARG  59  -4.653 -11.927  11.800
 1354   HH11  ARG  59          HH11      ARG  59  -6.082  -8.748  12.135
 1355   HH12  ARG  59          HH12      ARG  59  -7.479  -9.137  11.180
 1356   HH21  ARG  59          HH21      ARG  59  -6.481 -12.452  10.556
 1357   HH22  ARG  59          HH22      ARG  59  -7.716 -11.254  10.294
 1358    H    ALA  60           H        ALA  60   0.794 -11.088  11.150
 1359    HA   ALA  60           HA       ALA  60   1.833 -13.076  12.965
 1360    HB1  ALA  60           HB1      ALA  60  -0.473 -13.869  12.646
 1361    HB2  ALA  60           HB2      ALA  60   0.690 -14.964  11.897
 1362    HB3  ALA  60           HB3      ALA  60  -0.237 -13.847  10.896
 1363    H    SER  61           H        SER  61   3.692 -13.900  12.130
 1364    HA   SER  61           HA       SER  61   4.524 -13.026   9.500
 1365    HB2  SER  61           HB3      SER  61   6.661 -14.244  10.150
 1366    HB3  SER  61           HB2      SER  61   6.200 -12.900  11.196
 1367    HG   SER  61           HG       SER  61   6.818 -14.820  12.345
 1368    H    ASN  62           H        ASN  62   3.481 -15.906  11.113
 1369    HA   ASN  62           HA       ASN  62   3.102 -17.212   8.527
 1370    HB2  ASN  62           HB3      ASN  62   4.539 -18.423  10.894
 1371    HB3  ASN  62           HB2      ASN  62   3.744 -19.423   9.685
 1372   HD21  ASN  62          HD21      ASN  62   4.408 -17.730   7.447
 1373   HD22  ASN  62          HD22      ASN  62   6.102 -17.923   7.162
 1374    HA   PRO  63           HA       PRO  63  -0.767 -17.013  11.061
 1375    HB2  PRO  63           HB3      PRO  63  -2.306 -17.605   8.797
 1376    HB3  PRO  63           HB2      PRO  63  -1.985 -15.990   9.440
 1377    HG2  PRO  63           HG3      PRO  63  -0.680 -17.443   7.196
 1378    HG3  PRO  63           HG2      PRO  63  -1.024 -15.715   7.366
 1379    HD2  PRO  63           HD3      PRO  63   1.465 -16.688   7.683
 1380    HD3  PRO  63           HD2      PRO  63   0.867 -15.335   8.676
 1381    H    VAL  64           H        VAL  64   0.225 -19.396   8.652
 1382    HA   VAL  64           HA       VAL  64  -1.059 -21.469  10.301
 1383    HB   VAL  64           HB       VAL  64  -1.181 -22.885   8.289
 1384   HG11  VAL  64          HG11      VAL  64  -2.519 -20.207   7.950
 1385   HG12  VAL  64          HG12      VAL  64  -3.124 -21.562   8.904
 1386   HG13  VAL  64          HG13      VAL  64  -2.997 -21.704   7.151
 1387   HG21  VAL  64          HG21      VAL  64  -0.206 -20.438   6.830
 1388   HG22  VAL  64          HG22      VAL  64  -0.830 -21.899   6.066
 1389   HG23  VAL  64          HG23      VAL  64   0.656 -21.964   7.013
 1390    H    GLU  65           H        GLU  65   0.129 -23.518  10.409
 1391    HA   GLU  65           HA       GLU  65   2.921 -22.969  10.857
 1392    HB2  GLU  65           HB3      GLU  65   1.417 -24.337  12.375
 1393    HB3  GLU  65           HB2      GLU  65   1.516 -25.616  11.174
 1394    HG2  GLU  65           HG3      GLU  65   3.945 -25.676  11.444
 1395    HG3  GLU  65           HG2      GLU  65   3.831 -24.414  12.669
 1396    H    SER  66           H        SER  66   3.039 -22.555   8.457
 1397    HA   SER  66           HA       SER  66   4.602 -24.491   7.185
 1398    HB2  SER  66           HB3      SER  66   3.030 -25.009   5.262
 1399    HB3  SER  66           HB2      SER  66   2.599 -25.773   6.793
 1400    HG   SER  66           HG       SER  66   0.860 -24.557   6.932
 1401    H    GLY  67           H        GLY  67   2.733 -21.613   7.207
 1402    HA2  GLY  67           HA3      GLY  67   4.461 -19.850   6.200
 1403    HA3  GLY  67           HA2      GLY  67   3.830 -20.588   4.728
 1404    H    CYS  68           H        CYS  68   2.160 -19.571   3.851
 1405    HA   CYS  68           HA       CYS  68   0.418 -17.978   5.609
 1406    HB2  CYS  68           HB3      CYS  68   0.998 -17.641   2.653
 1407    HB3  CYS  68           HB2      CYS  68  -0.163 -16.673   3.567
 1408    H    ARG  69           H        ARG  69  -1.859 -17.707   4.474
 1409    HA   ARG  69           HA       ARG  69  -3.036 -20.280   4.687
 1410    HB2  ARG  69           HB3      ARG  69  -4.271 -17.732   3.605
 1411    HB3  ARG  69           HB2      ARG  69  -5.152 -19.167   4.109
 1412    HG2  ARG  69           HG3      ARG  69  -4.287 -18.787   6.427
 1413    HG3  ARG  69           HG2      ARG  69  -3.600 -17.263   5.852
 1414    HD2  ARG  69           HD3      ARG  69  -5.884 -16.611   5.073
 1415    HD3  ARG  69           HD2      ARG  69  -6.514 -18.054   5.869
 1416    HE   ARG  69           HE       ARG  69  -4.995 -16.374   7.639
 1417   HH11  ARG  69          HH11      ARG  69  -8.131 -16.910   6.183
 1418   HH12  ARG  69          HH12      ARG  69  -8.996 -16.014   7.386
 1419   HH21  ARG  69          HH21      ARG  69  -6.125 -15.178   9.231
 1420   HH22  ARG  69          HH22      ARG  69  -7.857 -15.033   9.128
 1421    H    GLY  70           H        GLY  70  -3.101 -21.818   3.170
 1422    HA2  GLY  70           HA3      GLY  70  -3.930 -22.705   1.169
 1423    HA3  GLY  70           HA2      GLY  70  -4.047 -21.076   0.523
 1424    H    ILE  71           H        ILE  71  -1.021 -21.277   1.779
 1425    HA   ILE  71           HA       ILE  71   0.166 -21.548  -0.830
 1426    HB   ILE  71           HB       ILE  71   1.501 -21.250   1.869
 1427   HG12  ILE  71          HG13      ILE  71   0.052 -19.347   1.386
 1428   HG13  ILE  71          HG12      ILE  71   1.742 -18.873   1.249
 1429   HG21  ILE  71          HG21      ILE  71   2.596 -20.864  -0.915
 1430   HG22  ILE  71          HG22      ILE  71   3.017 -22.157   0.207
 1431   HG23  ILE  71          HG23      ILE  71   3.449 -20.490   0.582
 1432   HD11  ILE  71          HD11      ILE  71   0.451 -17.881  -0.527
 1433   HD12  ILE  71          HD12      ILE  71  -0.140 -19.465  -1.023
 1434   HD13  ILE  71          HD13      ILE  71   1.570 -19.070  -1.198
 1435    H    ASP  72           H        ASP  72   1.295 -23.196  -1.635
 1436    HA   ASP  72           HA       ASP  72   0.865 -25.817  -0.872
 1437    HB2  ASP  72           HB3      ASP  72   1.554 -25.284  -3.109
 1438    HB3  ASP  72           HB2      ASP  72   3.083 -24.625  -2.536
 1439    H    SER  73           H        SER  73   3.568 -23.726  -0.063
 1440    HA   SER  73           HA       SER  73   4.938 -23.694   1.740
 1441    HB2  SER  73           HB3      SER  73   3.088 -24.635   3.071
 1442    HB3  SER  73           HB2      SER  73   3.584 -26.261   2.601
 1443    HG   SER  73           HG       SER  73   5.005 -24.381   4.187
 1444    H    LYS  74           H        LYS  74   4.621 -26.812   0.100
 1445    HA   LYS  74           HA       LYS  74   7.233 -27.717   0.846
 1446    HB2  LYS  74           HB3      LYS  74   5.438 -28.667  -1.391
 1447    HB3  LYS  74           HB2      LYS  74   6.844 -29.516  -0.774
 1448    HG2  LYS  74           HG3      LYS  74   5.696 -29.688   1.429
 1449    HG3  LYS  74           HG2      LYS  74   4.261 -28.984   0.675
 1450    HD2  LYS  74           HD3      LYS  74   5.622 -31.554  -0.113
 1451    HD3  LYS  74           HD2      LYS  74   4.079 -31.402   0.722
 1452    HE2  LYS  74           HE3      LYS  74   3.156 -30.242  -1.234
 1453    HE3  LYS  74           HE2      LYS  74   4.699 -30.427  -2.062
 1454    HZ1  LYS  74           HZ1      LYS  74   3.185 -32.123  -2.780
 1455    HZ2  LYS  74           HZ2      LYS  74   2.896 -32.614  -1.189
 1456    HZ3  LYS  74           HZ3      LYS  74   4.423 -32.843  -1.882
 1457    H    HIS  75           H        HIS  75   5.806 -26.227  -2.009
 1458    HA   HIS  75           HA       HIS  75   8.421 -26.073  -3.301
 1459    HB2  HIS  75           HB3      HIS  75   5.624 -25.390  -4.211
 1460    HB3  HIS  75           HB2      HIS  75   7.048 -24.998  -5.163
 1461    HD1  HIS  75           HD1      HIS  75   7.889 -26.776  -6.690
 1462    HD2  HIS  75           HD2      HIS  75   5.322 -28.273  -3.787
 1463    HE1  HIS  75           HE1      HIS  75   7.516 -29.184  -7.301
 1464    HE2  HIS  75           HE2      HIS  75   5.794 -29.999  -5.655
 1465    H    TRP  76           H        TRP  76   6.505 -24.203  -1.247
 1466    HA   TRP  76           HA       TRP  76   8.096 -21.815  -1.833
 1467    HB2  TRP  76           HB3      TRP  76   5.074 -21.821  -1.614
 1468    HB3  TRP  76           HB2      TRP  76   6.082 -20.382  -1.713
 1469    HD1  TRP  76           HD1      TRP  76   4.168 -22.729  -3.810
 1470    HE1  TRP  76           HE1      TRP  76   4.650 -22.314  -6.300
 1471    HE3  TRP  76           HE3      TRP  76   8.275 -19.717  -3.365
 1472    HZ2  TRP  76           HZ2      TRP  76   6.517 -20.905  -7.870
 1473    HZ3  TRP  76           HZ3      TRP  76   9.353 -18.881  -5.410
 1474    HH2  TRP  76           HH2      TRP  76   8.490 -19.463  -7.619
 1475    H    ASN  77           H        ASN  77   9.084 -21.396   0.112
 1476    HA   ASN  77           HA       ASN  77   7.558 -21.744   2.567
 1477    HB2  ASN  77           HB3      ASN  77   9.984 -22.255   2.566
 1478    HB3  ASN  77           HB2      ASN  77  10.327 -20.582   2.145
 1479   HD21  ASN  77          HD21      ASN  77   9.188 -22.734   4.645
 1480   HD22  ASN  77          HD22      ASN  77   9.397 -21.623   5.958
 1481    H    SER  78           H        SER  78   6.712 -20.061   3.771
 1482    HA   SER  78           HA       SER  78   6.394 -17.599   2.193
 1483    HB2  SER  78           HB3      SER  78   4.449 -18.619   4.256
 1484    HB3  SER  78           HB2      SER  78   4.162 -17.466   2.953
 1485    HG   SER  78           HG       SER  78   4.778 -19.379   1.566
 1486    H    TYR  79           H        TYR  79   6.533 -15.624   3.139
 1487    HA   TYR  79           HA       TYR  79   6.685 -15.396   6.032
 1488    HB2  TYR  79           HB3      TYR  79   9.036 -15.675   5.440
 1489    HB3  TYR  79           HB2      TYR  79   8.903 -14.425   4.203
 1490    HD1  TYR  79           HD1      TYR  79   9.548 -12.261   4.742
 1491    HD2  TYR  79           HD2      TYR  79   8.426 -14.904   7.880
 1492    HE1  TYR  79           HE1      TYR  79  10.174 -10.555   6.393
 1493    HE2  TYR  79           HE2      TYR  79   9.052 -13.202   9.542
 1494    HH   TYR  79           HH       TYR  79  10.494 -11.235   9.714
 1495    H    CYS  80           H        CYS  80   5.760 -13.541   6.732
 1496    HA   CYS  80           HA       CYS  80   4.517 -11.873   4.713
 1497    HB2  CYS  80           HB3      CYS  80   4.219 -11.883   7.726
 1498    HB3  CYS  80           HB2      CYS  80   3.230 -10.947   6.600
 1499    H    THR  81           H        THR  81   5.126  -9.896   4.174
 1500    HA   THR  81           HA       THR  81   6.865  -8.369   5.980
 1501    HB   THR  81           HB       THR  81   7.383  -8.730   3.013
 1502    HG1  THR  81           HG1      THR  81   8.128 -10.191   5.138
 1503   HG21  THR  81          HG21      THR  81   8.961  -7.220   5.104
 1504   HG22  THR  81          HG22      THR  81   7.990  -6.493   3.823
 1505   HG23  THR  81          HG23      THR  81   9.421  -7.440   3.415
 1506    H    THR  82           H        THR  82   6.282  -6.238   6.098
 1507    HA   THR  82           HA       THR  82   3.950  -5.421   4.627
 1508    HB   THR  82           HB       THR  82   4.250  -3.266   5.909
 1509    HG1  THR  82           HG1      THR  82   6.061  -2.993   6.918
 1510   HG21  THR  82          HG21      THR  82   2.731  -4.995   6.683
 1511   HG22  THR  82          HG22      THR  82   3.549  -4.247   8.054
 1512   HG23  THR  82          HG23      THR  82   4.061  -5.833   7.481
 1513    H    THR  83           H        THR  83   3.890  -4.251   2.830
 1514    HA   THR  83           HA       THR  83   6.365  -3.182   1.759
 1515    HB   THR  83           HB       THR  83   4.930  -4.311   0.163
 1516    HG1  THR  83           HG1      THR  83   4.753  -2.607  -1.373
 1517   HG21  THR  83          HG21      THR  83   2.762  -4.037   1.164
 1518   HG22  THR  83          HG22      THR  83   2.722  -3.352  -0.460
 1519   HG23  THR  83          HG23      THR  83   2.833  -2.289   0.944
 1520    H    HIS  84           H        HIS  84   6.738  -0.978   1.387
 1521    HA   HIS  84           HA       HIS  84   5.061   0.751   3.071
 1522    HB2  HIS  84           HB3      HIS  84   7.246   1.888   3.758
 1523    HB3  HIS  84           HB2      HIS  84   6.930   0.300   4.449
 1524    HD1  HIS  84           HD1      HIS  84   9.184   2.062   2.016
 1525    HD2  HIS  84           HD2      HIS  84   8.715  -1.699   3.716
 1526    HE1  HIS  84           HE1      HIS  84  11.268   0.791   1.425
 1527    HE2  HIS  84           HE2      HIS  84  10.879  -1.535   2.310
 1528    H    THR  85           H        THR  85   4.863   2.872   2.516
 1529    HA   THR  85           HA       THR  85   6.094   3.697  -0.033
 1530    HB   THR  85           HB       THR  85   3.650   3.073  -0.273
 1531    HG1  THR  85           HG1      THR  85   3.604   4.552  -1.797
 1532   HG21  THR  85          HG21      THR  85   1.987   4.659   0.596
 1533   HG22  THR  85          HG22      THR  85   3.264   5.518   1.457
 1534   HG23  THR  85          HG23      THR  85   2.864   3.860   1.901
 1535    H    PHE  86           H        PHE  86   5.702   6.220  -0.247
 1536    HA   PHE  86           HA       PHE  86   6.359   7.404   2.368
 1537    HB2  PHE  86           HB3      PHE  86   7.562   7.963  -0.342
 1538    HB3  PHE  86           HB2      PHE  86   7.676   9.120   0.985
 1539    HD1  PHE  86           HD1      PHE  86   8.991   6.090  -0.448
 1540    HD2  PHE  86           HD2      PHE  86   8.817   8.442   3.094
 1541    HE1  PHE  86           HE1      PHE  86  10.960   4.904   0.430
 1542    HE2  PHE  86           HE2      PHE  86  10.783   7.262   3.980
 1543    HZ   PHE  86           HZ       PHE  86  11.857   5.495   2.650
 1544    H    VAL  87           H        VAL  87   4.868   8.735   3.050
 1545    HA   VAL  87           HA       VAL  87   3.291  10.247   1.068
 1546    HB   VAL  87           HB       VAL  87   1.519  10.399   2.825
 1547   HG11  VAL  87          HG11      VAL  87   1.310   8.759   1.063
 1548   HG12  VAL  87          HG12      VAL  87   0.722   8.080   2.581
 1549   HG13  VAL  87          HG13      VAL  87   2.309   7.621   1.967
 1550   HG21  VAL  87          HG21      VAL  87   2.911  10.014   4.793
 1551   HG22  VAL  87          HG22      VAL  87   3.210   8.357   4.264
 1552   HG23  VAL  87          HG23      VAL  87   1.582   8.858   4.720
 1553    H    LYS  88           H        LYS  88   3.111  12.456   1.336
 1554    HA   LYS  88           HA       LYS  88   5.009  13.609   3.201
 1555    HB2  LYS  88           HB3      LYS  88   4.613  15.730   2.021
 1556    HB3  LYS  88           HB2      LYS  88   5.065  14.439   0.920
 1557    HG2  LYS  88           HG3      LYS  88   2.674  14.172   0.330
 1558    HG3  LYS  88           HG2      LYS  88   2.309  15.563   1.350
 1559    HD2  LYS  88           HD3      LYS  88   3.841  16.922  -0.010
 1560    HD3  LYS  88           HD2      LYS  88   4.113  15.534  -1.063
 1561    HE2  LYS  88           HE3      LYS  88   1.685  15.500  -1.554
 1562    HE3  LYS  88           HE2      LYS  88   1.506  16.967  -0.591
 1563    HZ1  LYS  88           HZ1      LYS  88   3.269  16.740  -2.970
 1564    HZ2  LYS  88           HZ2      LYS  88   2.906  18.148  -2.105
 1565    HZ3  LYS  88           HZ3      LYS  88   1.699  17.380  -3.005
 1566    H    ALA  89           H        ALA  89   4.466  14.173   5.128
 1567    HA   ALA  89           HA       ALA  89   1.726  15.130   5.648
 1568    HB1  ALA  89           HB1      ALA  89   1.752  13.976   7.790
 1569    HB2  ALA  89           HB2      ALA  89   3.369  13.359   7.461
 1570    HB3  ALA  89           HB3      ALA  89   2.006  12.827   6.477
 1571    H    LEU  90           H        LEU  90   1.548  16.651   7.387
 1572    HA   LEU  90           HA       LEU  90   3.780  18.424   7.501
 1573    HB2  LEU  90           HB3      LEU  90   1.350  19.128   7.525
 1574    HB3  LEU  90           HB2      LEU  90   1.279  18.555   9.187
 1575    HG   LEU  90           HG       LEU  90   3.145  20.171   9.722
 1576   HD11  LEU  90          HD11      LEU  90   3.475  22.032   8.161
 1577   HD12  LEU  90          HD12      LEU  90   2.470  21.203   6.973
 1578   HD13  LEU  90          HD13      LEU  90   4.002  20.493   7.480
 1579   HD21  LEU  90          HD21      LEU  90   0.793  20.628  10.260
 1580   HD22  LEU  90          HD22      LEU  90   0.588  21.373   8.674
 1581   HD23  LEU  90          HD23      LEU  90   1.680  22.097   9.853
 1582    H    THR  91           H        THR  91   5.453  18.072   8.704
 1583    HA   THR  91           HA       THR  91   5.121  16.804  11.341
 1584    HB   THR  91           HB       THR  91   7.512  16.133  11.115
 1585    HG1  THR  91           HG1      THR  91   7.153  17.393   8.604
 1586   HG21  THR  91          HG21      THR  91   5.766  14.532  10.545
 1587   HG22  THR  91          HG22      THR  91   7.142  14.344   9.460
 1588   HG23  THR  91          HG23      THR  91   5.689  15.173   8.905
 1589    H    THR  92           H        THR  92   6.653  17.581  13.011
 1590    HA   THR  92           HA       THR  92   7.272  20.407  12.520
 1591    HB   THR  92           HB       THR  92   5.538  20.141  14.218
 1592    HG1  THR  92           HG1      THR  92   7.505  21.683  14.352
 1593   HG21  THR  92          HG21      THR  92   6.071  19.148  16.408
 1594   HG22  THR  92          HG22      THR  92   7.617  18.593  15.765
 1595   HG23  THR  92          HG23      THR  92   6.108  17.957  15.109
 1596    H    ASP  93           H        ASP  93   9.277  20.976  12.470
 1597    HA   ASP  93           HA       ASP  93  11.316  19.262  13.716
 1598    HB2  ASP  93           HB3      ASP  93  11.584  19.624  11.276
 1599    HB3  ASP  93           HB2      ASP  93  11.628  21.363  11.550
 1600    H    GLU  94           H        GLU  94  11.418  19.981  15.742
 1601    HA   GLU  94           HA       GLU  94  11.906  21.279  17.530
 1602    HB2  GLU  94           HB3      GLU  94  12.899  23.240  15.456
 1603    HB3  GLU  94           HB2      GLU  94  13.095  23.447  17.191
 1604    HG2  GLU  94           HG3      GLU  94  14.239  21.236  15.505
 1605    HG3  GLU  94           HG2      GLU  94  15.118  22.595  16.193
 1606    H    LYS  95           H        LYS  95  11.082  23.967  15.375
 1607    HA   LYS  95           HA       LYS  95   8.526  24.242  16.809
 1608    HB2  LYS  95           HB3      LYS  95  10.421  26.462  16.019
 1609    HB3  LYS  95           HB2      LYS  95   8.800  26.712  16.648
 1610    HG2  LYS  95           HG3      LYS  95   9.430  25.680  18.750
 1611    HG3  LYS  95           HG2      LYS  95  11.042  25.345  18.119
 1612    HD2  LYS  95           HD3      LYS  95  11.416  27.751  17.835
 1613    HD3  LYS  95           HD2      LYS  95   9.821  28.073  18.517
 1614    HE2  LYS  95           HE3      LYS  95  10.506  27.029  20.613
 1615    HE3  LYS  95           HE2      LYS  95  12.088  26.675  19.925
 1616    HZ1  LYS  95           HZ1      LYS  95  12.132  28.656  21.309
 1617    HZ2  LYS  95           HZ2      LYS  95  10.963  29.391  20.338
 1618    HZ3  LYS  95           HZ3      LYS  95  12.490  29.040  19.701
 1619    H    GLN  96           H        GLN  96  10.118  23.942  13.861
 1620    HA   GLN  96           HA       GLN  96   8.248  25.525  12.307
 1621    HB2  GLN  96           HB3      GLN  96  10.615  23.808  11.545
 1622    HB3  GLN  96           HB2      GLN  96   9.563  24.545  10.353
 1623    HG2  GLN  96           HG3      GLN  96  11.469  25.922  10.560
 1624    HG3  GLN  96           HG2      GLN  96  10.133  26.767  11.332
 1625   HE21  GLN  96          HE21      GLN  96  10.194  27.141  13.528
 1626   HE22  GLN  96          HE22      GLN  96  11.602  26.853  14.491
 1627    H    ALA  97           H        ALA  97   6.946  24.631  10.622
 1628    HA   ALA  97           HA       ALA  97   6.317  21.769  10.959
 1629    HB1  ALA  97           HB1      ALA  97   4.508  23.165  11.836
 1630    HB2  ALA  97           HB2      ALA  97   3.994  22.272  10.405
 1631    HB3  ALA  97           HB3      ALA  97   4.386  23.986  10.280
 1632    H    ALA  98           H        ALA  98   6.816  20.632   9.194
 1633    HA   ALA  98           HA       ALA  98   6.624  21.942   6.572
 1634    HB1  ALA  98           HB1      ALA  98   9.004  20.354   7.527
 1635    HB2  ALA  98           HB2      ALA  98   8.955  22.101   7.289
 1636    HB3  ALA  98           HB3      ALA  98   8.787  21.018   5.908
 1637    H    TRP  99           H        TRP  99   6.122  20.617   4.869
 1638    HA   TRP  99           HA       TRP  99   4.851  18.113   5.503
 1639    HB2  TRP  99           HB3      TRP  99   5.355  19.464   2.837
 1640    HB3  TRP  99           HB2      TRP  99   4.355  18.040   3.069
 1641    HD1  TRP  99           HD1      TRP  99   4.435  21.734   4.259
 1642    HE1  TRP  99           HE1      TRP  99   2.004  22.543   4.498
 1643    HE3  TRP  99           HE3      TRP  99   2.027  17.367   3.152
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.593  21.467   4.242
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.438  17.341   3.166
 1646    HH2  TRP  99           HH2      TRP  99  -1.717  19.350   3.701
 1647    H    ARG 100           H        ARG 100   6.201  16.477   5.990
 1648    HA   ARG 100           HA       ARG 100   8.533  16.060   4.244
 1649    HB2  ARG 100           HB3      ARG 100   8.043  15.274   7.118
 1650    HB3  ARG 100           HB2      ARG 100   9.386  14.646   6.173
 1651    HG2  ARG 100           HG3      ARG 100   8.885  17.539   6.844
 1652    HG3  ARG 100           HG2      ARG 100  10.098  16.490   7.573
 1653    HD2  ARG 100           HD3      ARG 100   9.976  17.465   4.727
 1654    HD3  ARG 100           HD2      ARG 100  11.205  17.817   5.935
 1655    HE   ARG 100           HE       ARG 100  11.444  15.179   5.788
 1656   HH11  ARG 100          HH11      ARG 100  11.118  17.536   3.206
 1657   HH12  ARG 100          HH12      ARG 100  12.020  16.593   2.065
 1658   HH21  ARG 100          HH21      ARG 100  12.615  13.941   4.301
 1659   HH22  ARG 100          HH22      ARG 100  12.859  14.542   2.680
 1660    H    PHE 101           H        PHE 101   8.989  14.055   3.438
 1661    HA   PHE 101           HA       PHE 101   6.690  12.337   3.054
 1662    HB2  PHE 101           HB3      PHE 101   9.500  12.260   1.919
 1663    HB3  PHE 101           HB2      PHE 101   8.263  11.072   1.534
 1664    HD1  PHE 101           HD1      PHE 101   8.991  14.724   1.370
 1665    HD2  PHE 101           HD2      PHE 101   6.763  11.445  -0.191
 1666    HE1  PHE 101           HE1      PHE 101   8.170  16.150  -0.454
 1667    HE2  PHE 101           HE2      PHE 101   5.940  12.872  -2.015
 1668    HZ   PHE 101           HZ       PHE 101   6.644  15.227  -2.149
 1669    H    ILE 102           H        ILE 102   6.236  10.863   4.516
 1670    HA   ILE 102           HA       ILE 102   8.448   9.542   5.942
 1671    HB   ILE 102           HB       ILE 102   6.807   9.094   7.756
 1672   HG12  ILE 102          HG13      ILE 102   5.032  11.022   6.246
 1673   HG13  ILE 102          HG12      ILE 102   4.759   9.290   6.350
 1674   HG21  ILE 102          HG21      ILE 102   6.771  11.394   8.637
 1675   HG22  ILE 102          HG22      ILE 102   7.235  11.989   7.043
 1676   HG23  ILE 102          HG23      ILE 102   8.336  10.953   7.953
 1677   HD11  ILE 102          HD11      ILE 102   4.737  11.238   8.643
 1678   HD12  ILE 102          HD12      ILE 102   4.507   9.495   8.781
 1679   HD13  ILE 102          HD13      ILE 102   3.332  10.474   7.897
 1680    H    ARG 103           H        ARG 103   8.274   7.310   6.338
 1681    HA   ARG 103           HA       ARG 103   6.888   5.949   4.181
 1682    HB2  ARG 103           HB3      ARG 103   8.199   3.990   4.793
 1683    HB3  ARG 103           HB2      ARG 103   9.247   5.396   4.652
 1684    HG2  ARG 103           HG3      ARG 103   9.327   5.608   7.065
 1685    HG3  ARG 103           HG2      ARG 103   8.207   4.260   7.239
 1686    HD2  ARG 103           HD3      ARG 103   9.868   2.800   6.108
 1687    HD3  ARG 103           HD2      ARG 103  10.994   4.159   6.093
 1688    HE   ARG 103           HE       ARG 103   9.964   3.526   8.703
 1689   HH11  ARG 103          HH11      ARG 103  12.451   2.799   6.346
 1690   HH12  ARG 103          HH12      ARG 103  13.582   2.225   7.531
 1691   HH21  ARG 103          HH21      ARG 103  11.454   2.757  10.260
 1692   HH22  ARG 103          HH22      ARG 103  13.015   2.200   9.746
 1693    H    ILE 104           H        ILE 104   5.129   4.736   4.368
 1694    HA   ILE 104           HA       ILE 104   4.347   3.779   7.040
 1695    HB   ILE 104           HB       ILE 104   1.958   4.089   6.430
 1696   HG12  ILE 104          HG13      ILE 104   3.029   5.767   4.157
 1697   HG13  ILE 104          HG12      ILE 104   2.323   4.169   3.967
 1698   HG21  ILE 104          HG21      ILE 104   3.049   5.710   7.865
 1699   HG22  ILE 104          HG22      ILE 104   1.882   6.511   6.812
 1700   HG23  ILE 104          HG23      ILE 104   3.605   6.612   6.454
 1701   HD11  ILE 104          HD11      ILE 104   0.739   5.927   3.414
 1702   HD12  ILE 104          HD12      ILE 104   0.909   6.595   5.038
 1703   HD13  ILE 104          HD13      ILE 104   0.201   4.995   4.812
 1704    H    ASP 105           H        ASP 105   3.169   1.811   7.049
 1705    HA   ASP 105           HA       ASP 105   3.859   0.077   4.818
 1706    HB2  ASP 105           HB3      ASP 105   2.546  -0.572   7.478
 1707    HB3  ASP 105           HB2      ASP 105   3.075  -1.758   6.285
 1708    H    THR 106           H        THR 106   2.480  -0.358   3.223
 1709    HA   THR 106           HA       THR 106  -0.250   0.622   3.491
 1710    HB   THR 106           HB       THR 106  -0.330   0.094   0.997
 1711    HG1  THR 106           HG1      THR 106   2.105   0.139   0.308
 1712   HG21  THR 106          HG21      THR 106   0.976   2.077   0.396
 1713   HG22  THR 106          HG22      THR 106   1.755   2.046   1.978
 1714   HG23  THR 106          HG23      THR 106   0.023   2.358   1.854
 1715    H    ALA 107           H        ALA 107   1.466  -2.400   2.869
 1716    HA   ALA 107           HA       ALA 107  -0.913  -3.892   3.561
 1717    HB1  ALA 107           HB1      ALA 107  -1.229  -3.520   1.169
 1718    HB2  ALA 107           HB2      ALA 107  -0.926  -5.223   1.513
 1719    HB3  ALA 107           HB3      ALA 107   0.360  -4.217   0.848
 1720    H    CYS 108           H        CYS 108  -0.490  -6.152   3.884
 1721    HA   CYS 108           HA       CYS 108   2.339  -6.718   4.426
 1722    HB2  CYS 108           HB3      CYS 108   0.903  -6.887   6.400
 1723    HB3  CYS 108           HB2      CYS 108  -0.172  -7.994   5.545
 1724    H    VAL 109           H        VAL 109   3.280  -7.834   2.856
 1725    HA   VAL 109           HA       VAL 109   1.602  -9.516   1.142
 1726    HB   VAL 109           HB       VAL 109   3.372  -9.439  -0.500
 1727   HG11  VAL 109          HG11      VAL 109   1.853  -7.554  -0.489
 1728   HG12  VAL 109          HG12      VAL 109   3.469  -7.026  -0.954
 1729   HG13  VAL 109          HG13      VAL 109   2.873  -6.706   0.675
 1730   HG21  VAL 109          HG21      VAL 109   4.993  -7.907   1.534
 1731   HG22  VAL 109          HG22      VAL 109   5.458  -8.209  -0.139
 1732   HG23  VAL 109          HG23      VAL 109   5.302  -9.556   0.991
 1733    H    CYS 110           H        CYS 110   2.287 -11.637   0.580
 1734    HA   CYS 110           HA       CYS 110   3.988 -12.878   2.629
 1735    HB2  CYS 110           HB3      CYS 110   1.674 -13.731   2.576
 1736    HB3  CYS 110           HB2      CYS 110   1.866 -14.148   0.880
 1737    H    VAL 111           H        VAL 111   6.003 -12.975   1.845
 1738    HA   VAL 111           HA       VAL 111   6.481 -13.300  -0.977
 1739    HB   VAL 111           HB       VAL 111   8.860 -13.233  -0.440
 1740   HG11  VAL 111          HG11      VAL 111   7.277 -11.169   1.080
 1741   HG12  VAL 111          HG12      VAL 111   7.715 -11.110  -0.628
 1742   HG13  VAL 111          HG13      VAL 111   8.970 -11.014   0.607
 1743   HG21  VAL 111          HG21      VAL 111   9.673 -13.007   1.838
 1744   HG22  VAL 111          HG22      VAL 111   8.820 -14.537   1.628
 1745   HG23  VAL 111          HG23      VAL 111   8.032 -13.193   2.456
 1746    H    LEU 112           H        LEU 112   7.064 -15.123  -2.040
 1747    HA   LEU 112           HA       LEU 112   7.019 -17.597  -0.450
 1748    HB2  LEU 112           HB3      LEU 112   6.246 -17.139  -3.335
 1749    HB3  LEU 112           HB2      LEU 112   6.233 -18.694  -2.527
 1750    HG   LEU 112           HG       LEU 112   4.450 -16.329  -1.923
 1751   HD11  LEU 112          HD11      LEU 112   2.672 -17.882  -2.612
 1752   HD12  LEU 112          HD12      LEU 112   3.899 -19.068  -3.052
 1753   HD13  LEU 112          HD13      LEU 112   3.807 -17.531  -3.913
 1754   HD21  LEU 112          HD21      LEU 112   3.342 -17.855  -0.319
 1755   HD22  LEU 112          HD22      LEU 112   4.978 -17.409   0.159
 1756   HD23  LEU 112          HD23      LEU 112   4.666 -18.999  -0.538
 1757    H    SER 113           H        SER 113   8.670 -18.969  -0.569
 1758    HA   SER 113           HA       SER 113  10.185 -19.516  -2.855
 1759    HB2  SER 113           HB3      SER 113  12.412 -18.616  -2.073
 1760    HB3  SER 113           HB2      SER 113  11.271 -17.381  -2.600
 1761    HG   SER 113           HG       SER 113  10.731 -17.459  -0.160
 1762    H    ARG 114           H        ARG 114  10.316 -21.677  -2.415
 1763    HA   ARG 114           HA       ARG 114  11.456 -22.433   0.194
 1764    HB2  ARG 114           HB3      ARG 114   9.442 -23.638  -1.104
 1765    HB3  ARG 114           HB2      ARG 114  10.781 -24.497  -1.852
 1766    HG2  ARG 114           HG3      ARG 114  10.401 -24.297   1.127
 1767    HG3  ARG 114           HG2      ARG 114   9.752 -25.611   0.145
 1768    HD2  ARG 114           HD3      ARG 114  12.671 -24.869   0.303
 1769    HD3  ARG 114           HD2      ARG 114  11.911 -26.145   1.254
 1770    HE   ARG 114           HE       ARG 114  11.264 -26.849  -1.257
 1771   HH11  ARG 114          HH11      ARG 114  14.319 -25.924   0.187
 1772   HH12  ARG 114          HH12      ARG 114  15.262 -26.940  -0.856
 1773   HH21  ARG 114          HH21      ARG 114  12.508 -28.193  -2.626
 1774   HH22  ARG 114          HH22      ARG 114  14.234 -28.228  -2.451
 1775    H    LYS 115           H        LYS 115  12.016 -22.269  -3.194
 1776    HA   LYS 115           HA       LYS 115  14.811 -23.111  -2.830
 1777    HB2  LYS 115           HB3      LYS 115  13.078 -23.358  -5.309
 1778    HB3  LYS 115           HB2      LYS 115  14.755 -23.857  -5.184
 1779    HG2  LYS 115           HG3      LYS 115  14.132 -25.531  -3.512
 1780    HG3  LYS 115           HG2      LYS 115  12.444 -25.035  -3.661
 1781    HD2  LYS 115           HD3      LYS 115  14.143 -26.150  -5.885
 1782    HD3  LYS 115           HD2      LYS 115  12.927 -27.046  -4.978
 1783    HE2  LYS 115           HE3      LYS 115  11.214 -25.456  -5.770
 1784    HE3  LYS 115           HE2      LYS 115  12.451 -24.645  -6.731
 1785    HZ1  LYS 115           HZ1      LYS 115  11.604 -27.473  -7.039
 1786    HZ2  LYS 115           HZ2      LYS 115  12.783 -26.694  -7.965
 1787    HZ3  LYS 115           HZ3      LYS 115  11.170 -26.196  -8.061
 1788    H    ALA 116           H        ALA 116  16.369 -21.906  -3.976
 1789    HA   ALA 116           HA       ALA 116  15.765 -19.123  -4.194
 1790    HB1  ALA 116           HB1      ALA 116  18.284 -20.588  -4.973
 1791    HB2  ALA 116           HB2      ALA 116  17.930 -19.938  -3.373
 1792    HB3  ALA 116           HB3      ALA 116  18.114 -18.847  -4.746
 1793    H    THR 117           H        THR 117  15.606 -21.728  -6.355
 1794    HA   THR 117           HA       THR 117  15.703 -19.977  -8.696
 1795    HB   THR 117           HB       THR 117  15.351 -22.196  -9.931
 1796    HG1  THR 117           HG1      THR 117  16.336 -23.371  -7.552
 1797   HG21  THR 117          HG21      THR 117  17.862 -21.792  -8.302
 1798   HG22  THR 117          HG22      THR 117  17.508 -21.064  -9.870
 1799   HG23  THR 117          HG23      THR 117  17.726 -22.809  -9.736
 1800    H    ARG 118           H        ARG 118  13.923 -19.636  -9.995
 1801    HA   ARG 118           HA       ARG 118  11.391 -20.858  -9.359
 1802    HB2  ARG 118           HB3      ARG 118  10.465 -18.336  -9.231
 1803    HB3  ARG 118           HB2      ARG 118  10.903 -19.259  -7.809
 1804    HG2  ARG 118           HG3      ARG 118  11.795 -17.053  -7.607
 1805    HG3  ARG 118           HG2      ARG 118  13.127 -18.182  -7.830
 1806    HD2  ARG 118           HD3      ARG 118  13.561 -16.233  -9.151
 1807    HD3  ARG 118           HD2      ARG 118  13.168 -17.562 -10.240
 1808    HE   ARG 118           HE       ARG 118  10.792 -16.261  -9.803
 1809   HH11  ARG 118          HH11      ARG 118  13.937 -15.387 -11.064
 1810   HH12  ARG 118          HH12      ARG 118  13.316 -14.152 -12.109
 1811   HH21  ARG 118          HH21      ARG 118   9.971 -14.639 -11.181
 1812   HH22  ARG 118          HH22      ARG 118  11.058 -13.740 -12.189
  Start of MODEL   16
    1    H1   SER   1           H1       SER   1  25.501  -0.504   8.745
    2    H2   SER   1           H2       SER   1  25.087  -1.553   7.489
    3    H3   SER   1           H3       SER   1  25.064  -2.100   9.087
    4    HA   SER   1           HA       SER   1  23.272  -0.612   9.612
    5    HB2  SER   1           HB3      SER   1  22.149   0.544   7.658
    6    HB3  SER   1           HB2      SER   1  23.721   1.202   8.110
    7    HG   SER   1           HG       SER   1  24.205   0.888   6.090
    8    H    SER   2           H        SER   2  21.536  -1.858   9.910
    9    HA   SER   2           HA       SER   2  20.984  -3.930   7.889
   10    HB2  SER   2           HB3      SER   2  19.966  -5.184   9.878
   11    HB3  SER   2           HB2      SER   2  21.723  -5.019   9.864
   12    HG   SER   2           HG       SER   2  21.612  -3.901  11.634
   13    H    THR   3           H        THR   3  19.871  -1.451   7.498
   14    HA   THR   3           HA       THR   3  17.266  -1.221   8.645
   15    HB   THR   3           HB       THR   3  16.929   0.395   6.664
   16    HG1  THR   3           HG1      THR   3  19.302   1.028   6.057
   17   HG21  THR   3          HG21      THR   3  18.289   2.132   7.740
   18   HG22  THR   3          HG22      THR   3  19.158   0.892   8.644
   19   HG23  THR   3          HG23      THR   3  17.437   1.150   8.932
   20    H    HIS   4           H        HIS   4  18.628  -2.806   5.876
   21    HA   HIS   4           HA       HIS   4  16.027  -4.024   5.355
   22    HB2  HIS   4           HB3      HIS   4  16.517  -3.862   2.856
   23    HB3  HIS   4           HB2      HIS   4  16.017  -2.380   3.655
   24    HD1  HIS   4           HD1      HIS   4  17.816  -0.512   3.917
   25    HD2  HIS   4           HD2      HIS   4  19.082  -3.840   1.774
   26    HE1  HIS   4           HE1      HIS   4  19.935   0.194   2.769
   27    HE2  HIS   4           HE2      HIS   4  20.782  -1.896   1.647
   28    HA   PRO   5           HA       PRO   5  19.460  -7.103   5.587
   29    HB2  PRO   5           HB3      PRO   5  18.220  -8.802   7.298
   30    HB3  PRO   5           HB2      PRO   5  19.152  -7.405   7.851
   31    HG2  PRO   5           HG3      PRO   5  16.197  -7.748   7.614
   32    HG3  PRO   5           HG2      PRO   5  17.130  -6.893   8.853
   33    HD2  PRO   5           HD3      PRO   5  15.819  -5.666   6.765
   34    HD3  PRO   5           HD2      PRO   5  17.200  -4.964   7.629
   35    H    VAL   6           H        VAL   6  19.010  -7.590   3.416
   36    HA   VAL   6           HA       VAL   6  18.208  -8.726   1.622
   37    HB   VAL   6           HB       VAL   6  17.241 -10.848   3.537
   38   HG11  VAL   6          HG11      VAL   6  17.797 -12.369   1.706
   39   HG12  VAL   6          HG12      VAL   6  18.339 -11.002   0.732
   40   HG13  VAL   6          HG13      VAL   6  16.642 -11.143   1.189
   41   HG21  VAL   6          HG21      VAL   6  19.508 -10.267   4.202
   42   HG22  VAL   6          HG22      VAL   6  20.058 -10.443   2.536
   43   HG23  VAL   6          HG23      VAL   6  19.478 -11.851   3.427
   44    H    PHE   7           H        PHE   7  16.613  -6.750   2.450
   45    HA   PHE   7           HA       PHE   7  13.922  -7.678   2.943
   46    HB2  PHE   7           HB3      PHE   7  14.975  -5.531   3.887
   47    HB3  PHE   7           HB2      PHE   7  14.730  -4.848   2.285
   48    HD1  PHE   7           HD1      PHE   7  12.590  -7.026   4.425
   49    HD2  PHE   7           HD2      PHE   7  13.029  -3.311   2.399
   50    HE1  PHE   7           HE1      PHE   7  10.296  -6.418   5.058
   51    HE2  PHE   7           HE2      PHE   7  10.731  -2.695   3.024
   52    HZ   PHE   7           HZ       PHE   7   9.360  -4.246   4.354
   53    H    HIS   8           H        HIS   8  15.798  -7.604   0.305
   54    HA   HIS   8           HA       HIS   8  14.087  -6.714  -1.744
   55    HB2  HIS   8           HB3      HIS   8  16.470  -7.231  -2.113
   56    HB3  HIS   8           HB2      HIS   8  16.153  -8.932  -1.805
   57    HD1  HIS   8           HD1      HIS   8  15.699  -6.266  -4.399
   58    HD2  HIS   8           HD2      HIS   8  15.021 -10.342  -3.939
   59    HE1  HIS   8           HE1      HIS   8  15.160  -7.126  -6.698
   60    HE2  HIS   8           HE2      HIS   8  14.789  -9.600  -6.408
   61    H    MET   9           H        MET   9  14.073  -9.516   0.273
   62    HA   MET   9           HA       MET   9  12.400 -11.158  -1.327
   63    HB2  MET   9           HB3      MET   9  12.849 -11.110   1.662
   64    HB3  MET   9           HB2      MET   9  11.899 -12.336   0.835
   65    HG2  MET   9           HG3      MET   9  13.887 -12.983  -0.453
   66    HG3  MET   9           HG2      MET   9  14.832 -11.783   0.422
   67    HE1  MET   9           HE1      MET   9  15.258 -11.923   3.099
   68    HE2  MET   9           HE2      MET   9  14.599 -13.215   4.103
   69    HE3  MET   9           HE3      MET   9  13.516 -12.052   3.338
   70    H    GLY  10           H        GLY  10  11.852  -8.352   0.548
   71    HA2  GLY  10           HA3      GLY  10   9.053  -8.795   1.053
   72    HA3  GLY  10           HA2      GLY  10   9.927  -7.289   1.266
   73    H    GLU  11           H        GLU  11  10.698  -8.248  -1.735
   74    HA   GLU  11           HA       GLU  11   8.644  -6.561  -2.955
   75    HB2  GLU  11           HB3      GLU  11  11.164  -7.724  -4.178
   76    HB3  GLU  11           HB2      GLU  11  10.105  -6.523  -4.916
   77    HG2  GLU  11           HG3      GLU  11  11.748  -6.129  -2.414
   78    HG3  GLU  11           HG2      GLU  11  12.138  -5.513  -4.020
   79    H    PHE  12           H        PHE  12   8.806  -9.647  -2.141
   80    HA   PHE  12           HA       PHE  12   7.859 -10.769  -4.666
   81    HB2  PHE  12           HB3      PHE  12   8.621 -12.012  -2.025
   82    HB3  PHE  12           HB2      PHE  12   7.772 -12.922  -3.269
   83    HD1  PHE  12           HD1      PHE  12  10.870 -10.978  -2.631
   84    HD2  PHE  12           HD2      PHE  12   8.921 -13.903  -5.029
   85    HE1  PHE  12           HE1      PHE  12  13.008 -11.500  -3.726
   86    HE2  PHE  12           HE2      PHE  12  11.055 -14.428  -6.131
   87    HZ   PHE  12           HZ       PHE  12  13.100 -13.227  -5.479
   88    H    SER  13           H        SER  13   5.815 -11.441  -5.007
   89    HA   SER  13           HA       SER  13   3.892 -11.347  -2.821
   90    HB2  SER  13           HB3      SER  13   3.817  -9.102  -3.864
   91    HB3  SER  13           HB2      SER  13   3.527  -9.845  -5.432
   92    HG   SER  13           HG       SER  13   1.614  -9.084  -4.283
   93    H    VAL  14           H        VAL  14   1.902 -12.441  -3.366
   94    HA   VAL  14           HA       VAL  14   2.350 -14.825  -4.867
   95    HB   VAL  14           HB       VAL  14  -0.003 -15.374  -4.298
   96   HG11  VAL  14          HG11      VAL  14   1.646 -14.331  -1.998
   97   HG12  VAL  14          HG12      VAL  14   1.770 -15.931  -2.730
   98   HG13  VAL  14          HG13      VAL  14   0.304 -15.468  -1.864
   99   HG21  VAL  14          HG21      VAL  14  -1.290 -13.882  -2.860
  100   HG22  VAL  14          HG22      VAL  14  -0.931 -13.112  -4.407
  101   HG23  VAL  14          HG23      VAL  14  -0.017 -12.665  -2.967
  102    H    CYS  15           H        CYS  15   1.418 -11.745  -5.743
  103    HA   CYS  15           HA       CYS  15   0.583 -12.724  -8.367
  104    HB2  CYS  15           HB3      CYS  15  -1.458 -12.056  -7.094
  105    HB3  CYS  15           HB2      CYS  15  -0.782 -10.432  -6.933
  106    H    ASP  16           H        ASP  16   1.399 -11.576 -10.048
  107    HA   ASP  16           HA       ASP  16   3.725 -10.072  -9.656
  108    HB2  ASP  16           HB3      ASP  16   1.938 -10.375 -12.076
  109    HB3  ASP  16           HB2      ASP  16   3.458  -9.491 -12.114
  110    H    SER  17           H        SER  17   3.962  -8.094  -8.952
  111    HA   SER  17           HA       SER  17   1.724  -6.207  -9.251
  112    HB2  SER  17           HB3      SER  17   3.851  -6.285  -7.095
  113    HB3  SER  17           HB2      SER  17   2.457  -5.202  -7.153
  114    HG   SER  17           HG       SER  17   2.056  -7.988  -7.227
  115    H    VAL  18           H        VAL  18   2.109  -4.152  -9.970
  116    HA   VAL  18           HA       VAL  18   4.883  -3.519 -10.717
  117    HB   VAL  18           HB       VAL  18   3.627  -3.852 -12.728
  118   HG11  VAL  18          HG11      VAL  18   1.630  -1.868 -11.654
  119   HG12  VAL  18          HG12      VAL  18   1.378  -3.600 -11.867
  120   HG13  VAL  18          HG13      VAL  18   1.616  -2.565 -13.274
  121   HG21  VAL  18          HG21      VAL  18   3.804  -1.631 -13.780
  122   HG22  VAL  18          HG22      VAL  18   5.213  -2.037 -12.803
  123   HG23  VAL  18          HG23      VAL  18   4.004  -0.914 -12.181
  124    H    SER  19           H        SER  19   5.704  -1.978  -9.476
  125    HA   SER  19           HA       SER  19   3.937  -0.087  -8.134
  126    HB2  SER  19           HB3      SER  19   6.923  -0.530  -7.847
  127    HB3  SER  19           HB2      SER  19   5.942   0.533  -6.837
  128    HG   SER  19           HG       SER  19   4.773  -1.290  -6.143
  129    H    VAL  20           H        VAL  20   3.480   1.784  -9.057
  130    HA   VAL  20           HA       VAL  20   5.462   2.988 -10.880
  131    HB   VAL  20           HB       VAL  20   2.455   3.236 -11.032
  132   HG11  VAL  20          HG11      VAL  20   4.608   4.178 -12.913
  133   HG12  VAL  20          HG12      VAL  20   3.585   5.191 -11.892
  134   HG13  VAL  20          HG13      VAL  20   2.873   4.266 -13.214
  135   HG21  VAL  20          HG21      VAL  20   3.136   0.979 -11.594
  136   HG22  VAL  20          HG22      VAL  20   4.330   1.604 -12.735
  137   HG23  VAL  20          HG23      VAL  20   2.608   1.840 -13.040
  138    H    TRP  21           H        TRP  21   6.012   5.071 -10.523
  139    HA   TRP  21           HA       TRP  21   4.611   6.550  -8.427
  140    HB2  TRP  21           HB3      TRP  21   7.229   7.040  -9.864
  141    HB3  TRP  21           HB2      TRP  21   6.500   8.218  -8.778
  142    HD1  TRP  21           HD1      TRP  21   8.398   4.920  -8.782
  143    HE1  TRP  21           HE1      TRP  21   9.077   4.340  -6.369
  144    HE3  TRP  21           HE3      TRP  21   5.740   8.523  -6.300
  145    HZ2  TRP  21           HZ2      TRP  21   8.554   5.283  -3.759
  146    HZ3  TRP  21           HZ3      TRP  21   5.885   8.612  -3.843
  147    HH2  TRP  21           HH2      TRP  21   7.262   7.026  -2.604
  148    H    VAL  22           H        VAL  22   2.785   7.310  -9.302
  149    HA   VAL  22           HA       VAL  22   2.741   8.173 -12.066
  150    HB   VAL  22           HB       VAL  22   0.463   8.167 -10.086
  151   HG11  VAL  22          HG11      VAL  22  -0.938   8.073 -12.090
  152   HG12  VAL  22          HG12      VAL  22   0.505   8.157 -13.099
  153   HG13  VAL  22          HG13      VAL  22   0.072   9.520 -12.068
  154   HG21  VAL  22          HG21      VAL  22   1.413   5.932 -10.229
  155   HG22  VAL  22          HG22      VAL  22   1.320   5.991 -11.989
  156   HG23  VAL  22          HG23      VAL  22  -0.159   5.993 -11.028
  157    H    GLY  23           H        GLY  23   3.399  10.151 -12.500
  158    HA2  GLY  23           HA3      GLY  23   2.518  12.355 -10.748
  159    HA3  GLY  23           HA2      GLY  23   3.910  12.425 -11.831
  160    H    ASP  24           H        ASP  24   1.304  10.783 -13.157
  161    HA   ASP  24           HA       ASP  24   0.378  13.176 -14.599
  162    HB2  ASP  24           HB3      ASP  24   0.988  10.427 -15.702
  163    HB3  ASP  24           HB2      ASP  24   0.025  11.614 -16.577
  164    H    LYS  25           H        LYS  25  -0.717  11.876 -12.241
  165    HA   LYS  25           HA       LYS  25  -3.078  10.494 -13.206
  166    HB2  LYS  25           HB3      LYS  25  -1.767   9.904 -11.066
  167    HB3  LYS  25           HB2      LYS  25  -2.542  11.314 -10.357
  168    HG2  LYS  25           HG3      LYS  25  -4.728  10.351 -10.780
  169    HG3  LYS  25           HG2      LYS  25  -3.974   8.943 -11.531
  170    HD2  LYS  25           HD3      LYS  25  -2.763   8.596  -9.334
  171    HD3  LYS  25           HD2      LYS  25  -3.849   9.810  -8.656
  172    HE2  LYS  25           HE3      LYS  25  -4.754   7.622  -8.201
  173    HE3  LYS  25           HE2      LYS  25  -5.775   8.427  -9.394
  174    HZ1  LYS  25           HZ1      LYS  25  -3.675   6.410 -10.004
  175    HZ2  LYS  25           HZ2      LYS  25  -4.693   7.159 -11.135
  176    HZ3  LYS  25           HZ3      LYS  25  -5.345   6.117  -9.976
  177    H    THR  26           H        THR  26  -4.510  11.844 -14.131
  178    HA   THR  26           HA       THR  26  -4.961  14.458 -12.882
  179    HB   THR  26           HB       THR  26  -4.310  14.553 -15.233
  180    HG1  THR  26           HG1      THR  26  -6.820  15.415 -14.356
  181   HG21  THR  26          HG21      THR  26  -5.145  12.409 -15.998
  182   HG22  THR  26          HG22      THR  26  -5.832  13.702 -16.978
  183   HG23  THR  26          HG23      THR  26  -6.806  12.932 -15.726
  184    H    THR  27           H        THR  27  -6.321  11.427 -12.978
  185    HA   THR  27           HA       THR  27  -8.865  12.507 -12.036
  186    HB   THR  27           HB       THR  27  -9.951  10.473 -13.257
  187    HG1  THR  27           HG1      THR  27  -8.270  10.883 -15.377
  188   HG21  THR  27          HG21      THR  27 -10.554  12.773 -13.712
  189   HG22  THR  27          HG22      THR  27 -10.408  11.885 -15.229
  190   HG23  THR  27          HG23      THR  27  -9.120  12.979 -14.717
  191    H    ALA  28           H        ALA  28  -9.602  11.527 -10.257
  192    HA   ALA  28           HA       ALA  28  -8.926   8.746  -9.742
  193    HB1  ALA  28           HB1      ALA  28  -8.158  10.889  -7.766
  194    HB2  ALA  28           HB2      ALA  28  -7.032   9.962  -8.759
  195    HB3  ALA  28           HB3      ALA  28  -8.005   9.145  -7.534
  196    H    THR  29           H        THR  29  -9.979   8.028  -7.647
  197    HA   THR  29           HA       THR  29 -12.669   9.163  -7.592
  198    HB   THR  29           HB       THR  29 -11.758   6.589  -6.310
  199    HG1  THR  29           HG1      THR  29 -11.852   7.143  -8.904
  200   HG21  THR  29          HG21      THR  29 -14.125   5.991  -6.493
  201   HG22  THR  29          HG22      THR  29 -14.467   7.561  -7.220
  202   HG23  THR  29          HG23      THR  29 -13.912   7.464  -5.548
  203    H    ASP  30           H        ASP  30 -13.232  10.447  -6.032
  204    HA   ASP  30           HA       ASP  30 -11.711  11.010  -3.708
  205    HB2  ASP  30           HB3      ASP  30 -13.283  12.624  -4.747
  206    HB3  ASP  30           HB2      ASP  30 -14.634  11.569  -4.334
  207    H    ILE  31           H        ILE  31 -12.499  10.666  -1.460
  208    HA   ILE  31           HA       ILE  31 -12.914   7.956  -0.913
  209    HB   ILE  31           HB       ILE  31 -11.854   9.445   0.697
  210   HG12  ILE  31          HG13      ILE  31 -14.430   8.306   1.809
  211   HG13  ILE  31          HG12      ILE  31 -12.950   7.393   1.534
  212   HG21  ILE  31          HG21      ILE  31 -13.131  11.464   0.289
  213   HG22  ILE  31          HG22      ILE  31 -13.154  11.059   2.006
  214   HG23  ILE  31          HG23      ILE  31 -14.566  10.727   1.002
  215   HD11  ILE  31          HD11      ILE  31 -13.297   9.677   3.463
  216   HD12  ILE  31          HD12      ILE  31 -11.797   8.796   3.174
  217   HD13  ILE  31          HD13      ILE  31 -13.188   7.964   3.870
  218    H    LYS  32           H        LYS  32 -15.172  10.519  -1.516
  219    HA   LYS  32           HA       LYS  32 -17.446   9.138  -0.413
  220    HB2  LYS  32           HB3      LYS  32 -17.262  11.543  -2.230
  221    HB3  LYS  32           HB2      LYS  32 -18.730  10.981  -1.439
  222    HG2  LYS  32           HG3      LYS  32 -17.790  11.441   0.730
  223    HG3  LYS  32           HG2      LYS  32 -16.243  11.869   0.001
  224    HD2  LYS  32           HD3      LYS  32 -17.314  13.728  -1.159
  225    HD3  LYS  32           HD2      LYS  32 -18.857  13.315  -0.407
  226    HE2  LYS  32           HE3      LYS  32 -17.912  13.730   1.791
  227    HE3  LYS  32           HE2      LYS  32 -16.342  14.070   1.068
  228    HZ1  LYS  32           HZ1      LYS  32 -17.320  15.967  -0.067
  229    HZ2  LYS  32           HZ2      LYS  32 -17.513  16.100   1.608
  230    HZ3  LYS  32           HZ3      LYS  32 -18.821  15.642   0.641
  231    H    GLY  33           H        GLY  33 -15.658   8.798  -3.228
  232    HA2  GLY  33           HA3      GLY  33 -16.101   7.019  -4.744
  233    HA3  GLY  33           HA2      GLY  33 -17.819   7.187  -4.397
  234    H    LYS  34           H        LYS  34 -16.256  10.149  -4.879
  235    HA   LYS  34           HA       LYS  34 -17.600  10.485  -7.435
  236    HB2  LYS  34           HB3      LYS  34 -16.030  12.454  -5.762
  237    HB3  LYS  34           HB2      LYS  34 -16.975  12.853  -7.188
  238    HG2  LYS  34           HG3      LYS  34 -18.070  11.743  -4.616
  239    HG3  LYS  34           HG2      LYS  34 -18.132  13.429  -5.119
  240    HD2  LYS  34           HD3      LYS  34 -19.425  12.725  -7.120
  241    HD3  LYS  34           HD2      LYS  34 -19.449  11.086  -6.472
  242    HE2  LYS  34           HE3      LYS  34 -20.582  11.925  -4.460
  243    HE3  LYS  34           HE2      LYS  34 -20.615  13.536  -5.164
  244    HZ1  LYS  34           HZ1      LYS  34 -21.936  11.133  -6.301
  245    HZ2  LYS  34           HZ2      LYS  34 -21.974  12.688  -6.968
  246    HZ3  LYS  34           HZ3      LYS  34 -22.713  12.387  -5.478
  247    H    GLU  35           H        GLU  35 -16.519  11.293  -9.302
  248    HA   GLU  35           HA       GLU  35 -13.692  10.515  -9.423
  249    HB2  GLU  35           HB3      GLU  35 -15.156   9.440 -11.073
  250    HB3  GLU  35           HB2      GLU  35 -15.682  11.017 -11.646
  251    HG2  GLU  35           HG3      GLU  35 -13.527  11.504 -12.526
  252    HG3  GLU  35           HG2      GLU  35 -12.828  10.080 -11.759
  253    H    VAL  36           H        VAL  36 -12.257  12.090  -9.256
  254    HA   VAL  36           HA       VAL  36 -13.081  14.799 -10.052
  255    HB   VAL  36           HB       VAL  36 -11.781  15.683  -8.125
  256   HG11  VAL  36          HG11      VAL  36 -14.195  15.492  -7.980
  257   HG12  VAL  36          HG12      VAL  36 -13.460  15.134  -6.418
  258   HG13  VAL  36          HG13      VAL  36 -14.049  13.820  -7.437
  259   HG21  VAL  36          HG21      VAL  36 -11.721  12.797  -7.248
  260   HG22  VAL  36          HG22      VAL  36 -11.208  14.183  -6.284
  261   HG23  VAL  36          HG23      VAL  36 -10.328  13.755  -7.751
  262    H    THR  37           H        THR  37 -11.355  16.274 -10.491
  263    HA   THR  37           HA       THR  37  -9.248  15.026 -12.015
  264    HB   THR  37           HB       THR  37  -9.852  17.957 -11.607
  265    HG1  THR  37           HG1      THR  37 -11.538  16.628 -12.624
  266   HG21  THR  37          HG21      THR  37  -7.573  17.542 -12.401
  267   HG22  THR  37          HG22      THR  37  -8.558  18.280 -13.664
  268   HG23  THR  37          HG23      THR  37  -8.206  16.553 -13.715
  269    H    VAL  38           H        VAL  38  -7.457  14.426 -11.034
  270    HA   VAL  38           HA       VAL  38  -6.572  15.683  -8.586
  271    HB   VAL  38           HB       VAL  38  -5.288  13.456 -10.177
  272   HG11  VAL  38          HG11      VAL  38  -3.693  14.557  -8.721
  273   HG12  VAL  38          HG12      VAL  38  -4.095  12.960  -8.086
  274   HG13  VAL  38          HG13      VAL  38  -4.802  14.403  -7.358
  275   HG21  VAL  38          HG21      VAL  38  -7.092  13.330  -7.771
  276   HG22  VAL  38          HG22      VAL  38  -6.279  11.959  -8.523
  277   HG23  VAL  38          HG23      VAL  38  -7.515  12.847  -9.413
  278    H    LEU  39           H        LEU  39  -4.923  17.075  -8.386
  279    HA   LEU  39           HA       LEU  39  -3.605  17.930 -10.858
  280    HB2  LEU  39           HB3      LEU  39  -3.775  19.361  -8.201
  281    HB3  LEU  39           HB2      LEU  39  -3.137  20.016  -9.699
  282    HG   LEU  39           HG       LEU  39  -6.014  19.260  -9.202
  283   HD11  LEU  39          HD11      LEU  39  -4.668  21.943  -9.414
  284   HD12  LEU  39          HD12      LEU  39  -5.391  21.237  -7.969
  285   HD13  LEU  39          HD13      LEU  39  -6.410  21.680  -9.338
  286   HD21  LEU  39          HD21      LEU  39  -5.428  18.921 -11.520
  287   HD22  LEU  39          HD22      LEU  39  -4.687  20.518 -11.594
  288   HD23  LEU  39          HD23      LEU  39  -6.428  20.365 -11.361
  289    H    ALA  40           H        ALA  40  -1.627  17.219 -11.174
  290    HA   ALA  40           HA       ALA  40  -0.072  15.984  -9.112
  291    HB1  ALA  40           HB1      ALA  40   0.003  15.248 -11.470
  292    HB2  ALA  40           HB2      ALA  40   1.598  15.654 -10.839
  293    HB3  ALA  40           HB3      ALA  40   0.757  16.782 -11.903
  294    H    GLU  41           H        GLU  41  -0.566  19.115 -10.210
  295    HA   GLU  41           HA       GLU  41   1.859  20.137  -8.903
  296    HB2  GLU  41           HB3      GLU  41  -0.179  21.718 -10.479
  297    HB3  GLU  41           HB2      GLU  41   1.467  22.183 -10.075
  298    HG2  GLU  41           HG3      GLU  41   0.760  19.919 -11.920
  299    HG3  GLU  41           HG2      GLU  41   1.109  21.560 -12.456
  300    H    VAL  42           H        VAL  42   1.522  20.632  -6.786
  301    HA   VAL  42           HA       VAL  42  -1.229  21.136  -5.971
  302    HB   VAL  42           HB       VAL  42  -0.463  20.806  -3.644
  303   HG11  VAL  42          HG11      VAL  42   0.184  18.591  -5.579
  304   HG12  VAL  42          HG12      VAL  42  -1.396  18.958  -4.886
  305   HG13  VAL  42          HG13      VAL  42  -0.089  18.382  -3.849
  306   HG21  VAL  42          HG21      VAL  42   1.874  21.480  -3.900
  307   HG22  VAL  42          HG22      VAL  42   2.175  20.054  -4.895
  308   HG23  VAL  42          HG23      VAL  42   1.737  19.868  -3.198
  309    H    ASN  43           H        ASN  43  -1.829  23.113  -6.087
  310    HA   ASN  43           HA       ASN  43  -0.055  25.326  -5.456
  311    HB2  ASN  43           HB3      ASN  43  -2.986  25.338  -6.257
  312    HB3  ASN  43           HB2      ASN  43  -1.939  26.749  -6.154
  313   HD21  ASN  43          HD21      ASN  43  -2.804  23.949  -8.000
  314   HD22  ASN  43          HD22      ASN  43  -1.898  24.349  -9.415
  315    H    ILE  44           H        ILE  44   0.281  25.395  -3.279
  316    HA   ILE  44           HA       ILE  44  -1.942  24.919  -1.469
  317    HB   ILE  44           HB       ILE  44   0.912  25.692  -0.814
  318   HG12  ILE  44          HG13      ILE  44  -0.420  22.972  -0.774
  319   HG13  ILE  44          HG12      ILE  44   0.724  23.514  -1.998
  320   HG21  ILE  44          HG21      ILE  44  -1.261  24.554   0.942
  321   HG22  ILE  44          HG22      ILE  44  -0.706  26.227   0.954
  322   HG23  ILE  44          HG23      ILE  44   0.388  24.933   1.437
  323   HD11  ILE  44          HD11      ILE  44   2.455  23.710  -0.278
  324   HD12  ILE  44          HD12      ILE  44   1.802  22.074  -0.376
  325   HD13  ILE  44          HD13      ILE  44   1.305  23.144   0.933
  326    H    ASN  45           H        ASN  45   0.477  27.522  -1.710
  327    HA   ASN  45           HA       ASN  45  -1.488  29.554  -1.885
  328    HB2  ASN  45           HB3      ASN  45  -1.054  30.734   0.228
  329    HB3  ASN  45           HB2      ASN  45  -1.757  29.151   0.515
  330   HD21  ASN  45          HD21      ASN  45   0.742  27.706   0.135
  331   HD22  ASN  45          HD22      ASN  45   1.722  28.048   1.514
  332    H    ASN  46           H        ASN  46  -0.327  30.090  -3.662
  333    HA   ASN  46           HA       ASN  46   1.265  31.067  -4.947
  334    HB2  ASN  46           HB3      ASN  46   2.064  32.334  -2.315
  335    HB3  ASN  46           HB2      ASN  46   2.714  32.807  -3.880
  336   HD21  ASN  46          HD21      ASN  46   1.378  33.872  -5.354
  337   HD22  ASN  46          HD22      ASN  46  -0.092  34.636  -4.863
  338    H    SER  47           H        SER  47   1.756  28.484  -4.124
  339    HA   SER  47           HA       SER  47   4.565  28.266  -4.541
  340    HB2  SER  47           HB3      SER  47   4.408  28.739  -2.056
  341    HB3  SER  47           HB2      SER  47   3.518  27.225  -1.895
  342    HG   SER  47           HG       SER  47   5.950  27.283  -1.601
  343    H    VAL  48           H        VAL  48   4.703  26.602  -5.884
  344    HA   VAL  48           HA       VAL  48   2.672  24.478  -5.721
  345    HB   VAL  48           HB       VAL  48   4.297  25.292  -8.136
  346   HG11  VAL  48          HG11      VAL  48   1.918  23.459  -7.884
  347   HG12  VAL  48          HG12      VAL  48   3.586  22.963  -8.169
  348   HG13  VAL  48          HG13      VAL  48   2.727  23.906  -9.386
  349   HG21  VAL  48          HG21      VAL  48   1.427  25.933  -7.476
  350   HG22  VAL  48          HG22      VAL  48   2.245  26.297  -8.995
  351   HG23  VAL  48          HG23      VAL  48   2.767  27.078  -7.503
  352    H    PHE  49           H        PHE  49   3.326  22.428  -5.436
  353    HA   PHE  49           HA       PHE  49   6.193  21.832  -5.742
  354    HB2  PHE  49           HB3      PHE  49   4.315  20.824  -3.586
  355    HB3  PHE  49           HB2      PHE  49   5.940  20.201  -3.856
  356    HD1  PHE  49           HD1      PHE  49   3.952  22.786  -2.338
  357    HD2  PHE  49           HD2      PHE  49   7.896  21.722  -3.527
  358    HE1  PHE  49           HE1      PHE  49   4.866  24.518  -0.846
  359    HE2  PHE  49           HE2      PHE  49   8.815  23.452  -2.042
  360    HZ   PHE  49           HZ       PHE  49   7.301  24.851  -0.699
  361    H    ARG  50           H        ARG  50   6.719  19.866  -6.643
  362    HA   ARG  50           HA       ARG  50   4.475  18.380  -7.827
  363    HB2  ARG  50           HB3      ARG  50   7.356  18.666  -8.676
  364    HB3  ARG  50           HB2      ARG  50   6.285  17.454  -9.360
  365    HG2  ARG  50           HG3      ARG  50   4.765  19.296 -10.055
  366    HG3  ARG  50           HG2      ARG  50   5.997  20.439  -9.521
  367    HD2  ARG  50           HD3      ARG  50   7.560  19.603 -11.130
  368    HD3  ARG  50           HD2      ARG  50   6.483  18.273 -11.558
  369    HE   ARG  50           HE       ARG  50   5.002  20.494 -12.071
  370   HH11  ARG  50          HH11      ARG  50   8.177  19.408 -13.086
  371   HH12  ARG  50          HH12      ARG  50   8.100  20.211 -14.620
  372   HH21  ARG  50          HH21      ARG  50   4.895  21.537 -14.090
  373   HH22  ARG  50          HH22      ARG  50   6.228  21.422 -15.193
  374    H    GLN  51           H        GLN  51   4.142  16.313  -7.324
  375    HA   GLN  51           HA       GLN  51   6.267  14.628  -6.408
  376    HB2  GLN  51           HB3      GLN  51   5.412  14.067  -4.245
  377    HB3  GLN  51           HB2      GLN  51   5.582  15.810  -4.311
  378    HG2  GLN  51           HG3      GLN  51   2.971  14.399  -4.765
  379    HG3  GLN  51           HG2      GLN  51   3.526  14.917  -3.179
  380   HE21  GLN  51          HE21      GLN  51   4.747  17.376  -4.199
  381   HE22  GLN  51          HE22      GLN  51   3.429  18.437  -4.583
  382    H    TYR  52           H        TYR  52   5.618  12.384  -6.332
  383    HA   TYR  52           HA       TYR  52   3.381  11.972  -8.202
  384    HB2  TYR  52           HB3      TYR  52   5.707  10.085  -7.833
  385    HB3  TYR  52           HB2      TYR  52   4.614  10.211  -9.205
  386    HD1  TYR  52           HD1      TYR  52   4.659  12.928 -10.042
  387    HD2  TYR  52           HD2      TYR  52   7.853  10.630  -8.425
  388    HE1  TYR  52           HE1      TYR  52   6.278  14.393 -11.171
  389    HE2  TYR  52           HE2      TYR  52   9.477  12.090  -9.550
  390    HH   TYR  52           HH       TYR  52   9.552  13.615 -11.499
  391    H    PHE  53           H        PHE  53   2.271   9.885  -8.059
  392    HA   PHE  53           HA       PHE  53   1.879   9.150  -5.245
  393    HB2  PHE  53           HB3      PHE  53   0.131   8.570  -7.652
  394    HB3  PHE  53           HB2      PHE  53  -0.283   8.254  -5.968
  395    HD1  PHE  53           HD1      PHE  53  -0.520  10.211  -4.400
  396    HD2  PHE  53           HD2      PHE  53  -0.270  10.660  -8.623
  397    HE1  PHE  53           HE1      PHE  53  -1.486  12.465  -4.211
  398    HE2  PHE  53           HE2      PHE  53  -1.233  12.916  -8.446
  399    HZ   PHE  53           HZ       PHE  53  -1.840  13.822  -6.238
  400    H    PHE  54           H        PHE  54   2.289   7.154  -4.490
  401    HA   PHE  54           HA       PHE  54   3.673   5.289  -6.226
  402    HB2  PHE  54           HB3      PHE  54   4.564   5.776  -3.978
  403    HB3  PHE  54           HB2      PHE  54   3.075   5.182  -3.252
  404    HD1  PHE  54           HD1      PHE  54   2.824   2.911  -2.735
  405    HD2  PHE  54           HD2      PHE  54   5.992   4.152  -5.293
  406    HE1  PHE  54           HE1      PHE  54   3.795   0.658  -2.614
  407    HE2  PHE  54           HE2      PHE  54   6.969   1.896  -5.177
  408    HZ   PHE  54           HZ       PHE  54   5.870   0.146  -3.837
  409    H    GLU  55           H        GLU  55   2.242   4.255  -7.535
  410    HA   GLU  55           HA       GLU  55   0.012   2.852  -6.216
  411    HB2  GLU  55           HB3      GLU  55   0.204   3.703  -9.121
  412    HB3  GLU  55           HB2      GLU  55  -1.151   2.860  -8.383
  413    HG2  GLU  55           HG3      GLU  55  -1.281   4.903  -6.811
  414    HG3  GLU  55           HG2      GLU  55  -0.269   5.701  -8.017
  415    H    THR  56           H        THR  56   0.548   0.818  -5.891
  416    HA   THR  56           HA       THR  56   2.084  -0.635  -7.912
  417    HB   THR  56           HB       THR  56   1.305  -1.489  -5.114
  418    HG1  THR  56           HG1      THR  56   2.886  -0.059  -4.781
  419   HG21  THR  56          HG21      THR  56   3.170  -2.777  -7.115
  420   HG22  THR  56          HG22      THR  56   1.590  -3.393  -6.625
  421   HG23  THR  56          HG23      THR  56   2.908  -3.316  -5.456
  422    H    LYS  57           H        LYS  57   0.857  -1.483  -9.445
  423    HA   LYS  57           HA       LYS  57  -1.891  -2.292  -8.778
  424    HB2  LYS  57           HB3      LYS  57  -0.620  -1.620 -11.442
  425    HB3  LYS  57           HB2      LYS  57  -2.291  -2.124 -11.229
  426    HG2  LYS  57           HG3      LYS  57  -2.675  -0.133  -9.820
  427    HG3  LYS  57           HG2      LYS  57  -1.023   0.387 -10.146
  428    HD2  LYS  57           HD3      LYS  57  -2.497   1.555 -11.635
  429    HD3  LYS  57           HD2      LYS  57  -1.573   0.382 -12.573
  430    HE2  LYS  57           HE3      LYS  57  -3.480  -1.162 -12.477
  431    HE3  LYS  57           HE2      LYS  57  -4.398   0.046 -11.582
  432    HZ1  LYS  57           HZ1      LYS  57  -4.962   0.065 -13.925
  433    HZ2  LYS  57           HZ2      LYS  57  -3.353   0.372 -14.339
  434    HZ3  LYS  57           HZ3      LYS  57  -4.237   1.524 -13.479
  435    H    CYS  58           H        CYS  58  -2.743  -4.118 -10.126
  436    HA   CYS  58           HA       CYS  58  -0.914  -6.362  -9.964
  437    HB2  CYS  58           HB3      CYS  58  -3.848  -6.253 -10.725
  438    HB3  CYS  58           HB2      CYS  58  -2.917  -7.726 -10.491
  439    H    ARG  59           H        ARG  59   0.200  -7.127 -11.645
  440    HA   ARG  59           HA       ARG  59  -0.177  -6.017 -14.275
  441    HB2  ARG  59           HB3      ARG  59   1.705  -8.068 -13.131
  442    HB3  ARG  59           HB2      ARG  59   1.646  -7.736 -14.857
  443    HG2  ARG  59           HG3      ARG  59   2.241  -5.418 -14.451
  444    HG3  ARG  59           HG2      ARG  59   2.237  -5.707 -12.713
  445    HD2  ARG  59           HD3      ARG  59   4.106  -7.181 -12.878
  446    HD3  ARG  59           HD2      ARG  59   4.028  -7.175 -14.638
  447    HE   ARG  59           HE       ARG  59   4.512  -4.657 -14.317
  448   HH11  ARG  59          HH11      ARG  59   5.831  -7.251 -12.359
  449   HH12  ARG  59          HH12      ARG  59   7.285  -6.388 -11.982
  450   HH21  ARG  59          HH21      ARG  59   6.432  -3.537 -13.829
  451   HH22  ARG  59          HH22      ARG  59   7.630  -4.279 -12.811
  452    H    ALA  60           H        ALA  60  -1.570  -8.524 -12.576
  453    HA   ALA  60           HA       ALA  60  -2.990  -9.450 -14.902
  454    HB1  ALA  60           HB1      ALA  60  -1.296 -11.397 -13.322
  455    HB2  ALA  60           HB2      ALA  60  -0.985 -10.873 -14.978
  456    HB3  ALA  60           HB3      ALA  60  -2.428 -11.815 -14.607
  457    H    SER  61           H        SER  61  -4.867 -10.664 -14.318
  458    HA   SER  61           HA       SER  61  -5.774 -10.239 -11.595
  459    HB2  SER  61           HB3      SER  61  -7.196 -11.536 -13.937
  460    HB3  SER  61           HB2      SER  61  -7.937 -11.035 -12.416
  461    HG   SER  61           HG       SER  61  -7.305  -8.872 -12.944
  462    H    ASN  62           H        ASN  62  -4.675 -12.760 -13.689
  463    HA   ASN  62           HA       ASN  62  -4.401 -14.554 -11.402
  464    HB2  ASN  62           HB3      ASN  62  -5.797 -15.234 -13.993
  465    HB3  ASN  62           HB2      ASN  62  -5.000 -16.480 -13.041
  466   HD21  ASN  62          HD21      ASN  62  -5.677 -15.340 -10.479
  467   HD22  ASN  62          HD22      ASN  62  -7.371 -15.596 -10.249
  468    HA   PRO  63           HA       PRO  63  -0.417 -14.022 -13.622
  469    HB2  PRO  63           HB3      PRO  63   1.036 -15.202 -11.577
  470    HB3  PRO  63           HB2      PRO  63   0.686 -13.471 -11.702
  471    HG2  PRO  63           HG3      PRO  63  -0.687 -15.582 -10.090
  472    HG3  PRO  63           HG2      PRO  63  -0.306 -13.908  -9.653
  473    HD2  PRO  63           HD3      PRO  63  -2.794 -14.632 -10.360
  474    HD3  PRO  63           HD2      PRO  63  -2.125 -13.049 -10.834
  475    H    VAL  64           H        VAL  64  -1.659 -16.879 -11.995
  476    HA   VAL  64           HA       VAL  64  -0.377 -18.527 -14.067
  477    HB   VAL  64           HB       VAL  64  -0.532 -20.444 -12.511
  478   HG11  VAL  64          HG11      VAL  64   1.556 -19.223 -12.644
  479   HG12  VAL  64          HG12      VAL  64   1.277 -19.765 -10.989
  480   HG13  VAL  64          HG13      VAL  64   0.991 -18.081 -11.424
  481   HG21  VAL  64          HG21      VAL  64  -2.384 -19.676 -11.135
  482   HG22  VAL  64          HG22      VAL  64  -1.376 -18.387 -10.479
  483   HG23  VAL  64          HG23      VAL  64  -0.983 -20.071 -10.138
  484    H    GLU  65           H        GLU  65  -1.685 -20.308 -14.865
  485    HA   GLU  65           HA       GLU  65  -4.385 -19.403 -15.263
  486    HB2  GLU  65           HB3      GLU  65  -2.893 -20.370 -17.058
  487    HB3  GLU  65           HB2      GLU  65  -3.134 -21.941 -16.307
  488    HG2  GLU  65           HG3      GLU  65  -5.466 -21.889 -16.768
  489    HG3  GLU  65           HG2      GLU  65  -5.380 -20.212 -17.300
  490    H    SER  66           H        SER  66  -4.845 -19.654 -12.956
  491    HA   SER  66           HA       SER  66  -6.642 -21.708 -12.450
  492    HB2  SER  66           HB3      SER  66  -4.546 -23.109 -12.265
  493    HB3  SER  66           HB2      SER  66  -4.062 -22.106 -10.899
  494    HG   SER  66           HG       SER  66  -5.816 -22.834  -9.740
  495    H    GLY  67           H        GLY  67  -4.283 -19.481 -11.073
  496    HA2  GLY  67           HA3      GLY  67  -6.192 -17.871  -9.808
  497    HA3  GLY  67           HA2      GLY  67  -5.543 -18.998  -8.618
  498    H    CYS  68           H        CYS  68  -3.754 -18.399  -7.578
  499    HA   CYS  68           HA       CYS  68  -2.043 -16.365  -8.838
  500    HB2  CYS  68           HB3      CYS  68  -2.744 -16.601  -5.901
  501    HB3  CYS  68           HB2      CYS  68  -1.608 -15.438  -6.586
  502    H    ARG  69           H        ARG  69   0.145 -16.297  -7.492
  503    HA   ARG  69           HA       ARG  69   1.352 -18.814  -8.107
  504    HB2  ARG  69           HB3      ARG  69   2.535 -16.393  -6.719
  505    HB3  ARG  69           HB2      ARG  69   3.451 -17.754  -7.350
  506    HG2  ARG  69           HG3      ARG  69   2.654 -17.165  -9.631
  507    HG3  ARG  69           HG2      ARG  69   1.866 -15.743  -8.938
  508    HD2  ARG  69           HD3      ARG  69   4.027 -14.945  -8.107
  509    HD3  ARG  69           HD2      ARG  69   4.821 -16.357  -8.804
  510    HE   ARG  69           HE       ARG  69   3.497 -14.239 -10.389
  511   HH11  ARG  69          HH11      ARG  69   5.949 -16.717 -10.013
  512   HH12  ARG  69          HH12      ARG  69   6.784 -16.284 -11.465
  513   HH21  ARG  69          HH21      ARG  69   4.605 -13.661 -12.289
  514   HH22  ARG  69          HH22      ARG  69   6.012 -14.563 -12.773
  515    H    GLY  70           H        GLY  70   1.436 -20.533  -6.807
  516    HA2  GLY  70           HA3      GLY  70   2.225 -21.657  -4.904
  517    HA3  GLY  70           HA2      GLY  70   2.229 -20.131  -4.033
  518    H    ILE  71           H        ILE  71  -0.692 -20.081  -5.378
  519    HA   ILE  71           HA       ILE  71  -1.977 -20.819  -2.922
  520    HB   ILE  71           HB       ILE  71  -3.186 -19.967  -5.558
  521   HG12  ILE  71          HG13      ILE  71  -1.747 -18.238  -4.602
  522   HG13  ILE  71          HG12      ILE  71  -3.438 -17.768  -4.478
  523   HG21  ILE  71          HG21      ILE  71  -5.197 -19.458  -4.241
  524   HG22  ILE  71          HG22      ILE  71  -4.429 -20.158  -2.816
  525   HG23  ILE  71          HG23      ILE  71  -4.798 -21.175  -4.209
  526   HD11  ILE  71          HD11      ILE  71  -3.439 -18.448  -2.124
  527   HD12  ILE  71          HD12      ILE  71  -2.245 -17.194  -2.461
  528   HD13  ILE  71          HD13      ILE  71  -1.732 -18.867  -2.259
  529    H    ASP  72           H        ASP  72  -3.016 -22.611  -2.420
  530    HA   ASP  72           HA       ASP  72  -2.908 -25.032  -3.692
  531    HB2  ASP  72           HB3      ASP  72  -3.642 -25.006  -1.453
  532    HB3  ASP  72           HB2      ASP  72  -4.926 -23.857  -1.797
  533    H    SER  73           H        SER  73  -5.592 -22.729  -3.872
  534    HA   SER  73           HA       SER  73  -6.883 -22.058  -5.601
  535    HB2  SER  73           HB3      SER  73  -4.774 -22.241  -6.931
  536    HB3  SER  73           HB2      SER  73  -5.232 -23.892  -7.350
  537    HG   SER  73           HG       SER  73  -7.321 -22.650  -8.000
  538    H    LYS  74           H        LYS  74  -6.844 -25.132  -4.413
  539    HA   LYS  74           HA       LYS  74  -9.048 -26.047  -6.114
  540    HB2  LYS  74           HB3      LYS  74  -7.498 -27.493  -3.953
  541    HB3  LYS  74           HB2      LYS  74  -8.770 -28.207  -4.932
  542    HG2  LYS  74           HG3      LYS  74  -7.406 -27.795  -6.950
  543    HG3  LYS  74           HG2      LYS  74  -6.119 -27.169  -5.917
  544    HD2  LYS  74           HD3      LYS  74  -7.265 -29.950  -5.774
  545    HD3  LYS  74           HD2      LYS  74  -5.756 -29.517  -6.571
  546    HE2  LYS  74           HE3      LYS  74  -4.910 -28.683  -4.397
  547    HE3  LYS  74           HE2      LYS  74  -6.396 -29.251  -3.640
  548    HZ1  LYS  74           HZ1      LYS  74  -4.627 -30.856  -3.366
  549    HZ2  LYS  74           HZ2      LYS  74  -4.399 -30.947  -5.037
  550    HZ3  LYS  74           HZ3      LYS  74  -5.840 -31.500  -4.352
  551    H    HIS  75           H        HIS  75  -8.215 -25.321  -2.765
  552    HA   HIS  75           HA       HIS  75 -11.015 -25.549  -1.954
  553    HB2  HIS  75           HB3      HIS  75  -8.544 -24.815  -0.356
  554    HB3  HIS  75           HB2      HIS  75 -10.157 -25.014   0.316
  555    HD1  HIS  75           HD1      HIS  75 -10.851 -27.340   0.964
  556    HD2  HIS  75           HD2      HIS  75  -7.378 -27.275  -1.323
  557    HE1  HIS  75           HE1      HIS  75  -9.959 -29.688   1.020
  558    HE2  HIS  75           HE2      HIS  75  -7.785 -29.588  -0.246
  559    H    TRP  76           H        TRP  76  -9.222 -23.304  -3.486
  560    HA   TRP  76           HA       TRP  76 -10.875 -21.094  -2.538
  561    HB2  TRP  76           HB3      TRP  76  -7.847 -21.010  -2.623
  562    HB3  TRP  76           HB2      TRP  76  -8.875 -19.594  -2.418
  563    HD1  TRP  76           HD1      TRP  76 -10.301 -19.496  -0.056
  564    HE1  TRP  76           HE1      TRP  76  -9.669 -20.407   2.263
  565    HE3  TRP  76           HE3      TRP  76  -6.671 -22.816  -1.437
  566    HZ2  TRP  76           HZ2      TRP  76  -7.879 -22.274   3.367
  567    HZ3  TRP  76           HZ3      TRP  76  -5.545 -24.129   0.317
  568    HH2  TRP  76           HH2      TRP  76  -6.140 -23.861   2.670
  569    H    ASN  77           H        ASN  77 -11.564 -19.854  -4.254
  570    HA   ASN  77           HA       ASN  77 -10.093 -19.987  -6.764
  571    HB2  ASN  77           HB3      ASN  77 -12.509 -18.325  -5.980
  572    HB3  ASN  77           HB2      ASN  77 -11.801 -18.371  -7.588
  573   HD21  ASN  77          HD21      ASN  77 -14.486 -19.077  -6.648
  574   HD22  ASN  77          HD22      ASN  77 -14.747 -20.708  -7.163
  575    H    SER  78           H        SER  78  -8.863 -18.263  -7.567
  576    HA   SER  78           HA       SER  78  -8.132 -16.305  -5.490
  577    HB2  SER  78           HB3      SER  78  -6.269 -17.419  -7.591
  578    HB3  SER  78           HB2      SER  78  -5.847 -16.491  -6.151
  579    HG   SER  78           HG       SER  78  -7.025 -18.418  -5.091
  580    H    TYR  79           H        TYR  79  -7.789 -14.213  -6.070
  581    HA   TYR  79           HA       TYR  79  -7.728 -13.455  -8.868
  582    HB2  TYR  79           HB3      TYR  79 -10.154 -13.577  -8.342
  583    HB3  TYR  79           HB2      TYR  79  -9.912 -12.438  -7.020
  584    HD1  TYR  79           HD1      TYR  79  -9.890 -10.102  -7.423
  585    HD2  TYR  79           HD2      TYR  79  -9.755 -12.813 -10.698
  586    HE1  TYR  79           HE1      TYR  79 -10.282  -8.234  -8.975
  587    HE2  TYR  79           HE2      TYR  79 -10.146 -10.955 -12.260
  588    HH   TYR  79           HH       TYR  79 -11.084  -8.723 -12.263
  589    H    CYS  80           H        CYS  80  -6.467 -11.693  -9.144
  590    HA   CYS  80           HA       CYS  80  -5.192 -10.564  -6.828
  591    HB2  CYS  80           HB3      CYS  80  -4.891  -9.836  -9.753
  592    HB3  CYS  80           HB2      CYS  80  -3.829  -9.312  -8.443
  593    H    THR  81           H        THR  81  -5.864  -8.883  -5.735
  594    HA   THR  81           HA       THR  81  -7.548  -6.886  -7.081
  595    HB   THR  81           HB       THR  81  -7.873  -7.843  -4.223
  596    HG1  THR  81           HG1      THR  81  -8.562  -9.277  -6.049
  597   HG21  THR  81          HG21      THR  81  -8.514  -5.491  -4.565
  598   HG22  THR  81          HG22      THR  81  -9.916  -6.506  -4.227
  599   HG23  THR  81          HG23      THR  81  -9.587  -5.979  -5.876
  600    H    THR  82           H        THR  82  -6.892  -4.830  -6.819
  601    HA   THR  82           HA       THR  82  -4.427  -4.350  -5.442
  602    HB   THR  82           HB       THR  82  -4.957  -1.929  -6.217
  603    HG1  THR  82           HG1      THR  82  -6.594  -1.690  -7.603
  604   HG21  THR  82          HG21      THR  82  -4.175  -2.457  -8.495
  605   HG22  THR  82          HG22      THR  82  -4.501  -4.166  -8.196
  606   HG23  THR  82          HG23      THR  82  -3.263  -3.326  -7.261
  607    H    THR  83           H        THR  83  -4.110  -3.386  -3.537
  608    HA   THR  83           HA       THR  83  -6.335  -2.891  -1.798
  609    HB   THR  83           HB       THR  83  -3.465  -2.104  -1.291
  610    HG1  THR  83           HG1      THR  83  -4.703  -4.649  -1.241
  611   HG21  THR  83          HG21      THR  83  -4.063  -2.517   1.047
  612   HG22  THR  83          HG22      THR  83  -5.692  -2.976   0.557
  613   HG23  THR  83          HG23      THR  83  -5.138  -1.318   0.329
  614    H    HIS  84           H        HIS  84  -7.387  -1.019  -1.566
  615    HA   HIS  84           HA       HIS  84  -6.349   1.306  -3.020
  616    HB2  HIS  84           HB3      HIS  84  -9.127   0.784  -1.925
  617    HB3  HIS  84           HB2      HIS  84  -8.648   2.190  -2.868
  618    HD1  HIS  84           HD1      HIS  84  -8.289   1.837  -5.425
  619    HD2  HIS  84           HD2      HIS  84  -9.588  -1.548  -3.386
  620    HE1  HIS  84           HE1      HIS  84  -9.036   0.224  -7.198
  621    HE2  HIS  84           HE2      HIS  84  -9.615  -1.884  -5.950
  622    H    THR  85           H        THR  85  -5.291   2.763  -1.863
  623    HA   THR  85           HA       THR  85  -6.141   3.170   0.934
  624    HB   THR  85           HB       THR  85  -3.741   2.402   0.566
  625    HG1  THR  85           HG1      THR  85  -3.155   3.559   2.295
  626   HG21  THR  85          HG21      THR  85  -2.119   4.101  -0.132
  627   HG22  THR  85          HG22      THR  85  -3.440   5.208  -0.508
  628   HG23  THR  85          HG23      THR  85  -3.246   3.718  -1.432
  629    H    PHE  86           H        PHE  86  -5.985   5.463   1.676
  630    HA   PHE  86           HA       PHE  86  -6.898   7.181  -0.524
  631    HB2  PHE  86           HB3      PHE  86  -7.652   7.203   2.408
  632    HB3  PHE  86           HB2      PHE  86  -8.123   8.458   1.263
  633    HD1  PHE  86           HD1      PHE  86  -8.817   5.136   2.503
  634    HD2  PHE  86           HD2      PHE  86  -9.596   7.892  -0.646
  635    HE1  PHE  86           HE1      PHE  86 -10.785   3.820   1.844
  636    HE2  PHE  86           HE2      PHE  86 -11.566   6.578  -1.310
  637    HZ   PHE  86           HZ       PHE  86 -12.165   4.544  -0.068
  638    H    VAL  87           H        VAL  87  -5.570   8.727  -1.097
  639    HA   VAL  87           HA       VAL  87  -3.586   9.658   0.873
  640    HB   VAL  87           HB       VAL  87  -2.168  10.279  -1.080
  641   HG11  VAL  87          HG11      VAL  87  -1.762   8.208   0.110
  642   HG12  VAL  87          HG12      VAL  87  -1.473   7.983  -1.616
  643   HG13  VAL  87          HG13      VAL  87  -2.959   7.378  -0.884
  644   HG21  VAL  87          HG21      VAL  87  -2.675   9.315  -3.270
  645   HG22  VAL  87          HG22      VAL  87  -3.909  10.472  -2.773
  646   HG23  VAL  87          HG23      VAL  87  -4.225   8.741  -2.657
  647    H    LYS  88           H        LYS  88  -2.921  11.842   0.777
  648    HA   LYS  88           HA       LYS  88  -5.135  13.655   0.402
  649    HB2  LYS  88           HB3      LYS  88  -2.320  14.391   1.221
  650    HB3  LYS  88           HB2      LYS  88  -3.808  15.254   1.575
  651    HG2  LYS  88           HG3      LYS  88  -4.502  13.489   3.090
  652    HG3  LYS  88           HG2      LYS  88  -3.060  12.558   2.695
  653    HD2  LYS  88           HD3      LYS  88  -1.706  14.508   3.528
  654    HD3  LYS  88           HD2      LYS  88  -3.216  15.204   4.117
  655    HE2  LYS  88           HE3      LYS  88  -3.586  13.250   5.517
  656    HE3  LYS  88           HE2      LYS  88  -2.102  12.518   4.912
  657    HZ1  LYS  88           HZ1      LYS  88  -2.330  14.996   6.538
  658    HZ2  LYS  88           HZ2      LYS  88  -0.885  14.432   5.852
  659    HZ3  LYS  88           HZ3      LYS  88  -1.677  13.513   7.030
  660    H    ALA  89           H        ALA  89  -5.521  14.308  -1.628
  661    HA   ALA  89           HA       ALA  89  -3.219  15.275  -3.197
  662    HB1  ALA  89           HB1      ALA  89  -5.585  13.779  -4.315
  663    HB2  ALA  89           HB2      ALA  89  -3.975  13.102  -4.066
  664    HB3  ALA  89           HB3      ALA  89  -4.213  14.408  -5.226
  665    H    LEU  90           H        LEU  90  -3.549  17.109  -4.413
  666    HA   LEU  90           HA       LEU  90  -5.824  18.732  -3.713
  667    HB2  LEU  90           HB3      LEU  90  -3.516  19.665  -3.990
  668    HB3  LEU  90           HB2      LEU  90  -3.605  19.272  -5.702
  669    HG   LEU  90           HG       LEU  90  -5.644  20.796  -5.803
  670   HD11  LEU  90          HD11      LEU  90  -4.571  21.620  -3.114
  671   HD12  LEU  90          HD12      LEU  90  -6.154  20.918  -3.447
  672   HD13  LEU  90          HD13      LEU  90  -5.758  22.524  -4.054
  673   HD21  LEU  90          HD21      LEU  90  -4.277  22.806  -5.975
  674   HD22  LEU  90          HD22      LEU  90  -3.455  21.418  -6.689
  675   HD23  LEU  90          HD23      LEU  90  -2.975  22.004  -5.096
  676    H    THR  91           H        THR  91  -7.700  18.563  -4.758
  677    HA   THR  91           HA       THR  91  -7.644  17.657  -7.562
  678    HB   THR  91           HB       THR  91  -9.747  16.429  -7.147
  679    HG1  THR  91           HG1      THR  91  -9.284  17.353  -4.503
  680   HG21  THR  91          HG21      THR  91  -8.792  14.577  -5.825
  681   HG22  THR  91          HG22      THR  91  -7.474  15.634  -5.321
  682   HG23  THR  91          HG23      THR  91  -7.651  15.194  -7.019
  683    H    THR  92           H        THR  92  -9.218  18.504  -8.931
  684    HA   THR  92           HA       THR  92 -10.839  20.666  -7.779
  685    HB   THR  92           HB       THR  92  -9.164  21.716  -9.136
  686    HG1  THR  92           HG1      THR  92 -10.891  22.125 -11.080
  687   HG21  THR  92          HG21      THR  92  -8.522  19.774 -10.504
  688   HG22  THR  92          HG22      THR  92  -8.815  21.208 -11.487
  689   HG23  THR  92          HG23      THR  92 -10.026  19.930 -11.411
  690    H    ASP  93           H        ASP  93 -12.854  20.034  -7.692
  691    HA   ASP  93           HA       ASP  93 -13.920  17.957  -9.329
  692    HB2  ASP  93           HB3      ASP  93 -14.718  18.308  -7.033
  693    HB3  ASP  93           HB2      ASP  93 -15.328  19.897  -7.479
  694    H    GLU  94           H        GLU  94 -14.133  21.471  -9.300
  695    HA   GLU  94           HA       GLU  94 -15.155  21.334 -12.042
  696    HB2  GLU  94           HB3      GLU  94 -16.294  22.962  -9.787
  697    HB3  GLU  94           HB2      GLU  94 -16.478  23.476 -11.455
  698    HG2  GLU  94           HG3      GLU  94 -17.385  20.828 -10.365
  699    HG3  GLU  94           HG2      GLU  94 -18.412  22.242 -10.560
  700    H    LYS  95           H        LYS  95 -14.501  24.096  -9.898
  701    HA   LYS  95           HA       LYS  95 -12.367  24.901 -11.769
  702    HB2  LYS  95           HB3      LYS  95 -14.421  26.678 -10.444
  703    HB3  LYS  95           HB2      LYS  95 -13.087  27.240 -11.437
  704    HG2  LYS  95           HG3      LYS  95 -14.018  26.116 -13.371
  705    HG3  LYS  95           HG2      LYS  95 -15.329  25.468 -12.380
  706    HD2  LYS  95           HD3      LYS  95 -16.051  27.761 -11.874
  707    HD3  LYS  95           HD2      LYS  95 -14.780  28.380 -12.930
  708    HE2  LYS  95           HE3      LYS  95 -17.047  26.580 -13.766
  709    HE3  LYS  95           HE2      LYS  95 -16.962  28.317 -14.051
  710    HZ1  LYS  95           HZ1      LYS  95 -14.991  27.960 -15.400
  711    HZ2  LYS  95           HZ2      LYS  95 -16.294  27.064 -16.000
  712    HZ3  LYS  95           HZ3      LYS  95 -15.073  26.295 -15.124
  713    H    GLN  96           H        GLN  96 -13.074  24.115  -8.605
  714    HA   GLN  96           HA       GLN  96 -10.985  25.905  -7.563
  715    HB2  GLN  96           HB3      GLN  96 -13.346  24.686  -6.122
  716    HB3  GLN  96           HB2      GLN  96 -12.083  25.629  -5.347
  717    HG2  GLN  96           HG3      GLN  96 -13.875  26.663  -7.529
  718    HG3  GLN  96           HG2      GLN  96 -14.164  26.891  -5.806
  719   HE21  GLN  96          HE21      GLN  96 -12.195  27.790  -8.531
  720   HE22  GLN  96          HE22      GLN  96 -11.422  29.139  -7.776
  721    H    ALA  97           H        ALA  97  -9.207  25.015  -6.815
  722    HA   ALA  97           HA       ALA  97  -9.005  22.124  -6.691
  723    HB1  ALA  97           HB1      ALA  97  -7.242  23.425  -7.801
  724    HB2  ALA  97           HB2      ALA  97  -6.616  22.494  -6.442
  725    HB3  ALA  97           HB3      ALA  97  -6.883  24.228  -6.271
  726    H    ALA  98           H        ALA  98  -9.200  21.003  -4.876
  727    HA   ALA  98           HA       ALA  98  -8.573  22.282  -2.317
  728    HB1  ALA  98           HB1      ALA  98 -11.108  20.744  -2.878
  729    HB2  ALA  98           HB2      ALA  98 -10.991  22.485  -2.627
  730    HB3  ALA  98           HB3      ALA  98 -10.610  21.376  -1.310
  731    H    TRP  99           H        TRP  99  -7.869  20.872  -0.719
  732    HA   TRP  99           HA       TRP  99  -6.654  18.464  -1.678
  733    HB2  TRP  99           HB3      TRP  99  -6.791  19.700   1.080
  734    HB3  TRP  99           HB2      TRP  99  -5.915  18.217   0.728
  735    HD1  TRP  99           HD1      TRP  99  -5.787  21.994   0.035
  736    HE1  TRP  99           HE1      TRP  99  -3.403  22.598  -0.733
  737    HE3  TRP  99           HE3      TRP  99  -3.841  17.283  -0.332
  738    HZ2  TRP  99           HZ2      TRP  99  -1.015  21.246  -1.400
  739    HZ3  TRP  99           HZ3      TRP  99  -1.494  17.026  -1.039
  740    HH2  TRP  99           HH2      TRP  99  -0.115  18.969  -1.561
  741    H    ARG 100           H        ARG 100  -7.574  16.576  -1.823
  742    HA   ARG 100           HA       ARG 100  -9.687  15.841   0.089
  743    HB2  ARG 100           HB3      ARG 100  -9.651  15.191  -2.872
  744    HB3  ARG 100           HB2      ARG 100 -10.877  14.680  -1.722
  745    HG2  ARG 100           HG3      ARG 100 -10.298  17.525  -2.516
  746    HG3  ARG 100           HG2      ARG 100 -11.625  16.532  -3.121
  747    HD2  ARG 100           HD3      ARG 100 -12.464  16.328  -0.800
  748    HD3  ARG 100           HD2      ARG 100 -11.190  17.425  -0.276
  749    HE   ARG 100           HE       ARG 100 -13.167  18.255  -2.287
  750   HH11  ARG 100          HH11      ARG 100 -11.558  18.730   0.787
  751   HH12  ARG 100          HH12      ARG 100 -12.318  20.254   1.092
  752   HH21  ARG 100          HH21      ARG 100 -14.146  20.269  -1.905
  753   HH22  ARG 100          HH22      ARG 100 -13.781  21.140  -0.452
  754    H    PHE 101           H        PHE 101 -10.053  13.443   0.058
  755    HA   PHE 101           HA       PHE 101  -7.486  12.048  -0.130
  756    HB2  PHE 101           HB3      PHE 101  -9.993  11.590   1.440
  757    HB3  PHE 101           HB2      PHE 101  -8.996  10.202   1.033
  758    HD1  PHE 101           HD1      PHE 101  -9.083  13.398   2.865
  759    HD2  PHE 101           HD2      PHE 101  -6.921   9.815   2.092
  760    HE1  PHE 101           HE1      PHE 101  -7.609  13.872   4.777
  761    HE2  PHE 101           HE2      PHE 101  -5.451  10.281   4.002
  762    HZ   PHE 101           HZ       PHE 101  -5.794  12.307   5.345
  763    H    ILE 102           H        ILE 102  -7.102  10.898  -1.888
  764    HA   ILE 102           HA       ILE 102  -9.430   9.803  -3.336
  765    HB   ILE 102           HB       ILE 102  -7.995   9.745  -5.362
  766   HG12  ILE 102          HG13      ILE 102  -6.092  11.492  -3.803
  767   HG13  ILE 102          HG12      ILE 102  -5.821   9.778  -4.085
  768   HG21  ILE 102          HG21      ILE 102  -8.091  12.157  -5.826
  769   HG22  ILE 102          HG22      ILE 102  -8.378  12.458  -4.113
  770   HG23  ILE 102          HG23      ILE 102  -9.563  11.556  -5.062
  771   HD11  ILE 102          HD11      ILE 102  -6.039  11.916  -6.188
  772   HD12  ILE 102          HD12      ILE 102  -5.818  10.194  -6.500
  773   HD13  ILE 102          HD13      ILE 102  -4.565  11.107  -5.657
  774    H    ARG 103           H        ARG 103  -9.375   7.699  -4.030
  775    HA   ARG 103           HA       ARG 103  -7.613   6.004  -2.475
  776    HB2  ARG 103           HB3      ARG 103  -9.003   4.145  -3.267
  777    HB3  ARG 103           HB2      ARG 103  -9.989   5.429  -2.582
  778    HG2  ARG 103           HG3      ARG 103 -10.596   6.180  -4.803
  779    HG3  ARG 103           HG2      ARG 103  -9.545   4.964  -5.525
  780    HD2  ARG 103           HD3      ARG 103 -10.916   3.212  -4.392
  781    HD3  ARG 103           HD2      ARG 103 -12.023   4.484  -3.875
  782    HE   ARG 103           HE       ARG 103 -11.655   4.594  -6.676
  783   HH11  ARG 103          HH11      ARG 103 -13.227   2.710  -4.184
  784   HH12  ARG 103          HH12      ARG 103 -14.476   2.121  -5.233
  785   HH21  ARG 103          HH21      ARG 103 -13.301   3.831  -8.067
  786   HH22  ARG 103          HH22      ARG 103 -14.525   2.770  -7.442
  787    H    ILE 104           H        ILE 104  -5.754   5.299  -3.203
  788    HA   ILE 104           HA       ILE 104  -5.422   4.964  -6.107
  789    HB   ILE 104           HB       ILE 104  -3.000   5.175  -5.769
  790   HG12  ILE 104          HG13      ILE 104  -3.659   5.913  -2.913
  791   HG13  ILE 104          HG12      ILE 104  -2.987   4.365  -3.406
  792   HG21  ILE 104          HG21      ILE 104  -4.270   7.160  -6.341
  793   HG22  ILE 104          HG22      ILE 104  -2.930   7.574  -5.273
  794   HG23  ILE 104          HG23      ILE 104  -4.572   7.482  -4.635
  795   HD11  ILE 104          HD11      ILE 104  -1.666   7.036  -3.799
  796   HD12  ILE 104          HD12      ILE 104  -0.983   5.459  -4.201
  797   HD13  ILE 104          HD13      ILE 104  -1.293   5.883  -2.518
  798    H    ASP 105           H        ASP 105  -4.271   3.158  -6.841
  799    HA   ASP 105           HA       ASP 105  -4.711   0.760  -5.279
  800    HB2  ASP 105           HB3      ASP 105  -3.445   1.126  -8.020
  801    HB3  ASP 105           HB2      ASP 105  -3.934  -0.413  -7.309
  802    H    THR 106           H        THR 106  -3.243   0.704  -3.598
  803    HA   THR 106           HA       THR 106  -0.529   1.637  -4.146
  804    HB   THR 106           HB       THR 106  -1.672   2.590  -2.201
  805    HG1  THR 106           HG1      THR 106   0.692   1.112  -1.976
  806   HG21  THR 106          HG21      THR 106  -3.065   0.698  -1.562
  807   HG22  THR 106          HG22      THR 106  -2.062   1.200  -0.202
  808   HG23  THR 106          HG23      THR 106  -1.631  -0.236  -1.132
  809    H    ALA 107           H        ALA 107  -2.166  -1.329  -3.825
  810    HA   ALA 107           HA       ALA 107   0.326  -2.780  -3.897
  811    HB1  ALA 107           HB1      ALA 107  -0.141  -4.182  -1.959
  812    HB2  ALA 107           HB2      ALA 107  -1.590  -3.240  -1.611
  813    HB3  ALA 107           HB3      ALA 107   0.001  -2.489  -1.483
  814    H    CYS 108           H        CYS 108  -0.059  -5.125  -4.223
  815    HA   CYS 108           HA       CYS 108  -2.715  -5.659  -5.362
  816    HB2  CYS 108           HB3      CYS 108  -1.124  -5.365  -7.197
  817    HB3  CYS 108           HB2      CYS 108  -0.029  -6.538  -6.461
  818    H    VAL 109           H        VAL 109  -3.705  -7.179  -4.246
  819    HA   VAL 109           HA       VAL 109  -2.058  -9.255  -2.944
  820    HB   VAL 109           HB       VAL 109  -3.721  -9.424  -1.185
  821   HG11  VAL 109          HG11      VAL 109  -3.479  -7.213  -0.136
  822   HG12  VAL 109          HG12      VAL 109  -2.914  -6.562  -1.676
  823   HG13  VAL 109          HG13      VAL 109  -1.970  -7.795  -0.838
  824   HG21  VAL 109          HG21      VAL 109  -5.640  -7.911  -1.049
  825   HG22  VAL 109          HG22      VAL 109  -5.721  -8.917  -2.497
  826   HG23  VAL 109          HG23      VAL 109  -5.219  -7.231  -2.619
  827    H    CYS 110           H        CYS 110  -3.330 -11.325  -2.582
  828    HA   CYS 110           HA       CYS 110  -5.132 -11.779  -4.863
  829    HB2  CYS 110           HB3      CYS 110  -3.027 -13.054  -5.053
  830    HB3  CYS 110           HB2      CYS 110  -3.343 -13.800  -3.494
  831    H    VAL 111           H        VAL 111  -7.153 -12.086  -4.321
  832    HA   VAL 111           HA       VAL 111  -7.853 -12.681  -1.574
  833    HB   VAL 111           HB       VAL 111 -10.132 -12.262  -2.206
  834   HG11  VAL 111          HG11      VAL 111  -8.841 -10.271  -1.881
  835   HG12  VAL 111          HG12      VAL 111  -9.952 -10.007  -3.225
  836   HG13  VAL 111          HG13      VAL 111  -8.250 -10.329  -3.542
  837   HG21  VAL 111          HG21      VAL 111  -9.204 -12.219  -5.072
  838   HG22  VAL 111          HG22      VAL 111 -10.834 -11.856  -4.506
  839   HG23  VAL 111          HG23      VAL 111 -10.175 -13.483  -4.317
  840    H    LEU 112           H        LEU 112  -8.988 -14.537  -0.905
  841    HA   LEU 112           HA       LEU 112  -8.964 -16.743  -2.856
  842    HB2  LEU 112           HB3      LEU 112  -8.316 -16.891   0.094
  843    HB3  LEU 112           HB2      LEU 112  -8.401 -18.263  -0.993
  844    HG   LEU 112           HG       LEU 112  -6.367 -16.028  -1.097
  845   HD11  LEU 112          HD11      LEU 112  -4.791 -17.855  -0.561
  846   HD12  LEU 112          HD12      LEU 112  -6.167 -18.935  -0.331
  847   HD13  LEU 112          HD13      LEU 112  -5.955 -17.540   0.725
  848   HD21  LEU 112          HD21      LEU 112  -6.710 -18.451  -2.860
  849   HD22  LEU 112          HD22      LEU 112  -5.296 -17.399  -2.849
  850   HD23  LEU 112          HD23      LEU 112  -6.864 -16.761  -3.341
  851    H    SER 113           H        SER 113 -10.787 -17.890  -3.025
  852    HA   SER 113           HA       SER 113 -12.477 -18.544  -0.876
  853    HB2  SER 113           HB3      SER 113 -13.194 -16.203  -0.961
  854    HB3  SER 113           HB2      SER 113 -13.555 -16.358  -2.681
  855    HG   SER 113           HG       SER 113 -15.379 -16.590  -1.164
  856    H    ARG 114           H        ARG 114 -12.690 -20.605  -1.666
  857    HA   ARG 114           HA       ARG 114 -14.066 -20.866  -4.253
  858    HB2  ARG 114           HB3      ARG 114 -12.212 -22.443  -3.783
  859    HB3  ARG 114           HB2      ARG 114 -13.071 -23.017  -2.363
  860    HG2  ARG 114           HG3      ARG 114 -13.361 -24.595  -4.137
  861    HG3  ARG 114           HG2      ARG 114 -14.904 -23.792  -3.839
  862    HD2  ARG 114           HD3      ARG 114 -14.499 -22.313  -5.746
  863    HD3  ARG 114           HD2      ARG 114 -12.956 -23.111  -6.040
  864    HE   ARG 114           HE       ARG 114 -15.184 -24.919  -6.028
  865   HH11  ARG 114          HH11      ARG 114 -13.338 -22.691  -8.011
  866   HH12  ARG 114          HH12      ARG 114 -13.784 -23.463  -9.500
  867   HH21  ARG 114          HH21      ARG 114 -15.771 -25.918  -7.984
  868   HH22  ARG 114          HH22      ARG 114 -15.155 -25.302  -9.484
  869    H    LYS 115           H        LYS 115 -14.657 -20.441  -1.001
  870    HA   LYS 115           HA       LYS 115 -17.409 -21.237  -1.098
  871    HB2  LYS 115           HB3      LYS 115 -17.096 -22.951   0.765
  872    HB3  LYS 115           HB2      LYS 115 -16.534 -23.441  -0.827
  873    HG2  LYS 115           HG3      LYS 115 -14.234 -22.745  -0.150
  874    HG3  LYS 115           HG2      LYS 115 -14.855 -22.499   1.488
  875    HD2  LYS 115           HD3      LYS 115 -14.987 -25.092  -0.051
  876    HD3  LYS 115           HD2      LYS 115 -13.771 -24.703   1.161
  877    HE2  LYS 115           HE3      LYS 115 -15.535 -24.462   2.841
  878    HE3  LYS 115           HE2      LYS 115 -16.741 -24.858   1.618
  879    HZ1  LYS 115           HZ1      LYS 115 -14.546 -26.654   2.488
  880    HZ2  LYS 115           HZ2      LYS 115 -15.763 -27.033   1.378
  881    HZ3  LYS 115           HZ3      LYS 115 -16.152 -26.766   3.000
  882    H    ALA 116           H        ALA 116 -15.912 -18.840  -0.432
  883    HA   ALA 116           HA       ALA 116 -16.602 -18.603   2.426
  884    HB1  ALA 116           HB1      ALA 116 -14.177 -18.548   2.115
  885    HB2  ALA 116           HB2      ALA 116 -14.791 -16.999   2.694
  886    HB3  ALA 116           HB3      ALA 116 -14.351 -17.193   0.998
  887    H    THR 117           H        THR 117 -17.932 -17.056   2.980
  888    HA   THR 117           HA       THR 117 -19.490 -15.442   2.881
  889    HB   THR 117           HB       THR 117 -18.891 -13.280   1.837
  890    HG1  THR 117           HG1      THR 117 -17.106 -14.807   0.504
  891   HG21  THR 117          HG21      THR 117 -18.239 -13.714   4.111
  892   HG22  THR 117          HG22      THR 117 -16.938 -12.843   3.298
  893   HG23  THR 117          HG23      THR 117 -16.803 -14.580   3.571
  894    H    ARG 118           H        ARG 118 -20.740 -13.896   1.374
  895    HA   ARG 118           HA       ARG 118 -22.335 -13.699  -0.185
  896    HB2  ARG 118           HB3      ARG 118 -20.437 -13.401  -1.711
  897    HB3  ARG 118           HB2      ARG 118 -20.347 -15.136  -1.950
  898    HG2  ARG 118           HG3      ARG 118 -21.426 -14.167  -3.839
  899    HG3  ARG 118           HG2      ARG 118 -22.618 -15.086  -2.927
  900    HD2  ARG 118           HD3      ARG 118 -22.264 -12.081  -2.806
  901    HD3  ARG 118           HD2      ARG 118 -23.498 -12.923  -3.740
  902    HE   ARG 118           HE       ARG 118 -23.750 -13.774  -1.106
  903   HH11  ARG 118          HH11      ARG 118 -24.157 -10.829  -2.962
  904   HH12  ARG 118          HH12      ARG 118 -25.276 -10.132  -1.836
  905   HH21  ARG 118          HH21      ARG 118 -25.213 -12.839   0.385
  906   HH22  ARG 118          HH22      ARG 118 -25.870 -11.266   0.059
  907    H1   SER   1           H1       SER   1 -27.357   1.046  -8.471
  908    H2   SER   1           H2       SER   1 -26.932  -0.211  -7.427
  909    H3   SER   1           H3       SER   1 -26.910  -0.460  -9.098
  910    HA   SER   1           HA       SER   1 -25.132   1.114  -9.346
  911    HB2  SER   1           HB3      SER   1 -24.011   1.887  -7.202
  912    HB3  SER   1           HB2      SER   1 -25.577   2.621  -7.542
  913    HG   SER   1           HG       SER   1 -26.045   1.962  -5.599
  914    H    SER   2           H        SER   2 -23.388  -0.046  -9.866
  915    HA   SER   2           HA       SER   2 -22.829  -2.458  -8.271
  916    HB2  SER   2           HB3      SER   2 -21.816  -3.322 -10.453
  917    HB3  SER   2           HB2      SER   2 -23.573  -3.160 -10.414
  918    HG   SER   2           HG       SER   2 -23.440  -1.766 -11.969
  919    H    THR   3           H        THR   3 -21.721  -0.088  -7.435
  920    HA   THR   3           HA       THR   3 -19.117   0.347  -8.516
  921    HB   THR   3           HB       THR   3 -18.786   1.567  -6.271
  922    HG1  THR   3           HG1      THR   3 -21.168   2.073  -5.575
  923   HG21  THR   3          HG21      THR   3 -20.142   3.472  -7.007
  924   HG22  THR   3          HG22      THR   3 -21.011   2.420  -8.123
  925   HG23  THR   3          HG23      THR   3 -19.293   2.726  -8.360
  926    H    HIS   4           H        HIS   4 -20.474  -1.727  -6.088
  927    HA   HIS   4           HA       HIS   4 -17.868  -3.012  -5.804
  928    HB2  HIS   4           HB3      HIS   4 -18.363  -3.319  -3.318
  929    HB3  HIS   4           HB2      HIS   4 -17.860  -1.714  -3.826
  930    HD1  HIS   4           HD1      HIS   4 -19.656   0.173  -3.740
  931    HD2  HIS   4           HD2      HIS   4 -20.929  -3.499  -2.255
  932    HE1  HIS   4           HE1      HIS   4 -21.784   0.649  -2.487
  933    HE2  HIS   4           HE2      HIS   4 -22.607  -1.606  -1.722
  934    HA   PRO   5           HA       PRO   5 -21.298  -6.001  -6.601
  935    HB2  PRO   5           HB3      PRO   5 -20.061  -7.351  -8.600
  936    HB3  PRO   5           HB2      PRO   5 -20.993  -5.876  -8.882
  937    HG2  PRO   5           HG3      PRO   5 -18.038  -6.255  -8.718
  938    HG3  PRO   5           HG2      PRO   5 -18.973  -5.186  -9.775
  939    HD2  PRO   5           HD3      PRO   5 -17.661  -4.365  -7.497
  940    HD3  PRO   5           HD2      PRO   5 -19.044  -3.518  -8.215
  941    H    VAL   6           H        VAL   6 -20.854  -6.889  -4.566
  942    HA   VAL   6           HA       VAL   6 -20.046  -8.332  -3.011
  943    HB   VAL   6           HB       VAL   6 -19.081 -10.061  -5.286
  944   HG11  VAL   6          HG11      VAL   6 -19.632 -11.895  -3.770
  945   HG12  VAL   6          HG12      VAL   6 -20.171 -10.735  -2.556
  946   HG13  VAL   6          HG13      VAL   6 -18.475 -10.785  -3.036
  947   HG21  VAL   6          HG21      VAL   6 -21.348  -9.366  -5.829
  948   HG22  VAL   6          HG22      VAL   6 -21.897  -9.852  -4.225
  949   HG23  VAL   6          HG23      VAL   6 -21.316 -11.066  -5.365
  950    H    PHE   7           H        PHE   7 -18.453  -6.235  -3.464
  951    HA   PHE   7           HA       PHE   7 -15.761  -7.052  -4.118
  952    HB2  PHE   7           HB3      PHE   7 -16.819  -4.769  -4.645
  953    HB3  PHE   7           HB2      PHE   7 -16.572  -4.394  -2.945
  954    HD1  PHE   7           HD1      PHE   7 -14.432  -6.137  -5.453
  955    HD2  PHE   7           HD2      PHE   7 -14.870  -2.859  -2.774
  956    HE1  PHE   7           HE1      PHE   7 -12.139  -5.421  -5.964
  957    HE2  PHE   7           HE2      PHE   7 -12.574  -2.137  -3.278
  958    HZ   PHE   7           HZ       PHE   7 -11.203  -3.414  -4.872
  959    H    HIS   8           H        HIS   8 -17.637  -7.475  -1.511
  960    HA   HIS   8           HA       HIS   8 -15.925  -6.975   0.668
  961    HB2  HIS   8           HB3      HIS   8 -18.308  -7.554   0.944
  962    HB3  HIS   8           HB2      HIS   8 -17.992  -9.167   0.319
  963    HD1  HIS   8           HD1      HIS   8 -17.544  -7.040   3.371
  964    HD2  HIS   8           HD2      HIS   8 -16.835 -10.951   2.148
  965    HE1  HIS   8           HE1      HIS   8 -16.975  -8.308   5.462
  966    HE2  HIS   8           HE2      HIS   8 -16.685 -10.696   4.718
  967    H    MET   9           H        MET   9 -15.911  -9.356  -1.835
  968    HA   MET   9           HA       MET   9 -14.230 -11.263  -0.570
  969    HB2  MET   9           HB3      MET   9 -14.684 -10.662  -3.500
  970    HB3  MET   9           HB2      MET   9 -13.732 -12.018  -2.914
  971    HG2  MET   9           HG3      MET   9 -15.717 -12.896  -1.767
  972    HG3  MET   9           HG2      MET   9 -16.664 -11.557  -2.404
  973    HE1  MET   9           HE1      MET   9 -17.092 -11.199  -5.059
  974    HE2  MET   9           HE2      MET   9 -16.433 -12.280  -6.286
  975    HE3  MET   9           HE3      MET   9 -15.350 -11.279  -5.320
  976    H    GLY  10           H        GLY  10 -13.688  -8.159  -1.893
  977    HA2  GLY  10           HA3      GLY  10 -10.894  -8.494  -2.481
  978    HA3  GLY  10           HA2      GLY  10 -11.767  -6.976  -2.394
  979    H    GLU  11           H        GLU  11 -12.537  -8.468   0.371
  980    HA   GLU  11           HA       GLU  11 -10.478  -7.045   1.878
  981    HB2  GLU  11           HB3      GLU  11 -12.996  -8.415   2.864
  982    HB3  GLU  11           HB2      GLU  11 -11.936  -7.375   3.814
  983    HG2  GLU  11           HG3      GLU  11 -13.569  -6.511   1.428
  984    HG3  GLU  11           HG2      GLU  11 -13.969  -6.215   3.120
  985    H    PHE  12           H        PHE  12 -10.632  -9.922   0.506
  986    HA   PHE  12           HA       PHE  12  -9.684 -11.494   2.775
  987    HB2  PHE  12           HB3      PHE  12 -10.449 -12.230  -0.049
  988    HB3  PHE  12           HB2      PHE  12  -9.597 -13.352   1.006
  989    HD1  PHE  12           HD1      PHE  12 -12.700 -11.327   0.743
  990    HD2  PHE  12           HD2      PHE  12 -10.742 -14.645   2.553
  991    HE1  PHE  12           HE1      PHE  12 -14.835 -12.046   1.727
  992    HE2  PHE  12           HE2      PHE  12 -12.875 -15.368   3.543
  993    HZ   PHE  12           HZ       PHE  12 -14.923 -14.067   3.129
  994    H    SER  13           H        SER  13  -7.642 -12.221   2.980
  995    HA   SER  13           HA       SER  13  -5.720 -11.720   0.854
  996    HB2  SER  13           HB3      SER  13  -5.649  -9.703   2.292
  997    HB3  SER  13           HB2      SER  13  -5.352 -10.719   3.698
  998    HG   SER  13           HG       SER  13  -3.445  -9.760   2.705
  999    H    VAL  14           H        VAL  14  -3.732 -12.894   1.177
 1000    HA   VAL  14           HA       VAL  14  -4.171 -15.513   2.216
 1001    HB   VAL  14           HB       VAL  14  -1.818 -15.941   1.552
 1002   HG11  VAL  14          HG11      VAL  14  -3.470 -14.490  -0.512
 1003   HG12  VAL  14          HG12      VAL  14  -3.595 -16.197  -0.085
 1004   HG13  VAL  14          HG13      VAL  14  -2.131 -15.584  -0.854
 1005   HG21  VAL  14          HG21      VAL  14  -0.535 -14.207   0.417
 1006   HG22  VAL  14          HG22      VAL  14  -0.894 -13.735   2.079
 1007   HG23  VAL  14          HG23      VAL  14  -1.809 -13.034   0.745
 1008    H    CYS  15           H        CYS  15  -3.244 -12.648   3.648
 1009    HA   CYS  15           HA       CYS  15  -2.401 -14.094   6.043
 1010    HB2  CYS  15           HB3      CYS  15  -0.363 -13.198   4.916
 1011    HB3  CYS  15           HB2      CYS  15  -1.041 -11.575   5.054
 1012    H    ASP  16           H        ASP  16  -3.219 -13.280   7.908
 1013    HA   ASP  16           HA       ASP  16  -5.544 -11.734   7.808
 1014    HB2  ASP  16           HB3      ASP  16  -3.754 -12.475  10.129
 1015    HB3  ASP  16           HB2      ASP  16  -5.281 -11.620  10.330
 1016    H    SER  17           H        SER  17  -5.791  -9.660   7.488
 1017    HA   SER  17           HA       SER  17  -3.550  -7.858   8.123
 1018    HB2  SER  17           HB3      SER  17  -5.683  -7.531   6.000
 1019    HB3  SER  17           HB2      SER  17  -4.287  -6.481   6.253
 1020    HG   SER  17           HG       SER  17  -3.891  -9.233   5.805
 1021    H    VAL  18           H        VAL  18  -3.938  -5.971   9.210
 1022    HA   VAL  18           HA       VAL  18  -6.715  -5.493  10.065
 1023    HB   VAL  18           HB       VAL  18  -5.455  -6.188  11.978
 1024   HG11  VAL  18          HG11      VAL  18  -3.458  -4.042  11.288
 1025   HG12  VAL  18          HG12      VAL  18  -3.205  -5.785  11.177
 1026   HG13  VAL  18          HG13      VAL  18  -3.444  -5.027  12.752
 1027   HG21  VAL  18          HG21      VAL  18  -5.624  -4.199  13.422
 1028   HG22  VAL  18          HG22      VAL  18  -7.037  -4.417  12.390
 1029   HG23  VAL  18          HG23      VAL  18  -5.828  -3.201  11.983
 1030    H    SER  19           H        SER  19  -7.543  -3.741   9.146
 1031    HA   SER  19           HA       SER  19  -5.774  -1.641   8.165
 1032    HB2  SER  19           HB3      SER  19  -8.759  -2.026   7.801
 1033    HB3  SER  19           HB2      SER  19  -7.784  -0.785   7.013
 1034    HG   SER  19           HG       SER  19  -6.599  -2.451   5.992
 1035    H    VAL  20           H        VAL  20  -5.313   0.030   9.421
 1036    HA   VAL  20           HA       VAL  20  -7.293   0.870  11.436
 1037    HB   VAL  20           HB       VAL  20  -4.287   1.093  11.631
 1038   HG11  VAL  20          HG11      VAL  20  -6.439   1.663  13.658
 1039   HG12  VAL  20          HG12      VAL  20  -5.419   2.850  12.841
 1040   HG13  VAL  20          HG13      VAL  20  -4.702   1.697  13.967
 1041   HG21  VAL  20          HG21      VAL  20  -4.966  -1.232  11.764
 1042   HG22  VAL  20          HG22      VAL  20  -6.157  -0.830  13.004
 1043   HG23  VAL  20          HG23      VAL  20  -4.434  -0.654  13.344
 1044    H    TRP  21           H        TRP  21  -7.843   2.981  11.479
 1045    HA   TRP  21           HA       TRP  21  -6.449   4.827   9.686
 1046    HB2  TRP  21           HB3      TRP  21  -9.065   5.041  11.197
 1047    HB3  TRP  21           HB2      TRP  21  -8.337   6.400  10.345
 1048    HD1  TRP  21           HD1      TRP  21 -10.231   3.155   9.741
 1049    HE1  TRP  21           HE1      TRP  21 -10.915   3.029   7.262
 1050    HE3  TRP  21           HE3      TRP  21  -7.587   7.165   7.968
 1051    HZ2  TRP  21           HZ2      TRP  21 -10.398   4.445   4.874
 1052    HZ3  TRP  21           HZ3      TRP  21  -7.739   7.709   5.572
 1053    HH2  TRP  21           HH2      TRP  21  -9.111   6.376   4.062
 1054    H    VAL  22           H        VAL  22  -4.624   5.415  10.685
 1055    HA   VAL  22           HA       VAL  22  -4.577   5.746  13.563
 1056    HB   VAL  22           HB       VAL  22  -2.300   6.114  11.617
 1057   HG11  VAL  22          HG11      VAL  22  -0.899   5.649  13.571
 1058   HG12  VAL  22          HG12      VAL  22  -2.343   5.548  14.578
 1059   HG13  VAL  22          HG13      VAL  22  -1.905   7.077  13.814
 1060   HG21  VAL  22          HG21      VAL  22  -3.244   3.888  11.343
 1061   HG22  VAL  22          HG22      VAL  22  -3.151   3.620  13.084
 1062   HG23  VAL  22          HG23      VAL  22  -1.673   3.804  12.140
 1063    H    GLY  23           H        GLY  23  -5.244   7.610  14.363
 1064    HA2  GLY  23           HA3      GLY  23  -4.365  10.104  13.048
 1065    HA3  GLY  23           HA2      GLY  23  -5.755   9.969  14.129
 1066    H    ASP  24           H        ASP  24  -3.140   8.114  15.112
 1067    HA   ASP  24           HA       ASP  24  -2.214  10.196  16.976
 1068    HB2  ASP  24           HB3      ASP  24  -2.837   7.293  17.548
 1069    HB3  ASP  24           HB2      ASP  24  -1.861   8.287  18.626
 1070    H    LYS  25           H        LYS  25  -1.120   9.361  14.421
 1071    HA   LYS  25           HA       LYS  25   1.243   7.820  15.107
 1072    HB2  LYS  25           HB3      LYS  25  -0.074   7.640  12.898
 1073    HB3  LYS  25           HB2      LYS  25   0.697   9.158  12.463
 1074    HG2  LYS  25           HG3      LYS  25   2.887   8.137  12.691
 1075    HG3  LYS  25           HG2      LYS  25   2.137   6.613  13.171
 1076    HD2  LYS  25           HD3      LYS  25   0.924   6.675  10.951
 1077    HD3  LYS  25           HD2      LYS  25   2.004   7.997  10.505
 1078    HE2  LYS  25           HE3      LYS  25   2.916   5.934   9.655
 1079    HE3  LYS  25           HE2      LYS  25   3.936   6.510  10.974
 1080    HZ1  LYS  25           HZ1      LYS  25   1.847   4.407  11.204
 1081    HZ2  LYS  25           HZ2      LYS  25   2.865   4.939  12.453
 1082    HZ3  LYS  25           HZ3      LYS  25   3.519   4.131  11.123
 1083    H    THR  26           H        THR  26   2.658   8.989  16.284
 1084    HA   THR  26           HA       THR  26   3.119  11.778  15.528
 1085    HB   THR  26           HB       THR  26   2.474  11.436  17.859
 1086    HG1  THR  26           HG1      THR  26   4.984  12.445  17.157
 1087   HG21  THR  26          HG21      THR  26   3.315   9.189  18.214
 1088   HG22  THR  26          HG22      THR  26   4.003  10.283  19.413
 1089   HG23  THR  26          HG23      THR  26   4.975   9.758  18.038
 1090    H    THR  27           H        THR  27   4.481   8.792  15.040
 1091    HA   THR  27           HA       THR  27   7.024  10.028  14.323
 1092    HB   THR  27           HB       THR  27   8.107   7.800  15.142
 1093    HG1  THR  27           HG1      THR  27   6.443   7.790  17.304
 1094   HG21  THR  27          HG21      THR  27   8.712   9.979  16.021
 1095   HG22  THR  27          HG22      THR  27   8.568   8.820  17.344
 1096   HG23  THR  27          HG23      THR  27   7.280   9.989  17.050
 1097    H    ALA  28           H        ALA  28   7.760   9.392  12.395
 1098    HA   ALA  28           HA       ALA  28   7.082   6.754  11.373
 1099    HB1  ALA  28           HB1      ALA  28   6.318   9.230   9.833
 1100    HB2  ALA  28           HB2      ALA  28   5.191   8.137  10.635
 1101    HB3  ALA  28           HB3      ALA  28   6.161   7.563   9.280
 1102    H    THR  29           H        THR  29   8.131   6.450   9.177
 1103    HA   THR  29           HA       THR  29  10.824   7.569   9.338
 1104    HB   THR  29           HB       THR  29   9.909   5.280   7.604
 1105    HG1  THR  29           HG1      THR  29  10.018   5.352  10.261
 1106   HG21  THR  29          HG21      THR  29  12.279   4.663   7.659
 1107   HG22  THR  29          HG22      THR  29  12.622   6.068   8.670
 1108   HG23  THR  29          HG23      THR  29  12.062   6.290   7.013
 1109    H    ASP  30           H        ASP  30  11.390   9.124   8.039
 1110    HA   ASP  30           HA       ASP  30   9.861  10.104   5.862
 1111    HB2  ASP  30           HB3      ASP  30  11.429  11.509   7.170
 1112    HB3  ASP  30           HB2      ASP  30  12.782  10.551   6.573
 1113    H    ILE  31           H        ILE  31  10.642  10.188   3.590
 1114    HA   ILE  31           HA       ILE  31  11.059   7.630   2.547
 1115    HB   ILE  31           HB       ILE  31   9.998   9.389   1.242
 1116   HG12  ILE  31          HG13      ILE  31  12.572   8.477  -0.064
 1117   HG13  ILE  31          HG12      ILE  31  11.093   7.526   0.041
 1118   HG21  ILE  31          HG21      ILE  31  11.273  11.299   2.014
 1119   HG22  ILE  31          HG22      ILE  31  11.300  11.217   0.253
 1120   HG23  ILE  31          HG23      ILE  31  12.709  10.705   1.180
 1121   HD11  ILE  31          HD11      ILE  31  11.432  10.125  -1.431
 1122   HD12  ILE  31          HD12      ILE  31   9.936   9.202  -1.312
 1123   HD13  ILE  31          HD13      ILE  31  11.330   8.519  -2.151
 1124    H    LYS  32           H        LYS  32  13.318  10.039   3.608
 1125    HA   LYS  32           HA       LYS  32  15.593   8.888   2.268
 1126    HB2  LYS  32           HB3      LYS  32  15.415  10.913   4.500
 1127    HB3  LYS  32           HB2      LYS  32  16.882  10.509   3.613
 1128    HG2  LYS  32           HG3      LYS  32  15.931  11.368   1.571
 1129    HG3  LYS  32           HG2      LYS  32  14.386  11.651   2.373
 1130    HD2  LYS  32           HD3      LYS  32  15.462  13.263   3.858
 1131    HD3  LYS  32           HD2      LYS  32  17.001  12.997   3.037
 1132    HE2  LYS  32           HE3      LYS  32  16.060  13.824   0.961
 1133    HE3  LYS  32           HE2      LYS  32  14.486  14.013   1.728
 1134    HZ1  LYS  32           HZ1      LYS  32  15.446  15.667   3.205
 1135    HZ2  LYS  32           HZ2      LYS  32  15.651  16.120   1.591
 1136    HZ3  LYS  32           HZ3      LYS  32  16.954  15.488   2.464
 1137    H    GLY  33           H        GLY  33  13.810   8.039   4.985
 1138    HA2  GLY  33           HA3      GLY  33  14.257   6.000   6.132
 1139    HA3  GLY  33           HA2      GLY  33  15.974   6.233   5.823
 1140    H    LYS  34           H        LYS  34  14.414   9.051   6.850
 1141    HA   LYS  34           HA       LYS  34  15.756   8.908   9.423
 1142    HB2  LYS  34           HB3      LYS  34  14.180  11.151   8.154
 1143    HB3  LYS  34           HB2      LYS  34  15.129  11.277   9.625
 1144    HG2  LYS  34           HG3      LYS  34  16.219  10.672   6.887
 1145    HG3  LYS  34           HG2      LYS  34  16.275  12.235   7.693
 1146    HD2  LYS  34           HD3      LYS  34  17.582  11.182   9.525
 1147    HD3  LYS  34           HD2      LYS  34  17.603   9.688   8.589
 1148    HE2  LYS  34           HE3      LYS  34  18.726  10.884   6.756
 1149    HE3  LYS  34           HE2      LYS  34  18.767  12.336   7.747
 1150    HZ1  LYS  34           HZ1      LYS  34  20.084   9.761   8.416
 1151    HZ2  LYS  34           HZ2      LYS  34  20.131  11.166   9.353
 1152    HZ3  LYS  34           HZ3      LYS  34  20.862  11.143   7.830
 1153    H    GLU  35           H        GLU  35  14.673   9.363  11.412
 1154    HA   GLU  35           HA       GLU  35  11.850   8.566  11.387
 1155    HB2  GLU  35           HB3      GLU  35  13.316   7.208  12.808
 1156    HB3  GLU  35           HB2      GLU  35  13.841   8.651  13.660
 1157    HG2  GLU  35           HG3      GLU  35  11.687   8.965  14.618
 1158    HG3  GLU  35           HG2      GLU  35  10.989   7.708  13.601
 1159    H    VAL  36           H        VAL  36  10.411  10.139  11.517
 1160    HA   VAL  36           HA       VAL  36  11.234  12.656  12.797
 1161    HB   VAL  36           HB       VAL  36   9.935  13.879  11.067
 1162   HG11  VAL  36          HG11      VAL  36  12.347  13.719  10.887
 1163   HG12  VAL  36          HG12      VAL  36  11.610  13.655   9.285
 1164   HG13  VAL  36          HG13      VAL  36  12.201  12.177  10.045
 1165   HG21  VAL  36          HG21      VAL  36   9.870  11.205   9.671
 1166   HG22  VAL  36          HG22      VAL  36   9.355  12.745   8.982
 1167   HG23  VAL  36          HG23      VAL  36   8.479  12.053  10.347
 1168    H    THR  37           H        THR  37   9.509  14.026  13.503
 1169    HA   THR  37           HA       THR  37   7.405  12.512  14.773
 1170    HB   THR  37           HB       THR  37   7.994  15.472  14.909
 1171    HG1  THR  37           HG1      THR  37   9.699  13.986  15.653
 1172   HG21  THR  37          HG21      THR  37   5.728  14.907  15.626
 1173   HG22  THR  37          HG22      THR  37   6.718  15.396  17.001
 1174   HG23  THR  37          HG23      THR  37   6.371  13.689  16.726
 1175    H    VAL  38           H        VAL  38   5.613  12.100  13.697
 1176    HA   VAL  38           HA       VAL  38   4.723  13.785  11.524
 1177    HB   VAL  38           HB       VAL  38   3.441  11.302  12.679
 1178   HG11  VAL  38          HG11      VAL  38   1.846  12.655  11.451
 1179   HG12  VAL  38          HG12      VAL  38   2.246  11.201  10.536
 1180   HG13  VAL  38          HG13      VAL  38   2.954  12.751  10.081
 1181   HG21  VAL  38          HG21      VAL  38   5.246  11.625  10.290
 1182   HG22  VAL  38          HG22      VAL  38   4.434  10.137  10.776
 1183   HG23  VAL  38          HG23      VAL  38   5.668  10.848  11.815
 1184    H    LEU  39           H        LEU  39   3.072  15.191  11.593
 1185    HA   LEU  39           HA       LEU  39   1.758  15.565  14.186
 1186    HB2  LEU  39           HB3      LEU  39   1.918  17.468  11.841
 1187    HB3  LEU  39           HB2      LEU  39   1.282  17.830  13.437
 1188    HG   LEU  39           HG       LEU  39   4.160  17.187  12.802
 1189   HD11  LEU  39          HD11      LEU  39   2.812  19.783  13.512
 1190   HD12  LEU  39          HD12      LEU  39   3.532  19.361  11.959
 1191   HD13  LEU  39          HD13      LEU  39   4.554  19.540  13.384
 1192   HD21  LEU  39          HD21      LEU  39   3.574  16.422  15.017
 1193   HD22  LEU  39          HD22      LEU  39   2.834  17.979  15.387
 1194   HD23  LEU  39          HD23      LEU  39   4.576  17.870  15.126
 1195    H    ALA  40           H        ALA  40  -0.225  14.813  14.365
 1196    HA   ALA  40           HA       ALA  40  -1.778  13.980  12.107
 1197    HB1  ALA  40           HB1      ALA  40  -1.852  12.814  14.282
 1198    HB2  ALA  40           HB2      ALA  40  -3.447  13.333  13.742
 1199    HB3  ALA  40           HB3      ALA  40  -2.603  14.240  14.998
 1200    H    GLU  41           H        GLU  41  -1.285  16.849  13.761
 1201    HA   GLU  41           HA       GLU  41  -3.717  18.093  12.679
 1202    HB2  GLU  41           HB3      GLU  41  -1.674  19.354  14.517
 1203    HB3  GLU  41           HB2      GLU  41  -3.320  19.887  14.211
 1204    HG2  GLU  41           HG3      GLU  41  -2.620  17.318  15.604
 1205    HG3  GLU  41           HG2      GLU  41  -2.951  18.836  16.437
 1206    H    VAL  42           H        VAL  42  -3.383  18.968  10.686
 1207    HA   VAL  42           HA       VAL  42  -0.633  19.625   9.980
 1208    HB   VAL  42           HB       VAL  42  -1.399  19.734   7.632
 1209   HG11  VAL  42          HG11      VAL  42  -2.041  17.197   9.125
 1210   HG12  VAL  42          HG12      VAL  42  -0.463  17.689   8.506
 1211   HG13  VAL  42          HG13      VAL  42  -1.771  17.311   7.386
 1212   HG21  VAL  42          HG21      VAL  42  -3.739  20.342   8.010
 1213   HG22  VAL  42          HG22      VAL  42  -4.036  18.756   8.721
 1214   HG23  VAL  42          HG23      VAL  42  -3.599  18.890   7.019
 1215    H    ASN  43           H        ASN  43  -0.035  21.544  10.462
 1216    HA   ASN  43           HA       ASN  43  -1.812  23.834  10.253
 1217    HB2  ASN  43           HB3      ASN  43   1.118  23.708  11.037
 1218    HB3  ASN  43           HB2      ASN  43   0.065  25.107  11.206
 1219   HD21  ASN  43          HD21      ASN  43   0.961  22.019  12.489
 1220   HD22  ASN  43          HD22      ASN  43   0.060  22.135  13.957
 1221    H    ILE  44           H        ILE  44  -2.150  24.307   8.129
 1222    HA   ILE  44           HA       ILE  44   0.069  24.178   6.259
 1223    HB   ILE  44           HB       ILE  44  -2.784  25.054   5.761
 1224   HG12  ILE  44          HG13      ILE  44  -1.447  22.392   5.214
 1225   HG13  ILE  44          HG12      ILE  44  -2.591  22.696   6.520
 1226   HG21  ILE  44          HG21      ILE  44  -0.611  24.266   3.821
 1227   HG22  ILE  44          HG22      ILE  44  -1.167  25.911   4.121
 1228   HG23  ILE  44          HG23      ILE  44  -2.262  24.727   3.408
 1229   HD11  ILE  44          HD11      ILE  44  -4.323  23.202   4.866
 1230   HD12  ILE  44          HD12      ILE  44  -3.667  21.577   4.659
 1231   HD13  ILE  44          HD13      ILE  44  -3.174  22.874   3.570
 1232    H    ASN  45           H        ASN  45  -2.351  26.685   6.974
 1233    HA   ASN  45           HA       ASN  45  -0.387  28.649   7.525
 1234    HB2  ASN  45           HB3      ASN  45  -0.816  30.204   5.676
 1235    HB3  ASN  45           HB2      ASN  45  -0.121  28.703   5.093
 1236   HD21  ASN  45          HD21      ASN  45  -2.615  27.219   5.189
 1237   HD22  ASN  45          HD22      ASN  45  -3.594  27.816   3.902
 1238    H    ASN  46           H        ASN  46  -1.538  28.854   9.376
 1239    HA   ASN  46           HA       ASN  46  -3.136  29.567  10.820
 1240    HB2  ASN  46           HB3      ASN  46  -3.943  31.298   8.470
 1241    HB3  ASN  46           HB2      ASN  46  -4.593  31.469  10.096
 1242   HD21  ASN  46          HD21      ASN  46  -3.257  32.236  11.743
 1243   HD22  ASN  46          HD22      ASN  46  -1.795  33.091  11.401
 1244    H    SER  47           H        SER  47  -3.625  27.181   9.554
 1245    HA   SER  47           HA       SER  47  -6.433  26.884   9.899
 1246    HB2  SER  47           HB3      SER  47  -6.286  27.806   7.549
 1247    HB3  SER  47           HB2      SER  47  -5.367  26.368   7.110
 1248    HG   SER  47           HG       SER  47  -7.836  26.492   6.872
 1249    H    VAL  48           H        VAL  48  -6.548  25.015  10.933
 1250    HA   VAL  48           HA       VAL  48  -4.530  22.949  10.361
 1251    HB   VAL  48           HB       VAL  48  -6.161  23.300  12.882
 1252   HG11  VAL  48          HG11      VAL  48  -3.779  21.548  12.297
 1253   HG12  VAL  48          HG12      VAL  48  -5.446  21.006  12.482
 1254   HG13  VAL  48          HG13      VAL  48  -4.590  21.705  13.855
 1255   HG21  VAL  48          HG21      VAL  48  -3.292  24.057  12.350
 1256   HG22  VAL  48          HG22      VAL  48  -4.106  24.129  13.913
 1257   HG23  VAL  48          HG23      VAL  48  -4.636  25.173  12.595
 1258    H    PHE  49           H        PHE  49  -5.183  20.986   9.703
 1259    HA   PHE  49           HA       PHE  49  -8.053  20.347   9.892
 1260    HB2  PHE  49           HB3      PHE  49  -6.178  19.756   7.585
 1261    HB3  PHE  49           HB2      PHE  49  -7.801  19.091   7.737
 1262    HD1  PHE  49           HD1      PHE  49  -5.818  21.914   6.720
 1263    HD2  PHE  49           HD2      PHE  49  -9.760  20.644   7.699
 1264    HE1  PHE  49           HE1      PHE  49  -6.737  23.890   5.574
 1265    HE2  PHE  49           HE2      PHE  49 -10.684  22.617   6.558
 1266    HZ   PHE  49           HZ       PHE  49  -9.173  24.242   5.494
 1267    H    ARG  50           H        ARG  50  -8.580  18.241  10.410
 1268    HA   ARG  50           HA       ARG  50  -6.329  16.566  11.295
 1269    HB2  ARG  50           HB3      ARG  50  -9.212  16.684  12.187
 1270    HB3  ARG  50           HB2      ARG  50  -8.137  15.365  12.630
 1271    HG2  ARG  50           HG3      ARG  50  -6.618  17.042  13.658
 1272    HG3  ARG  50           HG2      ARG  50  -7.850  18.267  13.348
 1273    HD2  ARG  50           HD3      ARG  50  -9.413  17.142  14.768
 1274    HD3  ARG  50           HD2      ARG  50  -8.335  15.758  14.943
 1275    HE   ARG  50           HE       ARG  50  -6.854  17.843  15.858
 1276   HH11  ARG  50          HH11      ARG  50 -10.028  16.590  16.656
 1277   HH12  ARG  50          HH12      ARG  50  -9.948  17.094  18.312
 1278   HH21  ARG  50          HH21      ARG  50  -6.747  18.498  18.027
 1279   HH22  ARG  50          HH22      ARG  50  -8.074  18.178  19.098
 1280    H    GLN  51           H        GLN  51  -5.998  14.625  10.422
 1281    HA   GLN  51           HA       GLN  51  -8.122  13.139   9.208
 1282    HB2  GLN  51           HB3      GLN  51  -7.265  12.990   6.979
 1283    HB3  GLN  51           HB2      GLN  51  -7.440  14.691   7.366
 1284    HG2  GLN  51           HG3      GLN  51  -4.825  13.225   7.552
 1285    HG3  GLN  51           HG2      GLN  51  -5.380  14.028   6.089
 1286   HE21  GLN  51          HE21      GLN  51  -6.603  16.247   7.562
 1287   HE22  GLN  51          HE22      GLN  51  -5.287  17.224   8.126
 1288    H    TYR  52           H        TYR  52  -7.464  10.944   8.701
 1289    HA   TYR  52           HA       TYR  52  -5.228  10.200  10.470
 1290    HB2  TYR  52           HB3      TYR  52  -7.552   8.410   9.762
 1291    HB3  TYR  52           HB2      TYR  52  -6.456   8.284  11.131
 1292    HD1  TYR  52           HD1      TYR  52  -6.503  10.796  12.462
 1293    HD2  TYR  52           HD2      TYR  52  -9.697   8.840  10.442
 1294    HE1  TYR  52           HE1      TYR  52  -8.121  12.019  13.851
 1295    HE2  TYR  52           HE2      TYR  52 -11.321  10.062  11.822
 1296    HH   TYR  52           HH       TYR  52 -11.387  11.170  14.031
 1297    H    PHE  53           H        PHE  53  -4.118   8.171   9.945
 1298    HA   PHE  53           HA       PHE  53  -3.729   7.977   7.043
 1299    HB2  PHE  53           HB3      PHE  53  -1.975   6.963   9.298
 1300    HB3  PHE  53           HB2      PHE  53  -1.563   6.964   7.586
 1301    HD1  PHE  53           HD1      PHE  53  -1.329   9.178   6.406
 1302    HD2  PHE  53           HD2      PHE  53  -1.575   8.838  10.638
 1303    HE1  PHE  53           HE1      PHE  53  -0.363  11.428   6.637
 1304    HE2  PHE  53           HE2      PHE  53  -0.613  11.088  10.881
 1305    HZ   PHE  53           HZ       PHE  53  -0.008  12.386   8.880
 1306    H    PHE  54           H        PHE  54  -4.140   6.159   5.931
 1307    HA   PHE  54           HA       PHE  54  -5.517   4.000   7.289
 1308    HB2  PHE  54           HB3      PHE  54  -6.407   4.897   5.172
 1309    HB3  PHE  54           HB2      PHE  54  -4.920   4.448   4.348
 1310    HD1  PHE  54           HD1      PHE  54  -4.664   2.316   3.418
 1311    HD2  PHE  54           HD2      PHE  54  -7.833   3.053   6.163
 1312    HE1  PHE  54           HE1      PHE  54  -5.632   0.122   2.880
 1313    HE2  PHE  54           HE2      PHE  54  -8.806   0.856   5.630
 1314    HZ   PHE  54           HZ       PHE  54  -7.704  -0.611   3.988
 1315    H    GLU  55           H        GLU  55  -4.083   2.742   8.383
 1316    HA   GLU  55           HA       GLU  55  -1.851   1.611   6.823
 1317    HB2  GLU  55           HB3      GLU  55  -2.039   1.907   9.835
 1318    HB3  GLU  55           HB2      GLU  55  -0.684   1.220   8.950
 1319    HG2  GLU  55           HG3      GLU  55  -0.561   3.518   7.784
 1320    HG3  GLU  55           HG2      GLU  55  -1.575   4.076   9.115
 1321    H    THR  56           H        THR  56  -2.384  -0.326   6.125
 1322    HA   THR  56           HA       THR  56  -3.916  -2.132   7.845
 1323    HB   THR  56           HB       THR  56  -3.142  -2.452   4.935
 1324    HG1  THR  56           HG1      THR  56  -4.725  -0.988   4.873
 1325   HG21  THR  56          HG21      THR  56  -4.998  -4.092   6.665
 1326   HG22  THR  56          HG22      THR  56  -3.421  -4.603   6.065
 1327   HG23  THR  56          HG23      THR  56  -4.742  -4.312   4.933
 1328    H    LYS  57           H        LYS  57  -2.688  -3.251   9.190
 1329    HA   LYS  57           HA       LYS  57   0.061  -3.916   8.383
 1330    HB2  LYS  57           HB3      LYS  57  -1.209  -3.753  11.126
 1331    HB3  LYS  57           HB2      LYS  57   0.463  -4.207  10.822
 1332    HG2  LYS  57           HG3      LYS  57   0.846  -1.991   9.808
 1333    HG3  LYS  57           HG2      LYS  57  -0.809  -1.543  10.223
 1334    HD2  LYS  57           HD3      LYS  57   0.660  -0.672  11.906
 1335    HD3  LYS  57           HD2      LYS  57  -0.260  -2.001  12.606
 1336    HE2  LYS  57           HE3      LYS  57   1.648  -3.496  12.223
 1337    HE3  LYS  57           HE2      LYS  57   2.565  -2.141  11.572
 1338    HZ1  LYS  57           HZ1      LYS  57   3.122  -2.569  13.880
 1339    HZ2  LYS  57           HZ2      LYS  57   1.511  -2.335  14.339
 1340    HZ3  LYS  57           HZ3      LYS  57   2.406  -1.047  13.711
 1341    H    CYS  58           H        CYS  58   0.917  -5.958   9.369
 1342    HA   CYS  58           HA       CYS  58  -0.912  -8.136   8.792
 1343    HB2  CYS  58           HB3      CYS  58   2.024  -8.166   9.556
 1344    HB3  CYS  58           HB2      CYS  58   1.096  -9.571   9.057
 1345    H    ARG  59           H        ARG  59  -2.021  -9.201  10.304
 1346    HA   ARG  59           HA       ARG  59  -1.644  -8.599  13.093
 1347    HB2  ARG  59           HB3      ARG  59  -3.523 -10.407  11.589
 1348    HB3  ARG  59           HB2      ARG  59  -3.461 -10.404  13.345
 1349    HG2  ARG  59           HG3      ARG  59  -4.056  -8.050  13.381
 1350    HG3  ARG  59           HG2      ARG  59  -4.057  -8.011  11.620
 1351    HD2  ARG  59           HD3      ARG  59  -5.927  -9.488  11.513
 1352    HD3  ARG  59           HD2      ARG  59  -5.847  -9.809  13.245
 1353    HE   ARG  59           HE       ARG  59  -6.322  -7.272  13.392
 1354   HH11  ARG  59          HH11      ARG  59  -7.640  -9.461  11.001
 1355   HH12  ARG  59          HH12      ARG  59  -9.100  -8.554  10.784
 1356   HH21  ARG  59          HH21      ARG  59  -8.253  -6.082  13.127
 1357   HH22  ARG  59          HH22      ARG  59  -9.451  -6.630  11.998
 1358    H    ALA  60           H        ALA  60  -0.253 -10.752  10.956
 1359    HA   ALA  60           HA       ALA  60   1.176 -12.089  13.073
 1360    HB1  ALA  60           HB1      ALA  60  -0.513 -13.710  11.157
 1361    HB2  ALA  60           HB2      ALA  60  -0.827 -13.505  12.880
 1362    HB3  ALA  60           HB3      ALA  60   0.620 -14.358  12.343
 1363    H    SER  61           H        SER  61   3.055 -13.174  12.273
 1364    HA   SER  61           HA       SER  61   3.953 -12.244   9.672
 1365    HB2  SER  61           HB3      SER  61   5.387 -13.958  11.720
 1366    HB3  SER  61           HB2      SER  61   6.119 -13.174  10.321
 1367    HG   SER  61           HG       SER  61   5.490 -11.147  11.268
 1368    H    ASN  62           H        ASN  62   2.854 -15.111  11.258
 1369    HA   ASN  62           HA       ASN  62   2.585 -16.452   8.679
 1370    HB2  ASN  62           HB3      ASN  62   3.983 -17.595  11.096
 1371    HB3  ASN  62           HB2      ASN  62   3.189 -18.644   9.931
 1372   HD21  ASN  62          HD21      ASN  62   3.860 -17.052   7.622
 1373   HD22  ASN  62          HD22      ASN  62   5.557 -17.258   7.350
 1374    HA   PRO  63           HA       PRO  63  -1.397 -16.344  10.970
 1375    HB2  PRO  63           HB3      PRO  63  -2.851 -17.128   8.742
 1376    HB3  PRO  63           HB2      PRO  63  -2.505 -15.449   9.184
 1377    HG2  PRO  63           HG3      PRO  63  -1.130 -17.223   7.209
 1378    HG3  PRO  63           HG2      PRO  63  -1.514 -15.497   7.088
 1379    HD2  PRO  63           HD3      PRO  63   0.976 -16.334   7.645
 1380    HD3  PRO  63           HD2      PRO  63   0.304 -14.869   8.408
 1381    H    VAL  64           H        VAL  64  -0.161 -18.843   8.829
 1382    HA   VAL  64           HA       VAL  64  -1.425 -20.852  10.567
 1383    HB   VAL  64           HB       VAL  64  -1.274 -22.446   8.684
 1384   HG11  VAL  64          HG11      VAL  64  -3.364 -21.272   9.038
 1385   HG12  VAL  64          HG12      VAL  64  -3.083 -21.498   7.313
 1386   HG13  VAL  64          HG13      VAL  64  -2.798 -19.924   8.051
 1387   HG21  VAL  64          HG21      VAL  64   0.576 -21.437   7.471
 1388   HG22  VAL  64          HG22      VAL  64  -0.431 -20.047   7.069
 1389   HG23  VAL  64          HG23      VAL  64  -0.827 -21.638   6.420
 1390    H    GLU  65           H        GLU  65  -0.112 -22.745  11.020
 1391    HA   GLU  65           HA       GLU  65   2.589 -21.933  11.567
 1392    HB2  GLU  65           HB3      GLU  65   1.094 -23.210  13.159
 1393    HB3  GLU  65           HB2      GLU  65   1.338 -24.618  12.134
 1394    HG2  GLU  65           HG3      GLU  65   3.673 -24.638  12.593
 1395    HG3  GLU  65           HG2      GLU  65   3.577 -23.091  13.432
 1396    H    SER  66           H        SER  66   3.050 -21.753   9.264
 1397    HA   SER  66           HA       SER  66   4.836 -23.679   8.373
 1398    HB2  SER  66           HB3      SER  66   2.739 -25.015   7.936
 1399    HB3  SER  66           HB2      SER  66   2.246 -23.768   6.792
 1400    HG   SER  66           HG       SER  66   3.997 -24.267   5.502
 1401    H    GLY  67           H        GLY  67   2.476 -21.233   7.440
 1402    HA2  GLY  67           HA3      GLY  67   4.382 -19.413   6.492
 1403    HA3  GLY  67           HA2      GLY  67   3.731 -20.302   5.116
 1404    H    CYS  68           H        CYS  68   1.945 -19.514   4.206
 1405    HA   CYS  68           HA       CYS  68   0.231 -17.755   5.829
 1406    HB2  CYS  68           HB3      CYS  68   0.923 -17.440   2.897
 1407    HB3  CYS  68           HB2      CYS  68  -0.214 -16.426   3.787
 1408    H    ARG  69           H        ARG  69  -1.962 -17.440   4.519
 1409    HA   ARG  69           HA       ARG  69  -3.166 -20.031   4.656
 1410    HB2  ARG  69           HB3      ARG  69  -4.350 -17.395   3.748
 1411    HB3  ARG  69           HB2      ARG  69  -5.264 -18.850   4.116
 1412    HG2  ARG  69           HG3      ARG  69  -4.464 -18.695   6.464
 1413    HG3  ARG  69           HG2      ARG  69  -3.679 -17.169   6.045
 1414    HD2  ARG  69           HD3      ARG  69  -5.839 -16.231   5.380
 1415    HD3  ARG  69           HD2      ARG  69  -6.632 -17.749   5.805
 1416    HE   ARG  69           HE       ARG  69  -5.305 -15.964   7.755
 1417   HH11  ARG  69          HH11      ARG  69  -7.758 -18.322   6.920
 1418   HH12  ARG  69          HH12      ARG  69  -8.591 -18.171   8.430
 1419   HH21  ARG  69          HH21      ARG  69  -6.407 -15.758   9.737
 1420   HH22  ARG  69          HH22      ARG  69  -7.824 -16.725  10.034
 1421    H    GLY  70           H        GLY  70  -3.269 -21.474   3.058
 1422    HA2  GLY  70           HA3      GLY  70  -4.045 -22.226   0.979
 1423    HA3  GLY  70           HA2      GLY  70  -4.044 -20.567   0.404
 1424    H    ILE  71           H        ILE  71  -1.126 -20.761   1.733
 1425    HA   ILE  71           HA       ILE  71   0.159 -21.035  -0.814
 1426    HB   ILE  71           HB       ILE  71   1.370 -20.683   1.933
 1427   HG12  ILE  71          HG13      ILE  71  -0.071 -18.807   1.316
 1428   HG13  ILE  71          HG12      ILE  71   1.620 -18.323   1.282
 1429   HG21  ILE  71          HG21      ILE  71   3.381 -19.938   0.734
 1430   HG22  ILE  71          HG22      ILE  71   2.613 -20.359  -0.797
 1431   HG23  ILE  71          HG23      ILE  71   2.982 -21.619   0.381
 1432   HD11  ILE  71          HD11      ILE  71   1.620 -18.554  -1.157
 1433   HD12  ILE  71          HD12      ILE  71   0.426 -17.383  -0.594
 1434   HD13  ILE  71          HD13      ILE  71  -0.086 -18.993  -1.102
 1435    H    ASP  72           H        ASP  72   1.194 -22.700  -1.640
 1436    HA   ASP  72           HA       ASP  72   1.096 -25.314  -0.840
 1437    HB2  ASP  72           HB3      ASP  72   1.824 -24.861  -3.037
 1438    HB3  ASP  72           HB2      ASP  72   3.116 -23.807  -2.482
 1439    H    SER  73           H        SER  73   3.779 -23.078  -0.238
 1440    HA   SER  73           HA       SER  73   5.071 -22.741   1.585
 1441    HB2  SER  73           HB3      SER  73   2.963 -23.172   2.856
 1442    HB3  SER  73           HB2      SER  73   3.425 -24.872   2.962
 1443    HG   SER  73           HG       SER  73   5.509 -23.768   3.833
 1444    H    LYS  74           H        LYS  74   5.034 -25.541  -0.154
 1445    HA   LYS  74           HA       LYS  74   7.240 -26.757   1.347
 1446    HB2  LYS  74           HB3      LYS  74   5.688 -27.777  -1.044
 1447    HB3  LYS  74           HB2      LYS  74   6.961 -28.659  -0.216
 1448    HG2  LYS  74           HG3      LYS  74   5.601 -28.631   1.845
 1449    HG3  LYS  74           HG2      LYS  74   4.312 -27.826   0.948
 1450    HD2  LYS  74           HD3      LYS  74   5.459 -30.535   0.296
 1451    HD3  LYS  74           HD2      LYS  74   3.944 -30.251   1.149
 1452    HE2  LYS  74           HE3      LYS  74   3.114 -29.029  -0.835
 1453    HE3  LYS  74           HE2      LYS  74   4.605 -29.447  -1.674
 1454    HZ1  LYS  74           HZ1      LYS  74   2.836 -30.965  -2.258
 1455    HZ2  LYS  74           HZ2      LYS  74   2.603 -31.374  -0.635
 1456    HZ3  LYS  74           HZ3      LYS  74   4.045 -31.788  -1.411
 1457    H    HIS  75           H        HIS  75   6.401 -25.422  -1.804
 1458    HA   HIS  75           HA       HIS  75   9.199 -25.493  -2.652
 1459    HB2  HIS  75           HB3      HIS  75   6.724 -24.475  -4.076
 1460    HB3  HIS  75           HB2      HIS  75   8.335 -24.542  -4.777
 1461    HD1  HIS  75           HD1      HIS  75   9.032 -26.701  -5.848
 1462    HD2  HIS  75           HD2      HIS  75   5.562 -27.078  -3.590
 1463    HE1  HIS  75           HE1      HIS  75   8.147 -29.005  -6.349
 1464    HE2  HIS  75           HE2      HIS  75   5.980 -29.158  -5.071
 1465    H    TRP  76           H        TRP  76   7.404 -23.570  -0.728
 1466    HA   TRP  76           HA       TRP  76   9.058 -21.221  -1.249
 1467    HB2  TRP  76           HB3      TRP  76   6.029 -21.156  -1.147
 1468    HB3  TRP  76           HB2      TRP  76   7.056 -19.728  -1.085
 1469    HD1  TRP  76           HD1      TRP  76   8.478 -19.190  -3.388
 1470    HE1  TRP  76           HE1      TRP  76   7.848 -19.650  -5.837
 1471    HE3  TRP  76           HE3      TRP  76   4.853 -22.714  -2.649
 1472    HZ2  TRP  76           HZ2      TRP  76   6.053 -21.286  -7.270
 1473    HZ3  TRP  76           HZ3      TRP  76   3.728 -23.680  -4.614
 1474    HH2  TRP  76           HH2      TRP  76   4.317 -22.978  -6.877
 1475    H    ASN  77           H        ASN  77   9.746 -20.319   0.661
 1476    HA   ASN  77           HA       ASN  77   8.283 -20.922   3.108
 1477    HB2  ASN  77           HB3      ASN  77  10.696 -19.141   2.641
 1478    HB3  ASN  77           HB2      ASN  77   9.991 -19.488   4.214
 1479   HD21  ASN  77          HD21      ASN  77  12.675 -20.003   3.153
 1480   HD22  ASN  77          HD22      ASN  77  12.938 -21.701   3.365
 1481    H    SER  78           H        SER  78   7.050 -19.378   4.217
 1482    HA   SER  78           HA       SER  78   6.315 -17.072   2.541
 1483    HB2  SER  78           HB3      SER  78   4.458 -18.553   4.406
 1484    HB3  SER  78           HB2      SER  78   4.032 -17.379   3.162
 1485    HG   SER  78           HG       SER  78   5.200 -19.076   1.761
 1486    H    TYR  79           H        TYR  79   5.970 -15.121   3.500
 1487    HA   TYR  79           HA       TYR  79   5.911 -14.894   6.390
 1488    HB2  TYR  79           HB3      TYR  79   8.334 -14.910   5.847
 1489    HB3  TYR  79           HB2      TYR  79   8.089 -13.546   4.761
 1490    HD1  TYR  79           HD1      TYR  79   8.067 -11.325   5.593
 1491    HD2  TYR  79           HD2      TYR  79   7.936 -14.600   8.306
 1492    HE1  TYR  79           HE1      TYR  79   8.465  -9.782   7.465
 1493    HE2  TYR  79           HE2      TYR  79   8.331 -13.068  10.183
 1494    HH   TYR  79           HH       TYR  79   9.282 -10.875  10.601
 1495    H    CYS  80           H        CYS  80   4.647 -13.216   6.991
 1496    HA   CYS  80           HA       CYS  80   3.368 -11.677   4.927
 1497    HB2  CYS  80           HB3      CYS  80   3.067 -11.509   7.934
 1498    HB3  CYS  80           HB2      CYS  80   2.005 -10.750   6.745
 1499    H    THR  81           H        THR  81   4.043  -9.824   4.166
 1500    HA   THR  81           HA       THR  81   5.727  -8.107   5.862
 1501    HB   THR  81           HB       THR  81   6.037  -8.512   2.874
 1502    HG1  THR  81           HG1      THR  81   6.728 -10.265   4.393
 1503   HG21  THR  81          HG21      THR  81   6.683  -6.269   3.644
 1504   HG22  THR  81          HG22      THR  81   8.086  -7.204   3.126
 1505   HG23  THR  81          HG23      THR  81   7.753  -6.992   4.845
 1506    H    THR  82           H        THR  82   5.075  -6.028   5.973
 1507    HA   THR  82           HA       THR  82   2.598  -5.316   4.719
 1508    HB   THR  82           HB       THR  82   3.123  -3.080   5.935
 1509    HG1  THR  82           HG1      THR  82   4.767  -3.093   7.323
 1510   HG21  THR  82          HG21      THR  82   2.339  -4.026   8.072
 1511   HG22  THR  82          HG22      THR  82   2.666  -5.647   7.459
 1512   HG23  THR  82          HG23      THR  82   1.429  -4.648   6.696
 1513    H    THR  83           H        THR  83   2.276  -4.012   3.032
 1514    HA   THR  83           HA       THR  83   4.495  -3.199   1.412
 1515    HB   THR  83           HB       THR  83   1.624  -2.339   1.059
 1516    HG1  THR  83           HG1      THR  83   2.868  -4.828   0.539
 1517   HG21  THR  83          HG21      THR  83   2.221  -2.308  -1.313
 1518   HG22  THR  83          HG22      THR  83   3.851  -2.851  -0.919
 1519   HG23  THR  83          HG23      THR  83   3.297  -1.263  -0.386
 1520    H    HIS  84           H        HIS  84   5.542  -1.320   1.528
 1521    HA   HIS  84           HA       HIS  84   4.508   0.691   3.390
 1522    HB2  HIS  84           HB3      HIS  84   7.284   0.386   2.210
 1523    HB3  HIS  84           HB2      HIS  84   6.806   1.594   3.397
 1524    HD1  HIS  84           HD1      HIS  84   6.453   0.779   5.843
 1525    HD2  HIS  84           HD2      HIS  84   7.745  -2.176   3.218
 1526    HE1  HIS  84           HE1      HIS  84   7.207  -1.124   7.289
 1527    HE2  HIS  84           HE2      HIS  84   7.783  -2.972   5.680
 1528    H    THR  85           H        THR  85   3.449   2.344   2.528
 1529    HA   THR  85           HA       THR  85   4.294   3.261  -0.147
 1530    HB   THR  85           HB       THR  85   1.895   2.433   0.070
 1531    HG1  THR  85           HG1      THR  85   1.306   3.890  -1.412
 1532   HG21  THR  85          HG21      THR  85   0.271   3.969   1.075
 1533   HG22  THR  85          HG22      THR  85   1.590   4.990   1.648
 1534   HG23  THR  85          HG23      THR  85   1.402   3.354   2.279
 1535    H    PHE  86           H        PHE  86   4.136   5.650  -0.454
 1536    HA   PHE  86           HA       PHE  86   5.047   6.932   2.026
 1537    HB2  PHE  86           HB3      PHE  86   5.800   7.499  -0.851
 1538    HB3  PHE  86           HB2      PHE  86   6.270   8.520   0.508
 1539    HD1  PHE  86           HD1      PHE  86   6.963   5.484  -1.326
 1540    HD2  PHE  86           HD2      PHE  86   7.747   7.612   2.275
 1541    HE1  PHE  86           HE1      PHE  86   8.931   4.067  -0.923
 1542    HE2  PHE  86           HE2      PHE  86   9.717   6.199   2.685
 1543    HZ   PHE  86           HZ       PHE  86  10.314   4.425   1.087
 1544    H    VAL  87           H        VAL  87   3.716   8.340   2.881
 1545    HA   VAL  87           HA       VAL  87   1.731   9.620   1.120
 1546    HB   VAL  87           HB       VAL  87   0.315   9.866   3.155
 1547   HG11  VAL  87          HG11      VAL  87  -0.090   8.054   1.601
 1548   HG12  VAL  87          HG12      VAL  87  -0.379   7.514   3.255
 1549   HG13  VAL  87          HG13      VAL  87   1.108   7.053   2.425
 1550   HG21  VAL  87          HG21      VAL  87   0.826   8.515   5.128
 1551   HG22  VAL  87          HG22      VAL  87   2.060   9.745   4.851
 1552   HG23  VAL  87          HG23      VAL  87   2.375   8.064   4.417
 1553    H    LYS  88           H        LYS  88   1.061  11.748   1.626
 1554    HA   LYS  88           HA       LYS  88   3.276  13.463   2.322
 1555    HB2  LYS  88           HB3      LYS  88   0.457  14.328   1.655
 1556    HB3  LYS  88           HB2      LYS  88   1.938  15.253   1.465
 1557    HG2  LYS  88           HG3      LYS  88   2.640  13.796  -0.348
 1558    HG3  LYS  88           HG2      LYS  88   1.197  12.809  -0.135
 1559    HD2  LYS  88           HD3      LYS  88  -0.156  14.882  -0.587
 1560    HD3  LYS  88           HD2      LYS  88   1.357  15.672  -1.037
 1561    HE2  LYS  88           HE3      LYS  88   1.723  14.015  -2.777
 1562    HE3  LYS  88           HE2      LYS  88   0.240  13.182  -2.319
 1563    HZ1  LYS  88           HZ1      LYS  88   0.463  15.922  -3.451
 1564    HZ2  LYS  88           HZ2      LYS  88  -0.979  15.234  -2.886
 1565    HZ3  LYS  88           HZ3      LYS  88  -0.182  14.555  -4.214
 1566    H    ALA  89           H        ALA  89   3.662  13.730   4.438
 1567    HA   ALA  89           HA       ALA  89   1.362  14.382   6.164
 1568    HB1  ALA  89           HB1      ALA  89   3.733  12.708   6.981
 1569    HB2  ALA  89           HB2      ALA  89   2.124  12.085   6.610
 1570    HB3  ALA  89           HB3      ALA  89   2.360  13.152   7.994
 1571    H    LEU  90           H        LEU  90   1.692  15.959   7.698
 1572    HA   LEU  90           HA       LEU  90   3.964  17.687   7.308
 1573    HB2  LEU  90           HB3      LEU  90   1.658  18.549   7.758
 1574    HB3  LEU  90           HB2      LEU  90   1.749  17.846   9.366
 1575    HG   LEU  90           HG       LEU  90   3.788  19.326   9.746
 1576   HD11  LEU  90          HD11      LEU  90   2.710  20.634   7.257
 1577   HD12  LEU  90          HD12      LEU  90   4.295  19.885   7.456
 1578   HD13  LEU  90          HD13      LEU  90   3.893  21.351   8.349
 1579   HD21  LEU  90          HD21      LEU  90   2.419  21.269  10.292
 1580   HD22  LEU  90          HD22      LEU  90   1.601  19.772  10.737
 1581   HD23  LEU  90          HD23      LEU  90   1.115  20.643   9.282
 1582    H    THR  91           H        THR  91   5.844  17.330   8.300
 1583    HA   THR  91           HA       THR  91   5.790  15.920  10.888
 1584    HB   THR  91           HB       THR  91   7.893  14.787  10.250
 1585    HG1  THR  91           HG1      THR  91   7.433  16.194   7.831
 1586   HG21  THR  91          HG21      THR  91   6.936  13.214   8.610
 1587   HG22  THR  91          HG22      THR  91   5.613  14.344   8.317
 1588   HG23  THR  91          HG23      THR  91   5.799  13.596   9.903
 1589    H    THR  92           H        THR  92   7.366  16.501  12.389
 1590    HA   THR  92           HA       THR  92   8.984  18.842  11.655
 1591    HB   THR  92           HB       THR  92   7.303  19.616  13.186
 1592    HG1  THR  92           HG1      THR  92   9.049  19.648  15.169
 1593   HG21  THR  92          HG21      THR  92   6.672  17.454  14.170
 1594   HG22  THR  92          HG22      THR  92   6.963  18.680  15.404
 1595   HG23  THR  92          HG23      THR  92   8.178  17.442  15.086
 1596    H    ASP  93           H        ASP  93  11.002  18.245  11.454
 1597    HA   ASP  93           HA       ASP  93  12.066  15.895  12.678
 1598    HB2  ASP  93           HB3      ASP  93  12.865  16.673  10.483
 1599    HB3  ASP  93           HB2      ASP  93  13.486  18.143  11.227
 1600    H    GLU  94           H        GLU  94  12.291  19.350  13.294
 1601    HA   GLU  94           HA       GLU  94  13.308  18.710  15.968
 1602    HB2  GLU  94           HB3      GLU  94  14.436  20.725  14.047
 1603    HB3  GLU  94           HB2      GLU  94  14.619  20.935  15.781
 1604    HG2  GLU  94           HG3      GLU  94  15.543  18.536  14.228
 1605    HG3  GLU  94           HG2      GLU  94  16.563  19.892  14.693
 1606    H    LYS  95           H        LYS  95  12.642  21.819  14.373
 1607    HA   LYS  95           HA       LYS  95  10.512  22.262  16.365
 1608    HB2  LYS  95           HB3      LYS  95  12.563  24.255  15.388
 1609    HB3  LYS  95           HB2      LYS  95  11.230  24.623  16.472
 1610    HG2  LYS  95           HG3      LYS  95  12.169  23.159  18.157
 1611    HG3  LYS  95           HG2      LYS  95  13.477  22.709  17.062
 1612    HD2  LYS  95           HD3      LYS  95  14.193  25.060  16.996
 1613    HD3  LYS  95           HD2      LYS  95  12.920  25.466  18.150
 1614    HE2  LYS  95           HE3      LYS  95  15.195  23.553  18.631
 1615    HE3  LYS  95           HE2      LYS  95  15.100  25.202  19.239
 1616    HZ1  LYS  95           HZ1      LYS  95  13.131  24.583  20.497
 1617    HZ2  LYS  95           HZ2      LYS  95  14.444  23.606  20.920
 1618    HZ3  LYS  95           HZ3      LYS  95  13.229  22.999  19.915
 1619    H    GLN  96           H        GLN  96  11.206  22.071  13.111
 1620    HA   GLN  96           HA       GLN  96   9.123  24.031  12.420
 1621    HB2  GLN  96           HB3      GLN  96  11.491  23.099  10.786
 1622    HB3  GLN  96           HB2      GLN  96  10.224  24.158  10.190
 1623    HG2  GLN  96           HG3      GLN  96  12.012  24.794  12.523
 1624    HG3  GLN  96           HG2      GLN  96  12.295  25.334  10.869
 1625   HE21  GLN  96          HE21      GLN  96  10.348  25.711  13.718
 1626   HE22  GLN  96          HE22      GLN  96   9.551  27.164  13.225
 1627    H    ALA  97           H        ALA  97   7.341  23.290  11.525
 1628    HA   ALA  97           HA       ALA  97   7.147  20.470  10.861
 1629    HB1  ALA  97           HB1      ALA  97   5.383  21.538  12.194
 1630    HB2  ALA  97           HB2      ALA  97   4.757  20.878  10.685
 1631    HB3  ALA  97           HB3      ALA  97   5.023  22.612  10.842
 1632    H    ALA  98           H        ALA  98   7.339  19.705   8.870
 1633    HA   ALA  98           HA       ALA  98   6.708  21.437   6.592
 1634    HB1  ALA  98           HB1      ALA  98   9.243  19.823   6.854
 1635    HB2  ALA  98           HB2      ALA  98   9.126  21.581   6.932
 1636    HB3  ALA  98           HB3      ALA  98   8.742  20.737   5.431
 1637    H    TRP  99           H        TRP  99   6.013  20.348   4.757
 1638    HA   TRP  99           HA       TRP  99   4.789  17.804   5.258
 1639    HB2  TRP  99           HB3      TRP  99   4.926  19.531   2.778
 1640    HB3  TRP  99           HB2      TRP  99   4.051  18.006   2.848
 1641    HD1  TRP  99           HD1      TRP  99   3.921  21.587   4.237
 1642    HE1  TRP  99           HE1      TRP  99   1.543  22.036   5.105
 1643    HE3  TRP  99           HE3      TRP  99   1.977  16.890   3.717
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.848  20.584   5.508
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.369  16.505   4.367
 1646    HH2  TRP  99           HH2      TRP  99  -1.747  18.316   5.243
 1647    H    ARG 100           H        ARG 100   5.714  15.921   5.050
 1648    HA   ARG 100           HA       ARG 100   7.826  15.558   3.031
 1649    HB2  ARG 100           HB3      ARG 100   7.797  14.370   5.819
 1650    HB3  ARG 100           HB2      ARG 100   9.023  14.084   4.595
 1651    HG2  ARG 100           HG3      ARG 100   8.440  16.733   5.902
 1652    HG3  ARG 100           HG2      ARG 100   9.766  15.646   6.315
 1653    HD2  ARG 100           HD3      ARG 100  10.612  15.875   3.999
 1654    HD3  ARG 100           HD2      ARG 100   9.334  17.047   3.682
 1655    HE   ARG 100           HE       ARG 100  11.304  17.503   5.819
 1656   HH11  ARG 100          HH11      ARG 100   9.706  18.527   2.876
 1657   HH12  ARG 100          HH12      ARG 100  10.465  20.085   2.859
 1658   HH21  ARG 100          HH21      ARG 100  12.283  19.549   5.809
 1659   HH22  ARG 100          HH22      ARG 100  11.929  20.672   4.537
 1660    H    PHE 101           H        PHE 101   8.193  13.203   2.605
 1661    HA   PHE 101           HA       PHE 101   5.628  11.788   2.543
 1662    HB2  PHE 101           HB3      PHE 101   8.136  11.625   0.913
 1663    HB3  PHE 101           HB2      PHE 101   7.132  10.191   1.057
 1664    HD1  PHE 101           HD1      PHE 101   7.215  13.677  -0.148
 1665    HD2  PHE 101           HD2      PHE 101   5.068  10.004  -0.055
 1666    HE1  PHE 101           HE1      PHE 101   5.739  14.493  -1.936
 1667    HE2  PHE 101           HE2      PHE 101   3.593  10.813  -1.844
 1668    HZ   PHE 101           HZ       PHE 101   3.928  13.057  -2.787
 1669    H    ILE 102           H        ILE 102   5.250  10.330   4.057
 1670    HA   ILE 102           HA       ILE 102   7.581   8.988   5.274
 1671    HB   ILE 102           HB       ILE 102   6.149   8.553   7.257
 1672   HG12  ILE 102          HG13      ILE 102   4.242  10.557   6.054
 1673   HG13  ILE 102          HG12      ILE 102   3.973   8.820   6.011
 1674   HG21  ILE 102          HG21      ILE 102   6.243  10.836   8.162
 1675   HG22  ILE 102          HG22      ILE 102   6.525  11.452   6.533
 1676   HG23  ILE 102          HG23      ILE 102   7.713  10.392   7.295
 1677   HD11  ILE 102          HD11      ILE 102   4.191  10.530   8.476
 1678   HD12  ILE 102          HD12      ILE 102   3.974   8.780   8.463
 1679   HD13  ILE 102          HD13      ILE 102   2.717   9.830   7.805
 1680    H    ARG 103           H        ARG 103   7.527   6.791   5.572
 1681    HA   ARG 103           HA       ARG 103   5.768   5.413   3.726
 1682    HB2  ARG 103           HB3      ARG 103   7.160   3.440   4.156
 1683    HB3  ARG 103           HB2      ARG 103   8.143   4.828   3.719
 1684    HG2  ARG 103           HG3      ARG 103   8.759   5.155   6.038
 1685    HG3  ARG 103           HG2      ARG 103   7.709   3.826   6.525
 1686    HD2  ARG 103           HD3      ARG 103   9.075   2.314   5.077
 1687    HD3  ARG 103           HD2      ARG 103  10.182   3.661   4.806
 1688    HE   ARG 103           HE       ARG 103   9.814   3.241   7.580
 1689   HH11  ARG 103          HH11      ARG 103  11.393   1.857   4.778
 1690   HH12  ARG 103          HH12      ARG 103  12.648   1.097   5.702
 1691   HH21  ARG 103          HH21      ARG 103  11.469   2.246   8.803
 1692   HH22  ARG 103          HH22      ARG 103  12.694   1.319   7.994
 1693    H    ILE 104           H        ILE 104   3.910   4.584   4.313
 1694    HA   ILE 104           HA       ILE 104   3.581   3.716   7.106
 1695    HB   ILE 104           HB       ILE 104   1.157   3.981   6.814
 1696   HG12  ILE 104          HG13      ILE 104   1.814   5.234   4.143
 1697   HG13  ILE 104          HG12      ILE 104   1.143   3.620   4.344
 1698   HG21  ILE 104          HG21      ILE 104   2.425   5.826   7.742
 1699   HG22  ILE 104          HG22      ILE 104   1.084   6.430   6.772
 1700   HG23  ILE 104          HG23      ILE 104   2.725   6.459   6.125
 1701   HD11  ILE 104          HD11      ILE 104  -0.181   6.171   5.224
 1702   HD12  ILE 104          HD12      ILE 104  -0.861   4.547   5.326
 1703   HD13  ILE 104          HD13      ILE 104  -0.553   5.276   3.752
 1704    H    ASP 105           H        ASP 105   2.438   1.800   7.492
 1705    HA   ASP 105           HA       ASP 105   2.873  -0.265   5.510
 1706    HB2  ASP 105           HB3      ASP 105   1.606  -0.419   8.270
 1707    HB3  ASP 105           HB2      ASP 105   2.105  -1.795   7.286
 1708    H    THR 106           H        THR 106   1.404  -0.007   3.849
 1709    HA   THR 106           HA       THR 106  -1.312   0.804   4.564
 1710    HB   THR 106           HB       THR 106  -0.173   2.103   2.824
 1711    HG1  THR 106           HG1      THR 106  -2.535   0.684   2.331
 1712   HG21  THR 106          HG21      THR 106   1.220   0.360   1.849
 1713   HG22  THR 106          HG22      THR 106   0.218   1.105   0.605
 1714   HG23  THR 106          HG23      THR 106  -0.213  -0.477   1.252
 1715    H    ALA 107           H        ALA 107   0.327  -2.049   3.693
 1716    HA   ALA 107           HA       ALA 107  -2.163  -3.494   3.500
 1717    HB1  ALA 107           HB1      ALA 107  -1.696  -4.510   1.336
 1718    HB2  ALA 107           HB2      ALA 107  -0.250  -3.516   1.168
 1719    HB3  ALA 107           HB3      ALA 107  -1.841  -2.759   1.180
 1720    H    CYS 108           H        CYS 108  -1.778  -5.852   3.388
 1721    HA   CYS 108           HA       CYS 108   0.884  -6.589   4.401
 1722    HB2  CYS 108           HB3      CYS 108  -0.701  -6.642   6.263
 1723    HB3  CYS 108           HB2      CYS 108  -1.800  -7.655   5.323
 1724    H    VAL 109           H        VAL 109   1.872  -7.875   3.019
 1725    HA   VAL 109           HA       VAL 109   0.227  -9.676   1.357
 1726    HB   VAL 109           HB       VAL 109   1.889  -9.513  -0.403
 1727   HG11  VAL 109          HG11      VAL 109   1.641  -7.146  -1.025
 1728   HG12  VAL 109          HG12      VAL 109   1.080  -6.792   0.611
 1729   HG13  VAL 109          HG13      VAL 109   0.135  -7.849  -0.438
 1730   HG21  VAL 109          HG21      VAL 109   3.807  -8.001  -0.260
 1731   HG22  VAL 109          HG22      VAL 109   3.889  -9.253   0.981
 1732   HG23  VAL 109          HG23      VAL 109   3.386  -7.618   1.410
 1733    H    CYS 110           H        CYS 110   1.505 -11.637   0.614
 1734    HA   CYS 110           HA       CYS 110   3.308 -12.504   2.768
 1735    HB2  CYS 110           HB3      CYS 110   1.205 -13.799   2.723
 1736    HB3  CYS 110           HB2      CYS 110   1.521 -14.244   1.052
 1737    H    VAL 111           H        VAL 111   5.326 -12.705   2.177
 1738    HA   VAL 111           HA       VAL 111   6.024 -12.777  -0.632
 1739    HB   VAL 111           HB       VAL 111   8.305 -12.483   0.063
 1740   HG11  VAL 111          HG11      VAL 111   7.011 -10.467   0.117
 1741   HG12  VAL 111          HG12      VAL 111   8.128 -10.455   1.482
 1742   HG13  VAL 111          HG13      VAL 111   6.426 -10.833   1.740
 1743   HG21  VAL 111          HG21      VAL 111   7.378 -12.972   2.889
 1744   HG22  VAL 111          HG22      VAL 111   9.007 -12.506   2.399
 1745   HG23  VAL 111          HG23      VAL 111   8.353 -14.071   1.913
 1746    H    LEU 112           H        LEU 112   7.163 -14.477  -1.636
 1747    HA   LEU 112           HA       LEU 112   7.142 -17.008  -0.128
 1748    HB2  LEU 112           HB3      LEU 112   6.491 -16.603  -3.053
 1749    HB3  LEU 112           HB2      LEU 112   6.581 -18.153  -2.243
 1750    HG   LEU 112           HG       LEU 112   4.544 -15.982  -1.720
 1751   HD11  LEU 112          HD11      LEU 112   2.968 -17.677  -2.587
 1752   HD12  LEU 112          HD12      LEU 112   4.344 -18.695  -3.015
 1753   HD13  LEU 112          HD13      LEU 112   4.131 -17.128  -3.794
 1754   HD21  LEU 112          HD21      LEU 112   4.888 -18.692  -0.441
 1755   HD22  LEU 112          HD22      LEU 112   3.474 -17.656  -0.255
 1756   HD23  LEU 112          HD23      LEU 112   5.042 -17.123   0.348
 1757    H    SER 113           H        SER 113   8.970 -18.159  -0.175
 1758    HA   SER 113           HA       SER 113  10.658 -18.407  -2.410
 1759    HB2  SER 113           HB3      SER 113  11.369 -16.116  -1.890
 1760    HB3  SER 113           HB2      SER 113  11.743 -16.595  -0.233
 1761    HG   SER 113           HG       SER 113  13.561 -16.535  -1.757
 1762    H    ARG 114           H        ARG 114  10.874 -20.573  -2.014
 1763    HA   ARG 114           HA       ARG 114  12.255 -21.311   0.475
 1764    HB2  ARG 114           HB3      ARG 114  10.398 -22.771  -0.278
 1765    HB3  ARG 114           HB2      ARG 114  11.255 -23.069  -1.782
 1766    HG2  ARG 114           HG3      ARG 114  11.546 -24.951  -0.336
 1767    HG3  ARG 114           HG2      ARG 114  13.087 -24.105  -0.478
 1768    HD2  ARG 114           HD3      ARG 114  12.685 -23.010   1.669
 1769    HD3  ARG 114           HD2      ARG 114  11.144 -23.852   1.813
 1770    HE   ARG 114           HE       ARG 114  13.374 -25.620   1.454
 1771   HH11  ARG 114          HH11      ARG 114  11.541 -23.800   3.827
 1772   HH12  ARG 114          HH12      ARG 114  11.996 -24.830   5.148
 1773   HH21  ARG 114          HH21      ARG 114  13.962 -26.978   3.195
 1774   HH22  ARG 114          HH22      ARG 114  13.368 -26.633   4.790
 1775    H    LYS 115           H        LYS 115  12.833 -20.293  -2.646
 1776    HA   LYS 115           HA       LYS 115  15.589 -21.082  -2.697
 1777    HB2  LYS 115           HB3      LYS 115  15.283 -22.424  -4.847
 1778    HB3  LYS 115           HB2      LYS 115  14.722 -23.204  -3.375
 1779    HG2  LYS 115           HG3      LYS 115  12.420 -22.396  -3.910
 1780    HG3  LYS 115           HG2      LYS 115  13.039 -21.852  -5.473
 1781    HD2  LYS 115           HD3      LYS 115  13.178 -24.685  -4.443
 1782    HD3  LYS 115           HD2      LYS 115  11.957 -24.081  -5.559
 1783    HE2  LYS 115           HE3      LYS 115  13.712 -23.533  -7.173
 1784    HE3  LYS 115           HE2      LYS 115  14.926 -24.145  -6.048
 1785    HZ1  LYS 115           HZ1      LYS 115  12.734 -25.753  -7.240
 1786    HZ2  LYS 115           HZ2      LYS 115  13.939 -26.331  -6.204
 1787    HZ3  LYS 115           HZ3      LYS 115  14.345 -25.773  -7.748
 1788    H    ALA 116           H        ALA 116  14.082 -18.607  -2.912
 1789    HA   ALA 116           HA       ALA 116  14.774 -17.842  -5.675
 1790    HB1  ALA 116           HB1      ALA 116  12.350 -17.852  -5.354
 1791    HB2  ALA 116           HB2      ALA 116  12.959 -16.221  -5.640
 1792    HB3  ALA 116           HB3      ALA 116  12.523 -16.726  -4.008
 1793    H    THR 117           H        THR 117  16.108 -16.221  -5.928
 1794    HA   THR 117           HA       THR 117  17.660 -14.645  -5.537
 1795    HB   THR 117           HB       THR 117  17.063 -12.714  -4.115
 1796    HG1  THR 117           HG1      THR 117  15.287 -14.464  -3.073
 1797   HG21  THR 117          HG21      THR 117  16.401 -12.720  -6.426
 1798   HG22  THR 117          HG22      THR 117  15.099 -12.022  -5.462
 1799   HG23  THR 117          HG23      THR 117  14.970 -13.678  -6.054
 1800    H    ARG 118           H        ARG 118  18.918 -13.402  -3.769
 1801    HA   ARG 118           HA       ARG 118  20.509 -13.500  -2.195
 1802    HB2  ARG 118           HB3      ARG 118  18.606 -13.502  -0.642
 1803    HB3  ARG 118           HB2      ARG 118  18.527 -15.250  -0.732
 1804    HG2  ARG 118           HG3      ARG 118  19.603 -14.641   1.309
 1805    HG3  ARG 118           HG2      ARG 118  20.794 -15.374   0.242
 1806    HD2  ARG 118           HD3      ARG 118  20.438 -12.402   0.677
 1807    HD3  ARG 118           HD2      ARG 118  21.673 -13.401   1.435
 1808    HE   ARG 118           HE       ARG 118  21.922 -13.748  -1.308
 1809   HH11  ARG 118          HH11      ARG 118  22.319 -11.190   1.050
 1810   HH12  ARG 118          HH12      ARG 118  23.438 -10.293   0.070
 1811   HH21  ARG 118          HH21      ARG 118  23.377 -12.556  -2.604
 1812   HH22  ARG 118          HH22      ARG 118  24.039 -11.070  -1.999
  Start of MODEL   17
    1    H1   SER   1           H1       SER   1  23.036  -6.626 -17.516
    2    H2   SER   1           H2       SER   1  24.574  -6.482 -16.836
    3    H3   SER   1           H3       SER   1  23.778  -5.112 -17.416
    4    HA   SER   1           HA       SER   1  23.705  -5.190 -15.024
    5    HB2  SER   1           HB3      SER   1  21.822  -4.199 -16.315
    6    HB3  SER   1           HB2      SER   1  21.010  -5.761 -16.291
    7    HG   SER   1           HG       SER   1  20.727  -3.909 -14.538
    8    H    SER   2           H        SER   2  23.686  -6.416 -13.225
    9    HA   SER   2           HA       SER   2  22.438  -9.059 -13.318
   10    HB2  SER   2           HB3      SER   2  24.901  -9.227 -13.906
   11    HB3  SER   2           HB2      SER   2  25.251  -8.667 -12.273
   12    HG   SER   2           HG       SER   2  24.909 -11.114 -12.971
   13    H    THR   3           H        THR   3  21.601  -6.645 -12.065
   14    HA   THR   3           HA       THR   3  22.173  -6.978  -9.238
   15    HB   THR   3           HB       THR   3  20.410  -5.116  -9.035
   16    HG1  THR   3           HG1      THR   3  19.775  -5.599 -11.363
   17   HG21  THR   3          HG21      THR   3  22.794  -4.694  -8.792
   18   HG22  THR   3          HG22      THR   3  22.034  -3.383  -9.692
   19   HG23  THR   3          HG23      THR   3  22.977  -4.605 -10.541
   20    H    HIS   4           H        HIS   4  21.329  -9.048  -8.877
   21    HA   HIS   4           HA       HIS   4  18.402  -9.115  -8.697
   22    HB2  HIS   4           HB3      HIS   4  19.133 -10.355 -10.745
   23    HB3  HIS   4           HB2      HIS   4  20.078 -11.420  -9.716
   24    HD1  HIS   4           HD1      HIS   4  16.529 -10.585 -10.622
   25    HD2  HIS   4           HD2      HIS   4  18.642 -13.423  -8.438
   26    HE1  HIS   4           HE1      HIS   4  14.867 -12.387 -10.062
   27    HE2  HIS   4           HE2      HIS   4  16.195 -14.153  -8.855
   28    HA   PRO   5           HA       PRO   5  20.435 -10.524  -4.780
   29    HB2  PRO   5           HB3      PRO   5  19.374  -8.732  -3.108
   30    HB3  PRO   5           HB2      PRO   5  20.742  -8.305  -4.146
   31    HG2  PRO   5           HG3      PRO   5  17.829  -7.702  -4.501
   32    HG3  PRO   5           HG2      PRO   5  19.227  -6.645  -4.774
   33    HD2  PRO   5           HD3      PRO   5  17.894  -8.014  -6.763
   34    HD3  PRO   5           HD2      PRO   5  19.577  -7.471  -6.880
   35    H    VAL   6           H        VAL   6  18.214 -11.709  -6.059
   36    HA   VAL   6           HA       VAL   6  16.339 -12.953  -5.705
   37    HB   VAL   6           HB       VAL   6  17.094 -12.875  -2.781
   38   HG11  VAL   6          HG11      VAL   6  14.956 -13.940  -3.275
   39   HG12  VAL   6          HG12      VAL   6  16.142 -15.123  -2.730
   40   HG13  VAL   6          HG13      VAL   6  15.746 -14.999  -4.443
   41   HG21  VAL   6          HG21      VAL   6  18.526 -14.814  -3.211
   42   HG22  VAL   6          HG22      VAL   6  19.093 -13.379  -4.068
   43   HG23  VAL   6          HG23      VAL   6  18.228 -14.645  -4.940
   44    H    PHE   7           H        PHE   7  15.988 -10.153  -5.772
   45    HA   PHE   7           HA       PHE   7  14.581  -8.449  -5.256
   46    HB2  PHE   7           HB3      PHE   7  12.794 -10.832  -4.767
   47    HB3  PHE   7           HB2      PHE   7  12.206  -9.175  -4.732
   48    HD1  PHE   7           HD1      PHE   7  13.176 -11.954  -6.818
   49    HD2  PHE   7           HD2      PHE   7  12.329  -7.782  -6.785
   50    HE1  PHE   7           HE1      PHE   7  12.880 -11.996  -9.256
   51    HE2  PHE   7           HE2      PHE   7  12.029  -7.819  -9.225
   52    HZ   PHE   7           HZ       PHE   7  12.304  -9.927 -10.467
   53    H    HIS   8           H        HIS   8  16.325  -9.321  -3.153
   54    HA   HIS   8           HA       HIS   8  16.783  -8.834  -0.986
   55    HB2  HIS   8           HB3      HIS   8  14.231  -7.205  -1.139
   56    HB3  HIS   8           HB2      HIS   8  15.414  -7.112   0.161
   57    HD1  HIS   8           HD1      HIS   8  14.583  -5.701  -3.110
   58    HD2  HIS   8           HD2      HIS   8  17.990  -6.063  -0.733
   59    HE1  HIS   8           HE1      HIS   8  16.253  -4.067  -4.047
   60    HE2  HIS   8           HE2      HIS   8  18.234  -4.188  -2.492
   61    H    MET   9           H        MET   9  14.735 -10.948  -1.897
   62    HA   MET   9           HA       MET   9  13.153 -12.368  -1.115
   63    HB2  MET   9           HB3      MET   9  13.842 -13.636   0.862
   64    HB3  MET   9           HB2      MET   9  15.187 -13.355  -0.225
   65    HG2  MET   9           HG3      MET   9  15.907 -11.490   1.257
   66    HG3  MET   9           HG2      MET   9  14.633 -11.955   2.378
   67    HE1  MET   9           HE1      MET   9  16.877 -14.328   0.163
   68    HE2  MET   9           HE2      MET   9  18.211 -14.654   1.271
   69    HE3  MET   9           HE3      MET   9  17.970 -13.027   0.633
   70    H    GLY  10           H        GLY  10  12.336  -9.751  -0.763
   71    HA2  GLY  10           HA3      GLY  10  10.574 -10.058   1.556
   72    HA3  GLY  10           HA2      GLY  10  11.578  -8.620   1.485
   73    H    GLU  11           H        GLU  11  11.309  -8.483  -1.488
   74    HA   GLU  11           HA       GLU  11   8.663  -7.238  -1.479
   75    HB2  GLU  11           HB3      GLU  11   9.388  -6.000  -3.452
   76    HB3  GLU  11           HB2      GLU  11  10.550  -5.820  -2.144
   77    HG2  GLU  11           HG3      GLU  11  11.957  -7.561  -3.233
   78    HG3  GLU  11           HG2      GLU  11  10.830  -7.550  -4.591
   79    H    PHE  12           H        PHE  12   8.731 -10.007  -1.572
   80    HA   PHE  12           HA       PHE  12   8.048 -10.720  -4.326
   81    HB2  PHE  12           HB3      PHE  12   8.605 -12.299  -1.843
   82    HB3  PHE  12           HB2      PHE  12   7.625 -13.024  -3.110
   83    HD1  PHE  12           HD1      PHE  12  10.920 -12.368  -1.951
   84    HD2  PHE  12           HD2      PHE  12   8.621 -13.115  -5.453
   85    HE1  PHE  12           HE1      PHE  12  12.955 -13.070  -3.136
   86    HE2  PHE  12           HE2      PHE  12  10.654 -13.817  -6.644
   87    HZ   PHE  12           HZ       PHE  12  12.826 -13.797  -5.484
   88    H    SER  13           H        SER  13   6.026 -11.692  -4.813
   89    HA   SER  13           HA       SER  13   3.941 -11.639  -2.805
   90    HB2  SER  13           HB3      SER  13   3.867  -9.357  -3.772
   91    HB3  SER  13           HB2      SER  13   3.696 -10.049  -5.380
   92    HG   SER  13           HG       SER  13   1.708  -9.372  -4.208
   93    H    VAL  14           H        VAL  14   2.244 -13.021  -3.295
   94    HA   VAL  14           HA       VAL  14   2.782 -15.153  -5.097
   95    HB   VAL  14           HB       VAL  14   0.561 -16.008  -4.474
   96   HG11  VAL  14          HG11      VAL  14   2.431 -16.428  -2.975
   97   HG12  VAL  14          HG12      VAL  14   0.933 -16.233  -2.064
   98   HG13  VAL  14          HG13      VAL  14   2.107 -14.917  -2.126
   99   HG21  VAL  14          HG21      VAL  14  -0.637 -13.871  -4.424
  100   HG22  VAL  14          HG22      VAL  14   0.232 -13.421  -2.957
  101   HG23  VAL  14          HG23      VAL  14  -0.879 -14.789  -2.937
  102    H    CYS  15           H        CYS  15   1.386 -12.119  -5.471
  103    HA   CYS  15           HA       CYS  15   0.139 -12.873  -8.027
  104    HB2  CYS  15           HB3      CYS  15  -0.368 -10.503  -6.207
  105    HB3  CYS  15           HB2      CYS  15  -1.105 -10.719  -7.797
  106    H    ASP  16           H        ASP  16   0.925 -11.955  -9.874
  107    HA   ASP  16           HA       ASP  16   3.389 -10.559  -9.810
  108    HB2  ASP  16           HB3      ASP  16   1.374 -10.892 -12.049
  109    HB3  ASP  16           HB2      ASP  16   2.933 -10.104 -12.253
  110    H    SER  17           H        SER  17   3.699  -8.565  -9.206
  111    HA   SER  17           HA       SER  17   1.459  -6.670  -9.432
  112    HB2  SER  17           HB3      SER  17   3.596  -6.758  -7.285
  113    HB3  SER  17           HB2      SER  17   2.209  -5.663  -7.344
  114    HG   SER  17           HG       SER  17   1.975  -8.495  -7.256
  115    H    VAL  18           H        VAL  18   1.850  -4.756 -10.366
  116    HA   VAL  18           HA       VAL  18   4.656  -4.123 -10.982
  117    HB   VAL  18           HB       VAL  18   3.523  -4.625 -13.031
  118   HG11  VAL  18          HG11      VAL  18   1.431  -2.621 -12.214
  119   HG12  VAL  18          HG12      VAL  18   1.229  -4.372 -12.321
  120   HG13  VAL  18          HG13      VAL  18   1.525  -3.428 -13.780
  121   HG21  VAL  18          HG21      VAL  18   3.795  -1.643 -12.703
  122   HG22  VAL  18          HG22      VAL  18   3.729  -2.500 -14.243
  123   HG23  VAL  18          HG23      VAL  18   5.075  -2.775 -13.139
  124    H    SER  19           H        SER  19   5.364  -2.506  -9.782
  125    HA   SER  19           HA       SER  19   3.477  -0.528  -8.761
  126    HB2  SER  19           HB3      SER  19   6.380  -1.035  -8.048
  127    HB3  SER  19           HB2      SER  19   5.336   0.158  -7.275
  128    HG   SER  19           HG       SER  19   4.066  -1.477  -6.463
  129    H    VAL  20           H        VAL  20   3.234   1.321  -9.772
  130    HA   VAL  20           HA       VAL  20   5.450   2.328 -11.434
  131    HB   VAL  20           HB       VAL  20   2.486   2.715 -11.876
  132   HG11  VAL  20          HG11      VAL  20   3.149   3.701 -14.019
  133   HG12  VAL  20          HG12      VAL  20   4.841   3.565 -13.542
  134   HG13  VAL  20          HG13      VAL  20   3.752   4.622 -12.642
  135   HG21  VAL  20          HG21      VAL  20   3.157   0.429 -12.350
  136   HG22  VAL  20          HG22      VAL  20   4.459   1.013 -13.386
  137   HG23  VAL  20          HG23      VAL  20   2.778   1.288 -13.844
  138    H    TRP  21           H        TRP  21   6.096   4.372 -11.087
  139    HA   TRP  21           HA       TRP  21   4.587   6.001  -9.174
  140    HB2  TRP  21           HB3      TRP  21   7.372   6.365 -10.326
  141    HB3  TRP  21           HB2      TRP  21   6.606   7.470  -9.192
  142    HD1  TRP  21           HD1      TRP  21   8.189   3.980  -9.370
  143    HE1  TRP  21           HE1      TRP  21   8.746   3.202  -6.984
  144    HE3  TRP  21           HE3      TRP  21   5.941   7.755  -6.735
  145    HZ2  TRP  21           HZ2      TRP  21   8.302   4.072  -4.339
  146    HZ3  TRP  21           HZ3      TRP  21   6.062   7.703  -4.276
  147    HH2  TRP  21           HH2      TRP  21   7.216   5.898  -3.106
  148    H    VAL  22           H        VAL  22   2.935   6.814 -10.361
  149    HA   VAL  22           HA       VAL  22   3.331   7.743 -13.061
  150    HB   VAL  22           HB       VAL  22   0.906   8.072 -11.290
  151   HG11  VAL  22          HG11      VAL  22  -0.312   8.259 -13.428
  152   HG12  VAL  22          HG12      VAL  22   1.237   8.260 -14.272
  153   HG13  VAL  22          HG13      VAL  22   0.836   9.571 -13.163
  154   HG21  VAL  22          HG21      VAL  22   1.559   5.879 -13.249
  155   HG22  VAL  22          HG22      VAL  22   0.017   6.084 -12.418
  156   HG23  VAL  22          HG23      VAL  22   1.475   5.719 -11.495
  157    H    GLY  23           H        GLY  23   3.571   9.822 -13.741
  158    HA2  GLY  23           HA3      GLY  23   4.029  11.794 -11.614
  159    HA3  GLY  23           HA2      GLY  23   4.686  11.873 -13.245
  160    H    ASP  24           H        ASP  24   1.657  10.992 -13.832
  161    HA   ASP  24           HA       ASP  24   0.396  13.586 -13.469
  162    HB2  ASP  24           HB3      ASP  24   1.568  13.904 -15.574
  163    HB3  ASP  24           HB2      ASP  24   0.913  12.393 -16.201
  164    H    LYS  25           H        LYS  25  -1.332  12.856 -12.397
  165    HA   LYS  25           HA       LYS  25  -3.112  11.018 -13.842
  166    HB2  LYS  25           HB3      LYS  25  -2.083   9.942 -11.833
  167    HB3  LYS  25           HB2      LYS  25  -2.791  11.202 -10.837
  168    HG2  LYS  25           HG3      LYS  25  -5.010  10.464 -11.375
  169    HG3  LYS  25           HG2      LYS  25  -4.379   9.280 -12.524
  170    HD2  LYS  25           HD3      LYS  25  -3.213   8.146 -10.670
  171    HD3  LYS  25           HD2      LYS  25  -3.910   9.308  -9.544
  172    HE2  LYS  25           HE3      LYS  25  -6.147   8.551 -10.097
  173    HE3  LYS  25           HE2      LYS  25  -5.502   7.438 -11.305
  174    HZ1  LYS  25           HZ1      LYS  25  -6.035   6.299  -9.254
  175    HZ2  LYS  25           HZ2      LYS  25  -4.996   7.305  -8.383
  176    HZ3  LYS  25           HZ3      LYS  25  -4.363   6.237  -9.537
  177    H    THR  26           H        THR  26  -4.609  12.390 -14.637
  178    HA   THR  26           HA       THR  26  -5.015  14.938 -13.363
  179    HB   THR  26           HB       THR  26  -4.762  14.844 -15.787
  180    HG1  THR  26           HG1      THR  26  -6.911  15.971 -14.505
  181   HG21  THR  26          HG21      THR  26  -6.597  13.955 -17.191
  182   HG22  THR  26          HG22      THR  26  -7.349  13.290 -15.739
  183   HG23  THR  26          HG23      THR  26  -5.773  12.701 -16.265
  184    H    THR  27           H        THR  27  -6.597  11.950 -13.174
  185    HA   THR  27           HA       THR  27  -8.832  13.239 -11.814
  186    HB   THR  27           HB       THR  27 -10.298  11.358 -12.939
  187    HG1  THR  27           HG1      THR  27  -8.009  11.276 -14.357
  188   HG21  THR  27          HG21      THR  27 -10.788  13.737 -13.072
  189   HG22  THR  27          HG22      THR  27 -11.002  12.986 -14.653
  190   HG23  THR  27          HG23      THR  27  -9.558  13.941 -14.319
  191    H    ALA  28           H        ALA  28  -9.480  12.207 -10.031
  192    HA   ALA  28           HA       ALA  28  -8.881   9.372  -9.690
  193    HB1  ALA  28           HB1      ALA  28  -6.881  10.491  -8.834
  194    HB2  ALA  28           HB2      ALA  28  -7.781   9.703  -7.539
  195    HB3  ALA  28           HB3      ALA  28  -7.884  11.451  -7.746
  196    H    THR  29           H        THR  29  -9.804   8.618  -7.536
  197    HA   THR  29           HA       THR  29 -12.403   9.926  -7.168
  198    HB   THR  29           HB       THR  29 -11.613   7.158  -6.258
  199    HG1  THR  29           HG1      THR  29 -12.788   8.029  -8.706
  200   HG21  THR  29          HG21      THR  29 -13.573   8.108  -5.146
  201   HG22  THR  29          HG22      THR  29 -14.035   6.782  -6.213
  202   HG23  THR  29          HG23      THR  29 -14.302   8.452  -6.716
  203    H    ASP  30           H        ASP  30 -12.647  11.133  -5.433
  204    HA   ASP  30           HA       ASP  30 -10.835  11.188  -3.240
  205    HB2  ASP  30           HB3      ASP  30 -12.147  13.171  -3.881
  206    HB3  ASP  30           HB2      ASP  30 -13.645  12.316  -3.507
  207    H    ILE  31           H        ILE  31 -11.433  10.727  -0.981
  208    HA   ILE  31           HA       ILE  31 -12.196   8.088  -0.588
  209    HB   ILE  31           HB       ILE  31 -10.858   9.296   1.039
  210   HG12  ILE  31          HG13      ILE  31 -13.493   8.416   2.246
  211   HG13  ILE  31          HG12      ILE  31 -12.147   7.356   1.839
  212   HG21  ILE  31          HG21      ILE  31 -11.817  10.981   2.523
  213   HG22  ILE  31          HG22      ILE  31 -13.344  10.889   1.647
  214   HG23  ILE  31          HG23      ILE  31 -11.899  11.490   0.836
  215   HD11  ILE  31          HD11      ILE  31 -12.202   7.805   4.211
  216   HD12  ILE  31          HD12      ILE  31 -12.130   9.541   3.907
  217   HD13  ILE  31          HD13      ILE  31 -10.758   8.515   3.490
  218    H    LYS  32           H        LYS  32 -14.171  10.941  -0.802
  219    HA   LYS  32           HA       LYS  32 -16.476   9.776   0.470
  220    HB2  LYS  32           HB3      LYS  32 -16.297  12.230  -1.280
  221    HB3  LYS  32           HB2      LYS  32 -17.600  11.828  -0.165
  222    HG2  LYS  32           HG3      LYS  32 -16.167  12.122   1.720
  223    HG3  LYS  32           HG2      LYS  32 -14.752  12.295   0.683
  224    HD2  LYS  32           HD3      LYS  32 -16.100  14.277  -0.333
  225    HD3  LYS  32           HD2      LYS  32 -16.978  14.216   1.199
  226    HE2  LYS  32           HE3      LYS  32 -15.229  15.762   1.533
  227    HE3  LYS  32           HE2      LYS  32 -14.712  14.276   2.331
  228    HZ1  LYS  32           HZ1      LYS  32 -13.476  13.760   0.209
  229    HZ2  LYS  32           HZ2      LYS  32 -12.869  15.054   1.118
  230    HZ3  LYS  32           HZ3      LYS  32 -13.785  15.356  -0.265
  231    H    GLY  33           H        GLY  33 -15.053   9.463  -2.562
  232    HA2  GLY  33           HA3      GLY  33 -15.848   7.914  -4.172
  233    HA3  GLY  33           HA2      GLY  33 -17.486   8.184  -3.586
  234    H    LYS  34           H        LYS  34 -15.390  10.874  -4.206
  235    HA   LYS  34           HA       LYS  34 -17.130  11.654  -6.433
  236    HB2  LYS  34           HB3      LYS  34 -15.227  13.318  -4.781
  237    HB3  LYS  34           HB2      LYS  34 -16.296  13.932  -6.030
  238    HG2  LYS  34           HG3      LYS  34 -17.143  12.651  -3.444
  239    HG3  LYS  34           HG2      LYS  34 -17.183  14.368  -3.818
  240    HD2  LYS  34           HD3      LYS  34 -18.746  13.877  -5.676
  241    HD3  LYS  34           HD2      LYS  34 -18.780  12.192  -5.153
  242    HE2  LYS  34           HE3      LYS  34 -20.695  13.266  -4.225
  243    HE3  LYS  34           HE2      LYS  34 -19.550  12.994  -2.918
  244    HZ1  LYS  34           HZ1      LYS  34 -18.854  15.299  -3.093
  245    HZ2  LYS  34           HZ2      LYS  34 -20.513  15.201  -2.796
  246    HZ3  LYS  34           HZ3      LYS  34 -19.953  15.563  -4.349
  247    H    GLU  35           H        GLU  35 -16.320  12.207  -8.419
  248    HA   GLU  35           HA       GLU  35 -13.587  11.400  -9.002
  249    HB2  GLU  35           HB3      GLU  35 -15.353  10.714 -10.554
  250    HB3  GLU  35           HB2      GLU  35 -15.808  12.395 -10.800
  251    HG2  GLU  35           HG3      GLU  35 -13.651  12.846 -11.825
  252    HG3  GLU  35           HG2      GLU  35 -13.159  11.178 -11.549
  253    H    VAL  36           H        VAL  36 -11.995  12.819  -8.812
  254    HA   VAL  36           HA       VAL  36 -12.636  15.668  -9.166
  255    HB   VAL  36           HB       VAL  36 -10.891  16.148  -7.441
  256   HG11  VAL  36          HG11      VAL  36 -12.313  15.565  -5.515
  257   HG12  VAL  36          HG12      VAL  36 -13.263  14.513  -6.565
  258   HG13  VAL  36          HG13      VAL  36 -13.231  16.255  -6.853
  259   HG21  VAL  36          HG21      VAL  36  -9.679  14.037  -7.534
  260   HG22  VAL  36          HG22      VAL  36 -11.097  13.185  -6.923
  261   HG23  VAL  36          HG23      VAL  36 -10.261  14.349  -5.897
  262    H    THR  37           H        THR  37 -11.070  17.001 -10.036
  263    HA   THR  37           HA       THR  37  -9.196  15.721 -11.814
  264    HB   THR  37           HB       THR  37  -9.619  18.676 -11.346
  265    HG1  THR  37           HG1      THR  37 -11.234  18.587 -12.824
  266   HG21  THR  37          HG21      THR  37  -8.516  17.152 -13.710
  267   HG22  THR  37          HG22      THR  37  -7.576  18.117 -12.570
  268   HG23  THR  37          HG23      THR  37  -8.750  18.899 -13.630
  269    H    VAL  38           H        VAL  38  -7.305  15.089 -11.032
  270    HA   VAL  38           HA       VAL  38  -6.218  16.335  -8.647
  271    HB   VAL  38           HB       VAL  38  -5.215  13.941 -10.192
  272   HG11  VAL  38          HG11      VAL  38  -4.527  14.943  -7.435
  273   HG12  VAL  38          HG12      VAL  38  -3.472  14.968  -8.849
  274   HG13  VAL  38          HG13      VAL  38  -3.969  13.428  -8.142
  275   HG21  VAL  38          HG21      VAL  38  -6.911  14.068  -7.706
  276   HG22  VAL  38          HG22      VAL  38  -6.262  12.603  -8.439
  277   HG23  VAL  38          HG23      VAL  38  -7.455  13.570  -9.307
  278    H    LEU  39           H        LEU  39  -4.458  17.590  -8.584
  279    HA   LEU  39           HA       LEU  39  -3.139  18.211 -11.127
  280    HB2  LEU  39           HB3      LEU  39  -3.004  19.740  -8.524
  281    HB3  LEU  39           HB2      LEU  39  -2.468  20.289 -10.104
  282    HG   LEU  39           HG       LEU  39  -5.340  19.761  -9.334
  283   HD11  LEU  39          HD11      LEU  39  -3.866  22.362  -9.700
  284   HD12  LEU  39          HD12      LEU  39  -4.425  21.692  -8.167
  285   HD13  LEU  39          HD13      LEU  39  -5.594  22.184  -9.393
  286   HD21  LEU  39          HD21      LEU  39  -4.932  19.393 -11.702
  287   HD22  LEU  39          HD22      LEU  39  -4.145  20.967 -11.825
  288   HD23  LEU  39          HD23      LEU  39  -5.866  20.867 -11.451
  289    H    ALA  40           H        ALA  40  -1.220  17.320 -11.466
  290    HA   ALA  40           HA       ALA  40   0.201  15.891  -9.455
  291    HB1  ALA  40           HB1      ALA  40   1.118  16.738 -12.200
  292    HB2  ALA  40           HB2      ALA  40   0.262  15.244 -11.818
  293    HB3  ALA  40           HB3      ALA  40   1.882  15.522 -11.177
  294    H    GLU  41           H        GLU  41   0.197  19.105 -10.592
  295    HA   GLU  41           HA       GLU  41   2.626  19.777  -9.082
  296    HB2  GLU  41           HB3      GLU  41   1.003  21.448 -11.022
  297    HB3  GLU  41           HB2      GLU  41   2.515  21.927 -10.270
  298    HG2  GLU  41           HG3      GLU  41   2.344  19.499 -12.007
  299    HG3  GLU  41           HG2      GLU  41   2.549  21.110 -12.694
  300    H    VAL  42           H        VAL  42   2.213  20.429  -7.029
  301    HA   VAL  42           HA       VAL  42  -0.455  21.523  -6.481
  302    HB   VAL  42           HB       VAL  42  -0.121  20.976  -4.141
  303   HG11  VAL  42          HG11      VAL  42  -0.005  18.532  -4.302
  304   HG12  VAL  42          HG12      VAL  42   0.610  18.681  -5.948
  305   HG13  VAL  42          HG13      VAL  42  -1.019  19.235  -5.564
  306   HG21  VAL  42          HG21      VAL  42   1.855  19.779  -3.355
  307   HG22  VAL  42          HG22      VAL  42   2.274  21.381  -3.964
  308   HG23  VAL  42          HG23      VAL  42   2.595  19.950  -4.946
  309    H    ASN  43           H        ASN  43  -0.719  23.585  -5.953
  310    HA   ASN  43           HA       ASN  43   1.702  25.187  -5.571
  311    HB2  ASN  43           HB3      ASN  43   0.407  27.127  -6.298
  312    HB3  ASN  43           HB2      ASN  43   0.290  25.840  -7.492
  313   HD21  ASN  43          HD21      ASN  43  -1.696  24.839  -7.844
  314   HD22  ASN  43          HD22      ASN  43  -3.175  25.488  -7.226
  315    H    ILE  44           H        ILE  44   2.191  25.694  -3.594
  316    HA   ILE  44           HA       ILE  44   0.005  26.323  -1.713
  317    HB   ILE  44           HB       ILE  44   2.792  25.397  -0.979
  318   HG12  ILE  44          HG13      ILE  44   0.190  23.848  -0.920
  319   HG13  ILE  44          HG12      ILE  44   1.496  23.598  -2.079
  320   HG21  ILE  44          HG21      ILE  44   0.313  25.735   0.709
  321   HG22  ILE  44          HG22      ILE  44   1.691  26.834   0.682
  322   HG23  ILE  44          HG23      ILE  44   1.891  25.185   1.272
  323   HD11  ILE  44          HD11      ILE  44   2.982  22.996  -0.194
  324   HD12  ILE  44          HD12      ILE  44   1.608  21.909  -0.385
  325   HD13  ILE  44          HD13      ILE  44   1.599  23.126   0.890
  326    H    ASN  45           H        ASN  45  -0.084  28.472  -2.355
  327    HA   ASN  45           HA       ASN  45   0.389  30.689  -2.269
  328    HB2  ASN  45           HB3      ASN  45   2.435  29.734  -0.253
  329    HB3  ASN  45           HB2      ASN  45   2.237  31.434  -0.660
  330   HD21  ASN  45          HD21      ASN  45  -0.458  29.215  -0.555
  331   HD22  ASN  45          HD22      ASN  45  -1.189  29.874   0.865
  332    H    ASN  46           H        ASN  46   1.154  29.584  -4.452
  333    HA   ASN  46           HA       ASN  46   2.362  29.975  -6.319
  334    HB2  ASN  46           HB3      ASN  46   3.838  31.909  -4.544
  335    HB3  ASN  46           HB2      ASN  46   4.288  31.637  -6.223
  336   HD21  ASN  46          HD21      ASN  46   2.960  32.373  -7.854
  337   HD22  ASN  46          HD22      ASN  46   1.652  33.466  -7.573
  338    H    SER  47           H        SER  47   3.720  28.641  -3.514
  339    HA   SER  47           HA       SER  47   6.141  27.759  -4.838
  340    HB2  SER  47           HB3      SER  47   4.950  26.894  -2.183
  341    HB3  SER  47           HB2      SER  47   6.574  26.519  -2.761
  342    HG   SER  47           HG       SER  47   6.071  29.185  -2.848
  343    H    VAL  48           H        VAL  48   6.058  26.186  -6.285
  344    HA   VAL  48           HA       VAL  48   3.868  24.231  -6.101
  345    HB   VAL  48           HB       VAL  48   5.373  25.083  -8.581
  346   HG11  VAL  48          HG11      VAL  48   3.602  23.906  -9.786
  347   HG12  VAL  48          HG12      VAL  48   2.892  23.405  -8.253
  348   HG13  VAL  48          HG13      VAL  48   4.491  22.821  -8.717
  349   HG21  VAL  48          HG21      VAL  48   4.023  26.923  -7.707
  350   HG22  VAL  48          HG22      VAL  48   2.608  25.872  -7.676
  351   HG23  VAL  48          HG23      VAL  48   3.355  26.298  -9.214
  352    H    PHE  49           H        PHE  49   4.399  22.165  -5.811
  353    HA   PHE  49           HA       PHE  49   6.907  21.203  -6.944
  354    HB2  PHE  49           HB3      PHE  49   7.490  19.892  -4.981
  355    HB3  PHE  49           HB2      PHE  49   7.363  21.586  -4.531
  356    HD1  PHE  49           HD1      PHE  49   5.647  22.344  -3.014
  357    HD2  PHE  49           HD2      PHE  49   5.876  18.260  -4.202
  358    HE1  PHE  49           HE1      PHE  49   4.146  21.716  -1.164
  359    HE2  PHE  49           HE2      PHE  49   4.373  17.635  -2.362
  360    HZ   PHE  49           HZ       PHE  49   3.506  19.363  -0.838
  361    H    ARG  50           H        ARG  50   6.887  18.876  -7.313
  362    HA   ARG  50           HA       ARG  50   4.167  18.144  -8.105
  363    HB2  ARG  50           HB3      ARG  50   5.162  16.694  -9.743
  364    HB3  ARG  50           HB2      ARG  50   5.943  18.262  -9.844
  365    HG2  ARG  50           HG3      ARG  50   7.846  17.362  -8.564
  366    HG3  ARG  50           HG2      ARG  50   7.058  15.783  -8.550
  367    HD2  ARG  50           HD3      ARG  50   7.047  15.836 -11.035
  368    HD3  ARG  50           HD2      ARG  50   7.980  17.330 -10.967
  369    HE   ARG  50           HE       ARG  50   9.187  15.163  -9.508
  370   HH11  ARG  50          HH11      ARG  50   8.860  16.677 -12.645
  371   HH12  ARG  50          HH12      ARG  50  10.337  16.012 -13.260
  372   HH21  ARG  50          HH21      ARG  50  11.124  14.273 -10.315
  373   HH22  ARG  50          HH22      ARG  50  11.627  14.635 -11.939
  374    H    GLN  51           H        GLN  51   3.372  16.042  -7.853
  375    HA   GLN  51           HA       GLN  51   4.689  14.489  -5.721
  376    HB2  GLN  51           HB3      GLN  51   2.443  13.685  -5.081
  377    HB3  GLN  51           HB2      GLN  51   2.580  15.431  -4.927
  378    HG2  GLN  51           HG3      GLN  51   1.368  15.740  -7.000
  379    HG3  GLN  51           HG2      GLN  51   1.288  13.994  -7.238
  380   HE21  GLN  51          HE21      GLN  51  -0.079  12.767  -5.945
  381   HE22  GLN  51          HE22      GLN  51  -1.367  13.486  -5.035
  382    H    TYR  52           H        TYR  52   4.362  12.157  -5.845
  383    HA   TYR  52           HA       TYR  52   4.002  11.239  -8.623
  384    HB2  TYR  52           HB3      TYR  52   5.738   9.911  -6.523
  385    HB3  TYR  52           HB2      TYR  52   5.669   9.541  -8.242
  386    HD1  TYR  52           HD1      TYR  52   6.618  11.186  -9.887
  387    HD2  TYR  52           HD2      TYR  52   7.131  11.623  -5.685
  388    HE1  TYR  52           HE1      TYR  52   8.469  12.755 -10.278
  389    HE2  TYR  52           HE2      TYR  52   8.981  13.194  -6.067
  390    HH   TYR  52           HH       TYR  52  10.610  13.730  -7.834
  391    H    PHE  53           H        PHE  53   2.669   9.501  -8.949
  392    HA   PHE  53           HA       PHE  53   1.121   8.659  -6.605
  393    HB2  PHE  53           HB3      PHE  53   0.468   8.150  -9.515
  394    HB3  PHE  53           HB2      PHE  53  -0.616   8.009  -8.138
  395    HD1  PHE  53           HD1      PHE  53  -1.529   9.999  -7.068
  396    HD2  PHE  53           HD2      PHE  53   0.981  10.283 -10.487
  397    HE1  PHE  53           HE1      PHE  53  -2.245  12.329  -7.395
  398    HE2  PHE  53           HE2      PHE  53   0.274  12.612 -10.822
  399    HZ   PHE  53           HZ       PHE  53  -1.339  13.638  -9.277
  400    H    PHE  54           H        PHE  54   1.895   6.901  -5.668
  401    HA   PHE  54           HA       PHE  54   3.360   4.895  -7.155
  402    HB2  PHE  54           HB3      PHE  54   4.152   5.543  -4.930
  403    HB3  PHE  54           HB2      PHE  54   2.604   5.101  -4.222
  404    HD1  PHE  54           HD1      PHE  54   2.380   3.022  -3.249
  405    HD2  PHE  54           HD2      PHE  54   5.392   3.616  -6.197
  406    HE1  PHE  54           HE1      PHE  54   3.232   0.753  -2.832
  407    HE2  PHE  54           HE2      PHE  54   6.246   1.347  -5.785
  408    HZ   PHE  54           HZ       PHE  54   5.169  -0.087  -4.101
  409    H    GLU  55           H        GLU  55   2.023   3.738  -8.445
  410    HA   GLU  55           HA       GLU  55  -0.350   2.535  -7.175
  411    HB2  GLU  55           HB3      GLU  55   0.098   2.898 -10.146
  412    HB3  GLU  55           HB2      GLU  55  -1.387   2.404  -9.344
  413    HG2  GLU  55           HG3      GLU  55  -1.324   4.702  -8.209
  414    HG3  GLU  55           HG2      GLU  55  -0.115   5.123  -9.425
  415    H    THR  56           H        THR  56   0.051   0.537  -6.581
  416    HA   THR  56           HA       THR  56   1.733  -1.185  -8.258
  417    HB   THR  56           HB       THR  56   0.613  -1.752  -5.501
  418    HG1  THR  56           HG1      THR  56   2.230  -0.584  -4.822
  419   HG21  THR  56          HG21      THR  56   1.088  -3.780  -6.779
  420   HG22  THR  56          HG22      THR  56   2.264  -3.581  -5.479
  421   HG23  THR  56          HG23      THR  56   2.711  -3.188  -7.139
  422    H    LYS  57           H        LYS  57   0.654  -2.230  -9.779
  423    HA   LYS  57           HA       LYS  57  -2.193  -2.801  -9.303
  424    HB2  LYS  57           HB3      LYS  57  -0.709  -2.252 -11.883
  425    HB3  LYS  57           HB2      LYS  57  -2.420  -2.664 -11.777
  426    HG2  LYS  57           HG3      LYS  57  -2.913  -0.656 -10.605
  427    HG3  LYS  57           HG2      LYS  57  -1.205  -0.286 -10.394
  428    HD2  LYS  57           HD3      LYS  57  -0.997  -0.055 -12.847
  429    HD3  LYS  57           HD2      LYS  57  -2.736  -0.322 -12.991
  430    HE2  LYS  57           HE3      LYS  57  -3.191   1.644 -11.688
  431    HE3  LYS  57           HE2      LYS  57  -1.476   1.877 -11.374
  432    HZ1  LYS  57           HZ1      LYS  57  -2.172   3.371 -13.074
  433    HZ2  LYS  57           HZ2      LYS  57  -2.846   2.118 -13.993
  434    HZ3  LYS  57           HZ3      LYS  57  -1.171   2.204 -13.784
  435    H    CYS  58           H        CYS  58  -3.093  -4.692 -10.110
  436    HA   CYS  58           HA       CYS  58  -1.310  -6.969 -10.030
  437    HB2  CYS  58           HB3      CYS  58  -4.309  -6.912 -10.476
  438    HB3  CYS  58           HB2      CYS  58  -3.345  -8.310 -10.030
  439    H    ARG  59           H        ARG  59  -0.126  -6.892 -11.929
  440    HA   ARG  59           HA       ARG  59  -1.332  -6.487 -14.476
  441    HB2  ARG  59           HB3      ARG  59   0.845  -7.232 -15.398
  442    HB3  ARG  59           HB2      ARG  59   1.007  -5.967 -14.191
  443    HG2  ARG  59           HG3      ARG  59   1.721  -7.557 -12.547
  444    HG3  ARG  59           HG2      ARG  59   1.414  -8.895 -13.653
  445    HD2  ARG  59           HD3      ARG  59   3.423  -6.689 -14.084
  446    HD3  ARG  59           HD2      ARG  59   3.801  -8.315 -13.519
  447    HE   ARG  59           HE       ARG  59   2.403  -8.534 -15.932
  448   HH11  ARG  59          HH11      ARG  59   5.481  -7.365 -14.753
  449   HH12  ARG  59          HH12      ARG  59   6.317  -7.686 -16.240
  450   HH21  ARG  59          HH21      ARG  59   3.494  -8.967 -17.890
  451   HH22  ARG  59          HH22      ARG  59   5.185  -8.605 -18.026
  452    H    ALA  60           H        ALA  60  -0.875  -9.212 -12.431
  453    HA   ALA  60           HA       ALA  60  -2.381 -10.812 -14.378
  454    HB1  ALA  60           HB1      ALA  60  -0.004 -11.560 -14.362
  455    HB2  ALA  60           HB2      ALA  60  -1.138 -12.805 -13.838
  456    HB3  ALA  60           HB3      ALA  60  -0.176 -11.934 -12.647
  457    H    SER  61           H        SER  61  -4.328 -10.782 -13.415
  458    HA   SER  61           HA       SER  61  -4.644 -10.800 -10.572
  459    HB2  SER  61           HB3      SER  61  -6.254  -9.678 -12.104
  460    HB3  SER  61           HB2      SER  61  -6.730 -11.259 -12.719
  461    HG   SER  61           HG       SER  61  -7.128 -10.167 -10.137
  462    H    ASN  62           H        ASN  62  -4.543 -13.163 -13.090
  463    HA   ASN  62           HA       ASN  62  -4.713 -15.266 -11.049
  464    HB2  ASN  62           HB3      ASN  62  -6.021 -15.299 -13.777
  465    HB3  ASN  62           HB2      ASN  62  -5.738 -16.757 -12.836
  466   HD21  ASN  62          HD21      ASN  62  -6.316 -15.445 -10.282
  467   HD22  ASN  62          HD22      ASN  62  -8.030 -15.245 -10.237
  468    HA   PRO  63           HA       PRO  63  -0.651 -15.412 -13.306
  469    HB2  PRO  63           HB3      PRO  63   0.520 -16.751 -11.158
  470    HB3  PRO  63           HB2      PRO  63   0.608 -15.010 -11.457
  471    HG2  PRO  63           HG3      PRO  63  -1.179 -16.548  -9.635
  472    HG3  PRO  63           HG2      PRO  63  -0.430 -14.959  -9.395
  473    HD2  PRO  63           HD3      PRO  63  -3.038 -15.201 -10.019
  474    HD3  PRO  63           HD2      PRO  63  -2.051 -13.863 -10.667
  475    H    VAL  64           H        VAL  64  -2.404 -17.882 -11.460
  476    HA   VAL  64           HA       VAL  64  -1.389 -19.875 -13.368
  477    HB   VAL  64           HB       VAL  64  -2.048 -21.616 -11.759
  478   HG11  VAL  64          HG11      VAL  64  -0.252 -19.504 -10.585
  479   HG12  VAL  64          HG12      VAL  64   0.225 -20.762 -11.724
  480   HG13  VAL  64          HG13      VAL  64  -0.306 -21.199 -10.101
  481   HG21  VAL  64          HG21      VAL  64  -3.863 -20.428 -10.639
  482   HG22  VAL  64          HG22      VAL  64  -2.692 -19.331  -9.906
  483   HG23  VAL  64          HG23      VAL  64  -2.682 -21.043  -9.482
  484    H    GLU  65           H        GLU  65  -3.211 -21.817 -13.292
  485    HA   GLU  65           HA       GLU  65  -4.995 -21.037 -15.213
  486    HB2  GLU  65           HB3      GLU  65  -6.179 -23.171 -14.783
  487    HB3  GLU  65           HB2      GLU  65  -4.436 -23.350 -14.901
  488    HG2  GLU  65           HG3      GLU  65  -4.276 -23.457 -12.471
  489    HG3  GLU  65           HG2      GLU  65  -6.022 -23.258 -12.349
  490    H    SER  66           H        SER  66  -5.664 -21.199 -11.716
  491    HA   SER  66           HA       SER  66  -7.980 -19.502 -12.162
  492    HB2  SER  66           HB3      SER  66  -8.240 -22.204 -10.820
  493    HB3  SER  66           HB2      SER  66  -9.513 -20.988 -10.930
  494    HG   SER  66           HG       SER  66  -8.491 -21.472 -13.372
  495    H    GLY  67           H        GLY  67  -5.733 -18.627 -10.933
  496    HA2  GLY  67           HA3      GLY  67  -6.573 -17.293  -8.786
  497    HA3  GLY  67           HA2      GLY  67  -6.186 -18.849  -8.064
  498    H    CYS  68           H        CYS  68  -4.593 -17.972  -6.777
  499    HA   CYS  68           HA       CYS  68  -2.296 -16.703  -8.044
  500    HB2  CYS  68           HB3      CYS  68  -2.802 -17.270  -5.111
  501    HB3  CYS  68           HB2      CYS  68  -1.583 -16.180  -5.784
  502    H    ARG  69           H        ARG  69  -0.096 -17.434  -7.229
  503    HA   ARG  69           HA       ARG  69   0.236 -20.167  -7.970
  504    HB2  ARG  69           HB3      ARG  69   2.240 -18.207  -6.819
  505    HB3  ARG  69           HB2      ARG  69   2.644 -19.782  -7.488
  506    HG2  ARG  69           HG3      ARG  69   1.764 -19.032  -9.677
  507    HG3  ARG  69           HG2      ARG  69   1.477 -17.437  -8.974
  508    HD2  ARG  69           HD3      ARG  69   3.575 -17.410 -10.166
  509    HD3  ARG  69           HD2      ARG  69   3.885 -17.275  -8.437
  510    HE   ARG  69           HE       ARG  69   4.026 -19.977  -9.138
  511   HH11  ARG  69          HH11      ARG  69   5.756 -16.995  -9.751
  512   HH12  ARG  69          HH12      ARG  69   7.281 -17.781 -10.000
  513   HH21  ARG  69          HH21      ARG  69   6.039 -21.014  -9.452
  514   HH22  ARG  69          HH22      ARG  69   7.446 -20.071  -9.825
  515    H    GLY  70           H        GLY  70   0.082 -21.894  -6.721
  516    HA2  GLY  70           HA3      GLY  70   0.830 -23.164  -4.828
  517    HA3  GLY  70           HA2      GLY  70   0.852 -21.677  -3.888
  518    H    ILE  71           H        ILE  71  -1.798 -20.941  -5.099
  519    HA   ILE  71           HA       ILE  71  -3.360 -22.001  -2.953
  520    HB   ILE  71           HB       ILE  71  -4.202 -20.303  -5.302
  521   HG12  ILE  71          HG13      ILE  71  -2.513 -19.178  -3.970
  522   HG13  ILE  71          HG12      ILE  71  -4.079 -18.433  -3.676
  523   HG21  ILE  71          HG21      ILE  71  -5.620 -20.877  -2.706
  524   HG22  ILE  71          HG22      ILE  71  -6.099 -21.444  -4.307
  525   HG23  ILE  71          HG23      ILE  71  -6.146 -19.721  -3.929
  526   HD11  ILE  71          HD11      ILE  71  -2.656 -20.376  -1.871
  527   HD12  ILE  71          HD12      ILE  71  -4.260 -19.705  -1.578
  528   HD13  ILE  71          HD13      ILE  71  -2.852 -18.643  -1.613
  529    H    ASP  72           H        ASP  72  -4.845 -23.576  -2.955
  530    HA   ASP  72           HA       ASP  72  -5.143 -25.216  -5.335
  531    HB2  ASP  72           HB3      ASP  72  -6.293 -25.555  -2.549
  532    HB3  ASP  72           HB2      ASP  72  -6.455 -26.719  -3.858
  533    H    SER  73           H        SER  73  -6.518 -24.455  -6.790
  534    HA   SER  73           HA       SER  73  -8.549 -22.598  -6.308
  535    HB2  SER  73           HB3      SER  73  -8.263 -24.504  -8.644
  536    HB3  SER  73           HB2      SER  73  -9.224 -23.021  -8.624
  537    HG   SER  73           HG       SER  73  -7.404 -21.817  -8.571
  538    H    LYS  74           H        LYS  74  -8.545 -26.038  -6.013
  539    HA   LYS  74           HA       LYS  74 -11.383 -26.367  -6.191
  540    HB2  LYS  74           HB3      LYS  74  -9.224 -28.163  -5.086
  541    HB3  LYS  74           HB2      LYS  74 -10.912 -28.627  -5.218
  542    HG2  LYS  74           HG3      LYS  74 -10.775 -28.265  -7.665
  543    HG3  LYS  74           HG2      LYS  74  -9.049 -27.947  -7.479
  544    HD2  LYS  74           HD3      LYS  74 -10.447 -30.499  -6.701
  545    HD3  LYS  74           HD2      LYS  74  -9.502 -30.264  -8.169
  546    HE2  LYS  74           HE3      LYS  74  -7.526 -29.779  -6.778
  547    HE3  LYS  74           HE2      LYS  74  -8.492 -30.090  -5.337
  548    HZ1  LYS  74           HZ1      LYS  74  -7.185 -32.016  -5.956
  549    HZ2  LYS  74           HZ2      LYS  74  -7.914 -32.058  -7.480
  550    HZ3  LYS  74           HZ3      LYS  74  -8.836 -32.354  -6.095
  551    H    HIS  75           H        HIS  75  -9.130 -25.581  -3.661
  552    HA   HIS  75           HA       HIS  75 -11.200 -25.946  -1.618
  553    HB2  HIS  75           HB3      HIS  75  -8.231 -25.518  -1.502
  554    HB3  HIS  75           HB2      HIS  75  -9.225 -25.148  -0.098
  555    HD1  HIS  75           HD1      HIS  75  -9.704 -27.044   1.428
  556    HD2  HIS  75           HD2      HIS  75  -8.519 -28.334  -2.341
  557    HE1  HIS  75           HE1      HIS  75  -9.512 -29.546   1.602
  558    HE2  HIS  75           HE2      HIS  75  -8.706 -30.296  -0.665
  559    H    TRP  76           H        TRP  76  -9.546 -23.494  -3.412
  560    HA   TRP  76           HA       TRP  76 -11.224 -21.454  -2.146
  561    HB2  TRP  76           HB3      TRP  76  -8.228 -21.202  -2.537
  562    HB3  TRP  76           HB2      TRP  76  -9.293 -19.891  -2.032
  563    HD1  TRP  76           HD1      TRP  76  -7.186 -22.629  -0.687
  564    HE1  TRP  76           HE1      TRP  76  -7.506 -22.830   1.856
  565    HE3  TRP  76           HE3      TRP  76 -11.331 -19.692  -0.150
  566    HZ2  TRP  76           HZ2      TRP  76  -9.276 -21.872   3.828
  567    HZ3  TRP  76           HZ3      TRP  76 -12.278 -19.386   2.098
  568    HH2  TRP  76           HH2      TRP  76 -11.268 -20.456   4.047
  569    H    ASN  77           H        ASN  77 -12.246 -20.279  -3.751
  570    HA   ASN  77           HA       ASN  77 -11.049 -20.175  -6.394
  571    HB2  ASN  77           HB3      ASN  77 -13.552 -20.152  -6.061
  572    HB3  ASN  77           HB2      ASN  77 -13.388 -18.562  -5.324
  573   HD21  ASN  77          HD21      ASN  77 -13.204 -20.390  -8.276
  574   HD22  ASN  77          HD22      ASN  77 -13.197 -19.032  -9.351
  575    H    SER  78           H        SER  78  -9.907 -18.385  -7.200
  576    HA   SER  78           HA       SER  78  -9.152 -16.434  -5.160
  577    HB2  SER  78           HB3      SER  78  -7.700 -18.350  -4.796
  578    HB3  SER  78           HB2      SER  78  -7.250 -18.367  -6.498
  579    HG   SER  78           HG       SER  78  -6.677 -16.346  -4.591
  580    H    TYR  79           H        TYR  79  -8.235 -14.587  -5.881
  581    HA   TYR  79           HA       TYR  79  -7.113 -14.272  -8.455
  582    HB2  TYR  79           HB3      TYR  79  -8.661 -12.667  -9.419
  583    HB3  TYR  79           HB2      TYR  79  -9.530 -14.160  -9.076
  584    HD1  TYR  79           HD1      TYR  79  -9.018 -10.668  -7.972
  585    HD2  TYR  79           HD2      TYR  79 -11.385 -14.182  -7.583
  586    HE1  TYR  79           HE1      TYR  79 -10.729  -9.376  -6.770
  587    HE2  TYR  79           HE2      TYR  79 -13.100 -12.897  -6.372
  588    HH   TYR  79           HH       TYR  79 -13.296 -10.840  -5.065
  589    H    CYS  80           H        CYS  80  -6.293 -12.041  -8.730
  590    HA   CYS  80           HA       CYS  80  -5.573 -11.008  -6.088
  591    HB2  CYS  80           HB3      CYS  80  -4.270 -10.417  -8.752
  592    HB3  CYS  80           HB2      CYS  80  -3.624 -10.055  -7.150
  593    H    THR  81           H        THR  81  -6.056  -9.017  -5.420
  594    HA   THR  81           HA       THR  81  -7.270  -7.151  -7.341
  595    HB   THR  81           HB       THR  81  -9.068  -8.328  -6.037
  596    HG1  THR  81           HG1      THR  81  -9.829  -6.423  -6.639
  597   HG21  THR  81          HG21      THR  81  -9.379  -7.731  -3.677
  598   HG22  THR  81          HG22      THR  81  -7.831  -6.883  -3.692
  599   HG23  THR  81          HG23      THR  81  -7.883  -8.631  -3.927
  600    H    THR  82           H        THR  82  -6.984  -4.957  -6.815
  601    HA   THR  82           HA       THR  82  -4.553  -4.501  -5.341
  602    HB   THR  82           HB       THR  82  -4.969  -2.101  -6.184
  603    HG1  THR  82           HG1      THR  82  -6.789  -1.813  -7.188
  604   HG21  THR  82          HG21      THR  82  -4.138  -2.673  -8.428
  605   HG22  THR  82          HG22      THR  82  -4.543  -4.364  -8.134
  606   HG23  THR  82          HG23      THR  82  -3.300  -3.573  -7.163
  607    H    THR  83           H        THR  83  -4.289  -3.236  -3.559
  608    HA   THR  83           HA       THR  83  -6.701  -2.523  -2.058
  609    HB   THR  83           HB       THR  83  -3.830  -2.426  -1.114
  610    HG1  THR  83           HG1      THR  83  -5.434  -4.567  -1.613
  611   HG21  THR  83          HG21      THR  83  -5.438  -1.146   0.233
  612   HG22  THR  83          HG22      THR  83  -4.826  -2.545   1.114
  613   HG23  THR  83          HG23      THR  83  -6.437  -2.589   0.403
  614    H    HIS  84           H        HIS  84  -7.308  -0.426  -1.828
  615    HA   HIS  84           HA       HIS  84  -5.530   1.575  -3.026
  616    HB2  HIS  84           HB3      HIS  84  -7.531   2.969  -3.376
  617    HB3  HIS  84           HB2      HIS  84  -7.681   1.407  -4.166
  618    HD1  HIS  84           HD1      HIS  84  -9.663  -0.014  -3.554
  619    HD2  HIS  84           HD2      HIS  84  -9.216   3.271  -1.040
  620    HE1  HIS  84           HE1      HIS  84 -11.763   0.074  -2.174
  621    HE2  HIS  84           HE2      HIS  84 -11.550   2.178  -0.805
  622    H    THR  85           H        THR  85  -4.810   3.274  -1.926
  623    HA   THR  85           HA       THR  85  -5.829   3.667   0.814
  624    HB   THR  85           HB       THR  85  -3.435   2.893   0.679
  625    HG1  THR  85           HG1      THR  85  -3.051   4.078   2.403
  626   HG21  THR  85          HG21      THR  85  -3.012   5.584  -0.627
  627   HG22  THR  85          HG22      THR  85  -2.785   4.007  -1.386
  628   HG23  THR  85          HG23      THR  85  -1.735   4.508  -0.064
  629    H    PHE  86           H        PHE  86  -5.288   6.095   1.494
  630    HA   PHE  86           HA       PHE  86  -6.292   7.731  -0.741
  631    HB2  PHE  86           HB3      PHE  86  -7.032   7.967   2.190
  632    HB3  PHE  86           HB2      PHE  86  -7.603   9.025   0.899
  633    HD1  PHE  86           HD1      PHE  86  -8.991   8.014  -0.956
  634    HD2  PHE  86           HD2      PHE  86  -8.118   5.962   2.666
  635    HE1  PHE  86           HE1      PHE  86 -10.873   6.485  -1.375
  636    HE2  PHE  86           HE2      PHE  86  -9.995   4.428   2.255
  637    HZ   PHE  86           HZ       PHE  86 -11.374   4.686   0.233
  638    H    VAL  87           H        VAL  87  -4.946   9.243  -1.341
  639    HA   VAL  87           HA       VAL  87  -3.001  10.260   0.625
  640    HB   VAL  87           HB       VAL  87  -1.569  10.839  -1.334
  641   HG11  VAL  87          HG11      VAL  87  -0.869   8.519  -1.818
  642   HG12  VAL  87          HG12      VAL  87  -2.334   7.941  -1.023
  643   HG13  VAL  87          HG13      VAL  87  -1.119   8.822  -0.099
  644   HG21  VAL  87          HG21      VAL  87  -3.321  10.952  -3.039
  645   HG22  VAL  87          HG22      VAL  87  -3.569   9.211  -2.897
  646   HG23  VAL  87          HG23      VAL  87  -2.036   9.835  -3.503
  647    H    LYS  88           H        LYS  88  -2.514  12.460   0.655
  648    HA   LYS  88           HA       LYS  88  -4.703  14.205   0.036
  649    HB2  LYS  88           HB3      LYS  88  -1.921  14.888   1.014
  650    HB3  LYS  88           HB2      LYS  88  -3.298  15.978   0.987
  651    HG2  LYS  88           HG3      LYS  88  -4.441  14.594   2.632
  652    HG3  LYS  88           HG2      LYS  88  -3.078  13.475   2.643
  653    HD2  LYS  88           HD3      LYS  88  -1.613  15.330   3.364
  654    HD3  LYS  88           HD2      LYS  88  -3.029  16.377   3.438
  655    HE2  LYS  88           HE3      LYS  88  -3.995  15.057   5.179
  656    HE3  LYS  88           HE2      LYS  88  -2.732  13.834   5.020
  657    HZ1  LYS  88           HZ1      LYS  88  -2.256  15.233   6.896
  658    HZ2  LYS  88           HZ2      LYS  88  -2.373  16.632   5.948
  659    HZ3  LYS  88           HZ3      LYS  88  -1.112  15.535   5.685
  660    H    ALA  89           H        ALA  89  -5.050  14.989  -1.913
  661    HA   ALA  89           HA       ALA  89  -2.723  15.808  -3.524
  662    HB1  ALA  89           HB1      ALA  89  -3.675  13.726  -4.425
  663    HB2  ALA  89           HB2      ALA  89  -3.848  15.078  -5.541
  664    HB3  ALA  89           HB3      ALA  89  -5.235  14.531  -4.601
  665    H    LEU  90           H        LEU  90  -2.964  17.683  -4.717
  666    HA   LEU  90           HA       LEU  90  -5.089  19.447  -3.865
  667    HB2  LEU  90           HB3      LEU  90  -2.722  20.226  -4.186
  668    HB3  LEU  90           HB2      LEU  90  -2.910  19.932  -5.909
  669    HG   LEU  90           HG       LEU  90  -4.814  21.593  -5.883
  670   HD11  LEU  90          HD11      LEU  90  -3.699  22.174  -3.146
  671   HD12  LEU  90          HD12      LEU  90  -5.316  21.574  -3.519
  672   HD13  LEU  90          HD13      LEU  90  -4.838  23.197  -4.019
  673   HD21  LEU  90          HD21      LEU  90  -2.613  22.160  -6.742
  674   HD22  LEU  90          HD22      LEU  90  -2.068  22.569  -5.114
  675   HD23  LEU  90          HD23      LEU  90  -3.321  23.534  -5.895
  676    H    THR  91           H        THR  91  -6.999  19.238  -4.799
  677    HA   THR  91           HA       THR  91  -7.081  18.412  -7.625
  678    HB   THR  91           HB       THR  91  -9.284  17.414  -7.124
  679    HG1  THR  91           HG1      THR  91  -8.919  18.757  -4.799
  680   HG21  THR  91          HG21      THR  91  -7.331  15.977  -7.052
  681   HG22  THR  91          HG22      THR  91  -8.460  15.505  -5.785
  682   HG23  THR  91          HG23      THR  91  -7.019  16.438  -5.379
  683    H    THR  92           H        THR  92  -8.944  19.171  -8.841
  684    HA   THR  92           HA       THR  92 -10.253  21.535  -7.717
  685    HB   THR  92           HB       THR  92  -8.458  22.418  -9.100
  686    HG1  THR  92           HG1      THR  92  -9.844  23.507 -10.711
  687   HG21  THR  92          HG21      THR  92  -9.641  20.812 -11.367
  688   HG22  THR  92          HG22      THR  92  -8.120  20.462 -10.547
  689   HG23  THR  92          HG23      THR  92  -8.296  21.945 -11.483
  690    H    ASP  93           H        ASP  93 -12.386  21.694  -8.220
  691    HA   ASP  93           HA       ASP  93 -13.482  19.521  -9.860
  692    HB2  ASP  93           HB3      ASP  93 -15.578  19.830  -8.674
  693    HB3  ASP  93           HB2      ASP  93 -14.274  19.659  -7.508
  694    H    GLU  94           H        GLU  94 -12.805  22.788  -9.930
  695    HA   GLU  94           HA       GLU  94 -14.012  23.062 -12.494
  696    HB2  GLU  94           HB3      GLU  94 -15.324  25.143 -11.894
  697    HB3  GLU  94           HB2      GLU  94 -16.023  23.617 -11.383
  698    HG2  GLU  94           HG3      GLU  94 -15.354  24.000  -9.122
  699    HG3  GLU  94           HG2      GLU  94 -14.420  25.414  -9.591
  700    H    LYS  95           H        LYS  95 -12.817  25.102  -9.804
  701    HA   LYS  95           HA       LYS  95 -10.696  26.084 -11.544
  702    HB2  LYS  95           HB3      LYS  95 -12.714  27.900 -10.212
  703    HB3  LYS  95           HB2      LYS  95 -11.207  28.452 -10.925
  704    HG2  LYS  95           HG3      LYS  95 -11.938  27.705 -13.111
  705    HG3  LYS  95           HG2      LYS  95 -13.423  27.061 -12.408
  706    HD2  LYS  95           HD3      LYS  95 -14.017  29.331 -11.665
  707    HD3  LYS  95           HD2      LYS  95 -12.572  29.951 -12.461
  708    HE2  LYS  95           HE3      LYS  95 -13.400  29.192 -14.608
  709    HE3  LYS  95           HE2      LYS  95 -14.811  28.477 -13.833
  710    HZ1  LYS  95           HZ1      LYS  95 -14.144  31.367 -13.865
  711    HZ2  LYS  95           HZ2      LYS  95 -15.502  30.676 -13.131
  712    HZ3  LYS  95           HZ3      LYS  95 -15.328  30.619 -14.811
  713    H    GLN  96           H        GLN  96 -12.222  26.557  -8.354
  714    HA   GLN  96           HA       GLN  96  -9.821  27.352  -7.072
  715    HB2  GLN  96           HB3      GLN  96 -12.020  27.981  -6.207
  716    HB3  GLN  96           HB2      GLN  96 -12.408  26.295  -5.915
  717    HG2  GLN  96           HG3      GLN  96 -11.826  27.444  -3.860
  718    HG3  GLN  96           HG2      GLN  96 -10.669  26.165  -4.224
  719   HE21  GLN  96          HE21      GLN  96  -8.549  26.685  -4.586
  720   HE22  GLN  96          HE22      GLN  96  -7.921  28.289  -4.425
  721    H    ALA  97           H        ALA  97  -8.133  26.074  -6.824
  722    HA   ALA  97           HA       ALA  97  -8.317  23.226  -6.663
  723    HB1  ALA  97           HB1      ALA  97  -6.362  24.326  -7.639
  724    HB2  ALA  97           HB2      ALA  97  -5.904  23.296  -6.284
  725    HB3  ALA  97           HB3      ALA  97  -5.980  25.045  -6.075
  726    H    ALA  98           H        ALA  98  -8.259  21.923  -4.902
  727    HA   ALA  98           HA       ALA  98  -7.841  23.074  -2.254
  728    HB1  ALA  98           HB1      ALA  98 -10.232  23.332  -2.630
  729    HB2  ALA  98           HB2      ALA  98  -9.932  22.105  -1.399
  730    HB3  ALA  98           HB3      ALA  98 -10.369  21.623  -3.039
  731    H    TRP  99           H        TRP  99  -7.390  21.500  -0.647
  732    HA   TRP  99           HA       TRP  99  -6.089  19.164  -1.741
  733    HB2  TRP  99           HB3      TRP  99  -6.250  20.290   1.059
  734    HB3  TRP  99           HB2      TRP  99  -5.374  18.819   0.655
  735    HD1  TRP  99           HD1      TRP  99  -5.223  22.615   0.174
  736    HE1  TRP  99           HE1      TRP  99  -2.844  23.253  -0.578
  737    HE3  TRP  99           HE3      TRP  99  -3.317  17.929  -0.516
  738    HZ2  TRP  99           HZ2      TRP  99  -0.474  21.934  -1.356
  739    HZ3  TRP  99           HZ3      TRP  99  -0.982  17.703  -1.264
  740    HH2  TRP  99           HH2      TRP  99   0.406  19.666  -1.674
  741    H    ARG 100           H        ARG 100  -6.986  17.254  -1.938
  742    HA   ARG 100           HA       ARG 100  -9.120  16.477  -0.064
  743    HB2  ARG 100           HB3      ARG 100  -9.023  15.862  -3.030
  744    HB3  ARG 100           HB2      ARG 100 -10.254  15.297  -1.911
  745    HG2  ARG 100           HG3      ARG 100  -9.729  18.162  -2.676
  746    HG3  ARG 100           HG2      ARG 100 -11.059  17.154  -3.244
  747    HD2  ARG 100           HD3      ARG 100 -11.910  16.976  -0.965
  748    HD3  ARG 100           HD2      ARG 100 -10.566  17.953  -0.380
  749    HE   ARG 100           HE       ARG 100 -12.517  19.013  -2.312
  750   HH11  ARG 100          HH11      ARG 100 -10.702  19.283   0.672
  751   HH12  ARG 100          HH12      ARG 100 -11.345  20.842   1.073
  752   HH21  ARG 100          HH21      ARG 100 -13.355  21.073  -1.801
  753   HH22  ARG 100          HH22      ARG 100 -12.861  21.861  -0.336
  754    H    PHE 101           H        PHE 101  -9.518  13.985  -0.417
  755    HA   PHE 101           HA       PHE 101  -6.865  12.697  -0.298
  756    HB2  PHE 101           HB3      PHE 101  -9.413  11.973   1.189
  757    HB3  PHE 101           HB2      PHE 101  -7.935  11.027   1.224
  758    HD1  PHE 101           HD1      PHE 101  -9.352  14.345   2.123
  759    HD2  PHE 101           HD2      PHE 101  -6.237  11.507   2.734
  760    HE1  PHE 101           HE1      PHE 101  -8.557  15.640   4.054
  761    HE2  PHE 101           HE2      PHE 101  -5.434  12.804   4.666
  762    HZ   PHE 101           HZ       PHE 101  -6.597  14.871   5.327
  763    H    ILE 102           H        ILE 102  -6.530  11.449  -2.040
  764    HA   ILE 102           HA       ILE 102  -8.915  10.327  -3.369
  765    HB   ILE 102           HB       ILE 102  -7.607  10.316  -5.465
  766   HG12  ILE 102          HG13      ILE 102  -5.577  11.980  -3.974
  767   HG13  ILE 102          HG12      ILE 102  -5.363  10.268  -4.315
  768   HG21  ILE 102          HG21      ILE 102  -7.683  12.734  -5.868
  769   HG22  ILE 102          HG22      ILE 102  -7.843  13.007  -4.134
  770   HG23  ILE 102          HG23      ILE 102  -9.112  12.155  -5.014
  771   HD11  ILE 102          HD11      ILE 102  -5.658  12.465  -6.347
  772   HD12  ILE 102          HD12      ILE 102  -5.484  10.748  -6.713
  773   HD13  ILE 102          HD13      ILE 102  -4.171  11.620  -5.920
  774    H    ARG 103           H        ARG 103  -8.865   8.255  -4.158
  775    HA   ARG 103           HA       ARG 103  -7.174   6.454  -2.685
  776    HB2  ARG 103           HB3      ARG 103  -8.437   4.659  -3.840
  777    HB3  ARG 103           HB2      ARG 103  -9.491   5.818  -3.042
  778    HG2  ARG 103           HG3      ARG 103 -10.190   6.746  -5.066
  779    HG3  ARG 103           HG2      ARG 103  -8.830   6.063  -5.952
  780    HD2  ARG 103           HD3      ARG 103 -10.936   4.347  -4.661
  781    HD3  ARG 103           HD2      ARG 103 -11.095   4.958  -6.306
  782    HE   ARG 103           HE       ARG 103  -8.645   3.759  -6.272
  783   HH11  ARG 103          HH11      ARG 103 -11.884   2.707  -5.456
  784   HH12  ARG 103          HH12      ARG 103 -11.621   1.070  -5.968
  785   HH21  ARG 103          HH21      ARG 103  -8.280   1.588  -6.940
  786   HH22  ARG 103          HH22      ARG 103  -9.572   0.434  -6.793
  787    H    ILE 104           H        ILE 104  -5.339   5.584  -3.318
  788    HA   ILE 104           HA       ILE 104  -4.936   5.167  -6.200
  789    HB   ILE 104           HB       ILE 104  -2.489   5.319  -5.847
  790   HG12  ILE 104          HG13      ILE 104  -3.181   6.485  -3.147
  791   HG13  ILE 104          HG12      ILE 104  -2.546   4.863  -3.390
  792   HG21  ILE 104          HG21      ILE 104  -2.368   7.767  -5.687
  793   HG22  ILE 104          HG22      ILE 104  -4.033   7.797  -5.108
  794   HG23  ILE 104          HG23      ILE 104  -3.676   7.229  -6.739
  795   HD11  ILE 104          HD11      ILE 104  -1.149   7.429  -4.101
  796   HD12  ILE 104          HD12      ILE 104  -0.507   5.802  -4.336
  797   HD13  ILE 104          HD13      ILE 104  -0.805   6.406  -2.705
  798    H    ASP 105           H        ASP 105  -4.400   3.140  -6.780
  799    HA   ASP 105           HA       ASP 105  -4.609   1.063  -4.812
  800    HB2  ASP 105           HB3      ASP 105  -4.054   1.013  -7.788
  801    HB3  ASP 105           HB2      ASP 105  -4.160  -0.447  -6.797
  802    H    THR 106           H        THR 106  -2.985   0.630  -3.507
  803    HA   THR 106           HA       THR 106  -0.292   1.413  -4.384
  804    HB   THR 106           HB       THR 106  -1.073   2.690  -2.495
  805    HG1  THR 106           HG1      THR 106   1.011   0.869  -2.169
  806   HG21  THR 106          HG21      THR 106  -1.683   1.650  -0.368
  807   HG22  THR 106          HG22      THR 106  -1.493   0.052  -1.088
  808   HG23  THR 106          HG23      THR 106  -2.762   1.133  -1.660
  809    H    ALA 107           H        ALA 107  -2.100  -1.361  -3.842
  810    HA   ALA 107           HA       ALA 107   0.266  -3.009  -3.833
  811    HB1  ALA 107           HB1      ALA 107  -0.284  -4.255  -1.816
  812    HB2  ALA 107           HB2      ALA 107  -1.650  -3.182  -1.512
  813    HB3  ALA 107           HB3      ALA 107  -0.003  -2.555  -1.443
  814    H    CYS 108           H        CYS 108  -0.289  -5.330  -3.987
  815    HA   CYS 108           HA       CYS 108  -2.977  -5.795  -5.087
  816    HB2  CYS 108           HB3      CYS 108  -1.375  -5.650  -6.948
  817    HB3  CYS 108           HB2      CYS 108  -0.341  -6.848  -6.169
  818    H    VAL 109           H        VAL 109  -4.017  -7.353  -4.010
  819    HA   VAL 109           HA       VAL 109  -2.394  -9.224  -2.408
  820    HB   VAL 109           HB       VAL 109  -4.161  -9.253  -0.731
  821   HG11  VAL 109          HG11      VAL 109  -2.405  -7.610  -0.460
  822   HG12  VAL 109          HG12      VAL 109  -3.938  -6.954   0.112
  823   HG13  VAL 109          HG13      VAL 109  -3.296  -6.458  -1.456
  824   HG21  VAL 109          HG21      VAL 109  -5.554  -7.199  -2.450
  825   HG22  VAL 109          HG22      VAL 109  -6.061  -7.713  -0.841
  826   HG23  VAL 109          HG23      VAL 109  -6.086  -8.860  -2.181
  827    H    CYS 110           H        CYS 110  -3.472 -11.279  -1.909
  828    HA   CYS 110           HA       CYS 110  -4.971 -12.231  -4.250
  829    HB2  CYS 110           HB3      CYS 110  -2.798 -13.303  -3.956
  830    HB3  CYS 110           HB2      CYS 110  -3.202 -13.728  -2.301
  831    H    VAL 111           H        VAL 111  -7.049 -12.748  -3.955
  832    HA   VAL 111           HA       VAL 111  -8.031 -13.053  -1.214
  833    HB   VAL 111           HB       VAL 111 -10.255 -12.765  -2.085
  834   HG11  VAL 111          HG11      VAL 111  -8.366 -10.809  -3.376
  835   HG12  VAL 111          HG12      VAL 111  -9.005 -10.725  -1.735
  836   HG13  VAL 111          HG13      VAL 111 -10.088 -10.547  -3.115
  837   HG21  VAL 111          HG21      VAL 111  -9.063 -12.785  -4.847
  838   HG22  VAL 111          HG22      VAL 111 -10.756 -12.510  -4.440
  839   HG23  VAL 111          HG23      VAL 111 -10.018 -14.083  -4.129
  840    H    LEU 112           H        LEU 112  -9.212 -14.860  -0.524
  841    HA   LEU 112           HA       LEU 112  -9.227 -17.180  -2.344
  842    HB2  LEU 112           HB3      LEU 112  -8.715 -17.241   0.639
  843    HB3  LEU 112           HB2      LEU 112  -8.795 -18.638  -0.417
  844    HG   LEU 112           HG       LEU 112  -6.656 -16.504  -0.403
  845   HD11  LEU 112          HD11      LEU 112  -6.660 -19.430   0.322
  846   HD12  LEU 112          HD12      LEU 112  -6.403 -18.061   1.405
  847   HD13  LEU 112          HD13      LEU 112  -5.209 -18.442   0.165
  848   HD21  LEU 112          HD21      LEU 112  -7.064 -17.172  -2.685
  849   HD22  LEU 112          HD22      LEU 112  -7.012 -18.873  -2.228
  850   HD23  LEU 112          HD23      LEU 112  -5.556 -17.887  -2.119
  851    H    SER 113           H        SER 113 -11.161 -18.226  -2.474
  852    HA   SER 113           HA       SER 113 -12.944 -18.520  -0.307
  853    HB2  SER 113           HB3      SER 113 -14.838 -17.131  -1.326
  854    HB3  SER 113           HB2      SER 113 -13.554 -16.242  -0.510
  855    HG   SER 113           HG       SER 113 -12.606 -16.060  -2.696
  856    H    ARG 114           H        ARG 114 -12.685 -20.729  -1.268
  857    HA   ARG 114           HA       ARG 114 -14.723 -21.034  -3.375
  858    HB2  ARG 114           HB3      ARG 114 -12.695 -22.350  -3.754
  859    HB3  ARG 114           HB2      ARG 114 -12.893 -23.133  -2.194
  860    HG2  ARG 114           HG3      ARG 114 -13.615 -24.615  -3.942
  861    HG3  ARG 114           HG2      ARG 114 -15.007 -24.120  -2.983
  862    HD2  ARG 114           HD3      ARG 114 -14.227 -22.800  -5.575
  863    HD3  ARG 114           HD2      ARG 114 -15.344 -24.159  -5.481
  864    HE   ARG 114           HE       ARG 114 -16.473 -22.432  -3.780
  865   HH11  ARG 114          HH11      ARG 114 -15.253 -22.012  -7.031
  866   HH12  ARG 114          HH12      ARG 114 -16.343 -20.721  -7.414
  867   HH21  ARG 114          HH21      ARG 114 -17.891 -20.706  -4.262
  868   HH22  ARG 114          HH22      ARG 114 -17.847 -19.977  -5.839
  869    H    LYS 115           H        LYS 115 -13.941 -21.910  -0.071
  870    HA   LYS 115           HA       LYS 115 -16.617 -23.067   0.246
  871    HB2  LYS 115           HB3      LYS 115 -14.256 -23.290   2.124
  872    HB3  LYS 115           HB2      LYS 115 -15.737 -24.237   2.171
  873    HG2  LYS 115           HG3      LYS 115 -15.135 -25.248   0.009
  874    HG3  LYS 115           HG2      LYS 115 -13.631 -24.318   0.017
  875    HD2  LYS 115           HD3      LYS 115 -13.122 -26.510   0.806
  876    HD3  LYS 115           HD2      LYS 115 -13.053 -25.416   2.184
  877    HE2  LYS 115           HE3      LYS 115 -14.189 -27.442   2.825
  878    HE3  LYS 115           HE2      LYS 115 -15.332 -26.102   2.809
  879    HZ1  LYS 115           HZ1      LYS 115 -16.283 -28.065   1.786
  880    HZ2  LYS 115           HZ2      LYS 115 -15.017 -28.140   0.669
  881    HZ3  LYS 115           HZ3      LYS 115 -16.102 -26.844   0.632
  882    H    ALA 116           H        ALA 116 -15.426 -20.171   0.429
  883    HA   ALA 116           HA       ALA 116 -16.542 -19.454   3.040
  884    HB1  ALA 116           HB1      ALA 116 -14.316 -18.567   2.492
  885    HB2  ALA 116           HB2      ALA 116 -15.502 -17.281   2.712
  886    HB3  ALA 116           HB3      ALA 116 -14.998 -17.747   1.087
  887    H    THR 117           H        THR 117 -17.210 -19.430  -0.311
  888    HA   THR 117           HA       THR 117 -19.007 -17.219  -0.359
  889    HB   THR 117           HB       THR 117 -19.740 -18.301  -2.560
  890    HG1  THR 117           HG1      THR 117 -19.022 -20.436  -2.035
  891   HG21  THR 117          HG21      THR 117 -16.822 -17.626  -2.162
  892   HG22  THR 117          HG22      THR 117 -18.123 -16.477  -2.480
  893   HG23  THR 117          HG23      THR 117 -17.664 -17.654  -3.710
  894    H    ARG 118           H        ARG 118 -21.341 -17.560  -1.046
  895    HA   ARG 118           HA       ARG 118 -22.500 -19.648   0.667
  896    HB2  ARG 118           HB3      ARG 118 -23.769 -17.084  -0.320
  897    HB3  ARG 118           HB2      ARG 118 -24.517 -18.245   0.758
  898    HG2  ARG 118           HG3      ARG 118 -22.024 -16.686   1.411
  899    HG3  ARG 118           HG2      ARG 118 -23.652 -16.202   1.872
  900    HD2  ARG 118           HD3      ARG 118 -22.706 -17.265   3.766
  901    HD3  ARG 118           HD2      ARG 118 -23.845 -18.415   3.076
  902    HE   ARG 118           HE       ARG 118 -21.515 -19.154   1.942
  903   HH11  ARG 118          HH11      ARG 118 -22.387 -18.479   5.264
  904   HH12  ARG 118          HH12      ARG 118 -21.258 -19.616   5.927
  905   HH21  ARG 118          HH21      ARG 118 -20.034 -20.662   2.805
  906   HH22  ARG 118          HH22      ARG 118 -19.922 -20.865   4.524
  907    H1   SER   1           H1       SER   1 -24.849  -9.737  16.190
  908    H2   SER   1           H2       SER   1 -26.384  -9.459  15.551
  909    H3   SER   1           H3       SER   1 -25.575  -8.224  16.376
  910    HA   SER   1           HA       SER   1 -25.500  -7.867  14.005
  911    HB2  SER   1           HB3      SER   1 -23.615  -7.128  15.450
  912    HB3  SER   1           HB2      SER   1 -22.808  -8.666  15.149
  913    HG   SER   1           HG       SER   1 -22.522  -6.537  13.747
  914    H    SER   2           H        SER   2 -25.497  -8.749  12.016
  915    HA   SER   2           HA       SER   2 -24.231 -11.360  11.631
  916    HB2  SER   2           HB3      SER   2 -26.697 -11.631  12.173
  917    HB3  SER   2           HB2      SER   2 -27.038 -10.798  10.658
  918    HG   SER   2           HG       SER   2 -26.730 -13.315  10.895
  919    H    THR   3           H        THR   3 -23.389  -8.764  10.839
  920    HA   THR   3           HA       THR   3 -23.972  -8.573   7.999
  921    HB   THR   3           HB       THR   3 -22.223  -6.697   8.127
  922    HG1  THR   3           HG1      THR   3 -21.574  -7.596  10.338
  923   HG21  THR   3          HG21      THR   3 -24.608  -6.247   7.995
  924   HG22  THR   3          HG22      THR   3 -23.838  -5.122   9.112
  925   HG23  THR   3          HG23      THR   3 -24.770  -6.482   9.735
  926    H    HIS   4           H        HIS   4 -23.127 -10.546   7.264
  927    HA   HIS   4           HA       HIS   4 -20.196 -10.569   7.074
  928    HB2  HIS   4           HB3      HIS   4 -20.927 -12.164   8.861
  929    HB3  HIS   4           HB2      HIS   4 -21.874 -13.022   7.656
  930    HD1  HIS   4           HD1      HIS   4 -18.317 -12.369   8.692
  931    HD2  HIS   4           HD2      HIS   4 -20.437 -14.764   6.034
  932    HE1  HIS   4           HE1      HIS   4 -16.659 -14.039   7.812
  933    HE2  HIS   4           HE2      HIS   4 -17.983 -15.540   6.290
  934    HA   PRO   5           HA       PRO   5 -22.235 -11.239   2.967
  935    HB2  PRO   5           HB3      PRO   5 -21.175  -9.169   1.650
  936    HB3  PRO   5           HB2      PRO   5 -22.541  -8.938   2.749
  937    HG2  PRO   5           HG3      PRO   5 -19.627  -8.412   3.202
  938    HG3  PRO   5           HG2      PRO   5 -21.023  -7.426   3.669
  939    HD2  PRO   5           HD3      PRO   5 -19.685  -9.139   5.368
  940    HD3  PRO   5           HD2      PRO   5 -21.369  -8.623   5.589
  941    H    VAL   6           H        VAL   6 -20.017 -12.643   4.000
  942    HA   VAL   6           HA       VAL   6 -18.135 -13.793   3.427
  943    HB   VAL   6           HB       VAL   6 -18.890 -13.179   0.566
  944   HG11  VAL   6          HG11      VAL   6 -16.752 -14.313   0.854
  945   HG12  VAL   6          HG12      VAL   6 -17.936 -15.381   0.101
  946   HG13  VAL   6          HG13      VAL   6 -17.537 -15.571   1.807
  947   HG21  VAL   6          HG21      VAL   6 -20.323 -15.167   0.630
  948   HG22  VAL   6          HG22      VAL   6 -20.890 -13.915   1.738
  949   HG23  VAL   6          HG23      VAL   6 -20.024 -15.320   2.361
  950    H    PHE   7           H        PHE   7 -17.790 -11.050   4.003
  951    HA   PHE   7           HA       PHE   7 -16.377  -9.283   3.817
  952    HB2  PHE   7           HB3      PHE   7 -14.597 -11.539   2.896
  953    HB3  PHE   7           HB2      PHE   7 -14.003  -9.905   3.164
  954    HD1  PHE   7           HD1      PHE   7 -14.970 -13.015   4.706
  955    HD2  PHE   7           HD2      PHE   7 -14.127  -8.910   5.436
  956    HE1  PHE   7           HE1      PHE   7 -14.667 -13.508   7.094
  957    HE2  PHE   7           HE2      PHE   7 -13.823  -9.393   7.829
  958    HZ   PHE   7           HZ       PHE   7 -14.093 -11.693   8.663
  959    H    HIS   8           H        HIS   8 -18.121  -9.751   1.588
  960    HA   HIS   8           HA       HIS   8 -18.579  -8.878  -0.455
  961    HB2  HIS   8           HB3      HIS   8 -16.026  -7.306  -0.007
  962    HB3  HIS   8           HB2      HIS   8 -17.207  -6.976  -1.267
  963    HD1  HIS   8           HD1      HIS   8 -16.384  -6.196   2.212
  964    HD2  HIS   8           HD2      HIS   8 -19.782  -6.101  -0.200
  965    HE1  HIS   8           HE1      HIS   8 -18.050  -4.753   3.424
  966    HE2  HIS   8           HE2      HIS   8 -20.042  -4.604   1.891
  967    H    MET   9           H        MET   9 -16.528 -11.124   0.051
  968    HA   MET   9           HA       MET   9 -14.949 -12.374  -0.979
  969    HB2  MET   9           HB3      MET   9 -15.637 -13.256  -3.156
  970    HB3  MET   9           HB2      MET   9 -16.984 -13.179  -2.036
  971    HG2  MET   9           HG3      MET   9 -17.700 -11.073  -3.149
  972    HG3  MET   9           HG2      MET   9 -16.428 -11.325  -4.337
  973    HE1  MET   9           HE1      MET   9 -18.673 -14.061  -2.600
  974    HE2  MET   9           HE2      MET   9 -20.006 -14.181  -3.747
  975    HE3  MET   9           HE3      MET   9 -19.769 -12.699  -2.822
  976    H    GLY  10           H        GLY  10 -14.135  -9.733  -0.849
  977    HA2  GLY  10           HA3      GLY  10 -12.368  -9.612  -3.184
  978    HA3  GLY  10           HA2      GLY  10 -13.369  -8.210  -2.847
  979    H    GLU  11           H        GLU  11 -13.103  -8.622   0.100
  980    HA   GLU  11           HA       GLU  11 -10.458  -7.399   0.322
  981    HB2  GLU  11           HB3      GLU  11 -11.182  -6.546   2.491
  982    HB3  GLU  11           HB2      GLU  11 -12.345  -6.127   1.239
  983    HG2  GLU  11           HG3      GLU  11 -13.753  -8.036   1.992
  984    HG3  GLU  11           HG2      GLU  11 -12.625  -8.280   3.325
  985    H    PHE  12           H        PHE  12 -10.525 -10.140  -0.100
  986    HA   PHE  12           HA       PHE  12  -9.845 -11.346   2.477
  987    HB2  PHE  12           HB3      PHE  12 -10.399 -12.443  -0.250
  988    HB3  PHE  12           HB2      PHE  12  -9.420 -13.387   0.863
  989    HD1  PHE  12           HD1      PHE  12 -12.715 -12.531  -0.156
  990    HD2  PHE  12           HD2      PHE  12 -10.417 -13.906   3.150
  991    HE1  PHE  12           HE1      PHE  12 -14.750 -13.437   0.878
  992    HE2  PHE  12           HE2      PHE  12 -12.452 -14.813   4.191
  993    HZ   PHE  12           HZ       PHE  12 -14.622 -14.582   3.053
  994    H    SER  13           H        SER  13  -7.821 -12.390   2.788
  995    HA   SER  13           HA       SER  13  -5.736 -11.974   0.820
  996    HB2  SER  13           HB3      SER  13  -5.658  -9.903   2.182
  997    HB3  SER  13           HB2      SER  13  -5.493 -10.873   3.639
  998    HG   SER  13           HG       SER  13  -3.502  -9.993   2.597
  999    H    VAL  14           H        VAL  14  -4.047 -13.424   1.044
 1000    HA   VAL  14           HA       VAL  14  -4.580 -15.848   2.425
 1001    HB   VAL  14           HB       VAL  14  -2.358 -16.572   1.659
 1002   HG11  VAL  14          HG11      VAL  14  -4.225 -16.710   0.108
 1003   HG12  VAL  14          HG12      VAL  14  -2.728 -16.348  -0.752
 1004   HG13  VAL  14          HG13      VAL  14  -3.902 -15.068  -0.448
 1005   HG21  VAL  14          HG21      VAL  14  -1.159 -14.459   2.000
 1006   HG22  VAL  14          HG22      VAL  14  -2.030 -13.750   0.641
 1007   HG23  VAL  14          HG23      VAL  14  -0.918 -15.090   0.370
 1008    H    CYS  15           H        CYS  15  -3.178 -12.932   3.345
 1009    HA   CYS  15           HA       CYS  15  -1.936 -14.140   5.721
 1010    HB2  CYS  15           HB3      CYS  15  -1.430 -11.475   4.372
 1011    HB3  CYS  15           HB2      CYS  15  -0.694 -11.979   5.894
 1012    H    ASP  16           H        ASP  16  -2.719 -13.576   7.708
 1013    HA   ASP  16           HA       ASP  16  -5.187 -12.198   7.906
 1014    HB2  ASP  16           HB3      ASP  16  -3.166 -12.939  10.037
 1015    HB3  ASP  16           HB2      ASP  16  -4.729 -12.210  10.387
 1016    H    SER  17           H        SER  17  -5.489 -10.129   7.661
 1017    HA   SER  17           HA       SER  17  -3.254  -8.307   8.246
 1018    HB2  SER  17           HB3      SER  17  -5.393  -7.990   6.124
 1019    HB3  SER  17           HB2      SER  17  -4.002  -6.930   6.381
 1020    HG   SER  17           HG       SER  17  -3.770  -9.697   5.777
 1021    H    VAL  18           H        VAL  18  -3.648  -6.587   9.512
 1022    HA   VAL  18           HA       VAL  18  -6.454  -6.081  10.235
 1023    HB   VAL  18           HB       VAL  18  -5.322  -6.950  12.161
 1024   HG11  VAL  18          HG11      VAL  18  -3.228  -4.831  11.721
 1025   HG12  VAL  18          HG12      VAL  18  -3.027  -6.570  11.506
 1026   HG13  VAL  18          HG13      VAL  18  -3.322  -5.910  13.115
 1027   HG21  VAL  18          HG21      VAL  18  -5.595  -3.960  12.378
 1028   HG22  VAL  18          HG22      VAL  18  -5.528  -5.081  13.738
 1029   HG23  VAL  18          HG23      VAL  18  -6.876  -5.151  12.602
 1030    H    SER  19           H        SER  19  -7.160  -4.272   9.348
 1031    HA   SER  19           HA       SER  19  -5.273  -2.136   8.717
 1032    HB2  SER  19           HB3      SER  19  -8.172  -2.511   7.913
 1033    HB3  SER  19           HB2      SER  19  -7.135  -1.185   7.384
 1034    HG   SER  19           HG       SER  19  -5.848  -2.626   6.285
 1035    H    VAL  20           H        VAL  20  -5.033  -0.504  10.048
 1036    HA   VAL  20           HA       VAL  20  -7.248   0.171  11.870
 1037    HB   VAL  20           HB       VAL  20  -4.284   0.479  12.374
 1038   HG11  VAL  20          HG11      VAL  20  -4.947   1.052  14.664
 1039   HG12  VAL  20          HG12      VAL  20  -6.640   1.003  14.172
 1040   HG13  VAL  20          HG13      VAL  20  -5.555   2.208  13.479
 1041   HG21  VAL  20          HG21      VAL  20  -4.947  -1.859  12.417
 1042   HG22  VAL  20          HG22      VAL  20  -6.245  -1.480  13.549
 1043   HG23  VAL  20          HG23      VAL  20  -4.563  -1.289  14.042
 1044    H    TRP  21           H        TRP  21  -7.898   2.249  11.902
 1045    HA   TRP  21           HA       TRP  21  -6.382   4.198  10.324
 1046    HB2  TRP  21           HB3      TRP  21  -9.170   4.348  11.515
 1047    HB3  TRP  21           HB2      TRP  21  -8.399   5.642  10.604
 1048    HD1  TRP  21           HD1      TRP  21  -9.971   2.180  10.136
 1049    HE1  TRP  21           HE1      TRP  21 -10.541   1.856   7.653
 1050    HE3  TRP  21           HE3      TRP  21  -7.735   6.373   8.241
 1051    HZ2  TRP  21           HZ2      TRP  21 -10.101   3.195   5.211
 1052    HZ3  TRP  21           HZ3      TRP  21  -7.856   6.775   5.814
 1053    HH2  TRP  21           HH2      TRP  21  -9.014   5.217   4.335
 1054    H    VAL  22           H        VAL  22  -4.735   4.784  11.635
 1055    HA   VAL  22           HA       VAL  22  -5.129   5.199  14.460
 1056    HB   VAL  22           HB       VAL  22  -2.702   5.848  12.779
 1057   HG11  VAL  22          HG11      VAL  22  -1.483   5.646  14.911
 1058   HG12  VAL  22          HG12      VAL  22  -3.029   5.482  15.746
 1059   HG13  VAL  22          HG13      VAL  22  -2.637   6.977  14.897
 1060   HG21  VAL  22          HG21      VAL  22  -3.356   3.332  14.302
 1061   HG22  VAL  22          HG22      VAL  22  -1.814   3.686  13.525
 1062   HG23  VAL  22          HG23      VAL  22  -3.271   3.498  12.548
 1063    H    GLY  23           H        GLY  23  -5.367   7.116  15.511
 1064    HA2  GLY  23           HA3      GLY  23  -5.830   9.449  13.787
 1065    HA3  GLY  23           HA2      GLY  23  -6.488   9.222  15.405
 1066    H    ASP  24           H        ASP  24  -3.456   8.248  15.810
 1067    HA   ASP  24           HA       ASP  24  -2.193  10.863  15.933
 1068    HB2  ASP  24           HB3      ASP  24  -3.354  10.808  18.060
 1069    HB3  ASP  24           HB2      ASP  24  -2.721   9.200  18.404
 1070    H    LYS  25           H        LYS  25  -0.463  10.348  14.749
 1071    HA   LYS  25           HA       LYS  25   1.316   8.273  15.830
 1072    HB2  LYS  25           HB3      LYS  25   0.286   7.584  13.655
 1073    HB3  LYS  25           HB2      LYS  25   0.992   9.007  12.908
 1074    HG2  LYS  25           HG3      LYS  25   3.212   8.184  13.305
 1075    HG3  LYS  25           HG2      LYS  25   2.581   6.808  14.213
 1076    HD2  LYS  25           HD3      LYS  25   1.422   6.033  12.180
 1077    HD3  LYS  25           HD2      LYS  25   2.116   7.385  11.289
 1078    HE2  LYS  25           HE3      LYS  25   4.357   6.541  11.691
 1079    HE3  LYS  25           HE2      LYS  25   3.711   5.227  12.675
 1080    HZ1  LYS  25           HZ1      LYS  25   4.242   4.478  10.449
 1081    HZ2  LYS  25           HZ2      LYS  25   3.206   5.629   9.777
 1082    HZ3  LYS  25           HZ3      LYS  25   2.569   4.370  10.718
 1083    H    THR  26           H        THR  26   2.817   9.473  16.858
 1084    HA   THR  26           HA       THR  26   3.214  12.217  16.081
 1085    HB   THR  26           HB       THR  26   2.965  11.688  18.446
 1086    HG1  THR  26           HG1      THR  26   5.099  13.028  17.383
 1087   HG21  THR  26          HG21      THR  26   4.784  10.534  19.662
 1088   HG22  THR  26          HG22      THR  26   5.538  10.142  18.117
 1089   HG23  THR  26          HG23      THR  26   3.956   9.479  18.518
 1090    H    THR  27           H        THR  27   4.801   9.318  15.340
 1091    HA   THR  27           HA       THR  27   7.037  10.833  14.239
 1092    HB   THR  27           HB       THR  27   8.512   8.788  14.991
 1093    HG1  THR  27           HG1      THR  27   6.224   8.463  16.417
 1094   HG21  THR  27          HG21      THR  27   8.993  11.092  15.574
 1095   HG22  THR  27          HG22      THR  27   9.204  10.060  16.988
 1096   HG23  THR  27          HG23      THR  27   7.760  11.058  16.832
 1097    H    ALA  28           H        ALA  28   7.679  10.151  12.295
 1098    HA   ALA  28           HA       ALA  28   7.085   7.428  11.445
 1099    HB1  ALA  28           HB1      ALA  28   5.081   8.678  10.808
 1100    HB2  ALA  28           HB2      ALA  28   5.980   8.132   9.392
 1101    HB3  ALA  28           HB3      ALA  28   6.081   9.817   9.907
 1102    H    THR  29           H        THR  29   8.009   7.069   9.196
 1103    HA   THR  29           HA       THR  29  10.605   8.423   9.068
 1104    HB   THR  29           HB       THR  29   9.811   5.872   7.662
 1105    HG1  THR  29           HG1      THR  29  10.988   6.266  10.228
 1106   HG21  THR  29          HG21      THR  29  11.774   7.004   6.747
 1107   HG22  THR  29          HG22      THR  29  12.235   5.505   7.558
 1108   HG23  THR  29          HG23      THR  29  12.500   7.058   8.355
 1109    H    ASP  30           H        ASP  30  10.853   9.929   7.585
 1110    HA   ASP  30           HA       ASP  30   9.039  10.392   5.444
 1111    HB2  ASP  30           HB3      ASP  30  10.353  12.219   6.438
 1112    HB3  ASP  30           HB2      ASP  30  11.850  11.448   5.914
 1113    H    ILE  31           H        ILE  31   9.639  10.359   3.133
 1114    HA   ILE  31           HA       ILE  31  10.394   7.831   2.264
 1115    HB   ILE  31           HB       ILE  31   9.063   9.320   0.884
 1116   HG12  ILE  31          HG13      ILE  31  11.697   8.673  -0.461
 1117   HG13  ILE  31          HG12      ILE  31  10.350   7.558  -0.258
 1118   HG21  ILE  31          HG21      ILE  31  10.021  11.247  -0.260
 1119   HG22  ILE  31          HG22      ILE  31  11.549  10.994   0.580
 1120   HG23  ILE  31          HG23      ILE  31  10.107  11.435   1.492
 1121   HD11  ILE  31          HD11      ILE  31  10.404   8.434  -2.509
 1122   HD12  ILE  31          HD12      ILE  31  10.337  10.085  -1.891
 1123   HD13  ILE  31          HD13      ILE  31   8.962   9.003  -1.669
 1124    H    LYS  32           H        LYS  32  12.376  10.598   2.989
 1125    HA   LYS  32           HA       LYS  32  14.685   9.680   1.536
 1126    HB2  LYS  32           HB3      LYS  32  14.496  11.775   3.702
 1127    HB3  LYS  32           HB2      LYS  32  15.801  11.585   2.536
 1128    HG2  LYS  32           HG3      LYS  32  14.372  12.219   0.734
 1129    HG3  LYS  32           HG2      LYS  32  12.957  12.197   1.783
 1130    HD2  LYS  32           HD3      LYS  32  14.301  13.959   3.149
 1131    HD3  LYS  32           HD2      LYS  32  15.181  14.180   1.633
 1132    HE2  LYS  32           HE3      LYS  32  13.430  15.759   1.586
 1133    HE3  LYS  32           HE2      LYS  32  12.921  14.446   0.528
 1134    HZ1  LYS  32           HZ1      LYS  32  11.678  13.544   2.508
 1135    HZ2  LYS  32           HZ2      LYS  32  11.072  14.983   1.853
 1136    HZ3  LYS  32           HZ3      LYS  32  11.981  15.025   3.272
 1137    H    GLY  33           H        GLY  33  13.255   8.825   4.457
 1138    HA2  GLY  33           HA3      GLY  33  14.043   7.005   5.757
 1139    HA3  GLY  33           HA2      GLY  33  15.683   7.371   5.230
 1140    H    LYS  34           H        LYS  34  13.593   9.907   6.333
 1141    HA   LYS  34           HA       LYS  34  15.331  10.261   8.666
 1142    HB2  LYS  34           HB3      LYS  34  13.429  12.203   7.345
 1143    HB3  LYS  34           HB2      LYS  34  14.498  12.578   8.686
 1144    HG2  LYS  34           HG3      LYS  34  15.345  11.791   5.908
 1145    HG3  LYS  34           HG2      LYS  34  15.386  13.411   6.590
 1146    HD2  LYS  34           HD3      LYS  34  16.952  12.587   8.326
 1147    HD3  LYS  34           HD2      LYS  34  16.983  11.028   7.502
 1148    HE2  LYS  34           HE3      LYS  34  18.898  12.251   6.781
 1149    HE3  LYS  34           HE2      LYS  34  17.750  12.224   5.451
 1150    HZ1  LYS  34           HZ1      LYS  34  17.060  14.463   6.039
 1151    HZ2  LYS  34           HZ2      LYS  34  18.721  14.414   5.734
 1152    HZ3  LYS  34           HZ3      LYS  34  18.158  14.486   7.324
 1153    H    GLU  35           H        GLU  35  14.519  10.418  10.716
 1154    HA   GLU  35           HA       GLU  35  11.785   9.536  11.143
 1155    HB2  GLU  35           HB3      GLU  35  13.550   8.577  12.545
 1156    HB3  GLU  35           HB2      GLU  35  14.006  10.183  13.093
 1157    HG2  GLU  35           HG3      GLU  35  11.838  10.440  14.173
 1158    HG3  GLU  35           HG2      GLU  35  11.367   8.837  13.615
 1159    H    VAL  36           H        VAL  36  10.195  10.969  11.220
 1160    HA   VAL  36           HA       VAL  36  10.842  13.706  12.086
 1161    HB   VAL  36           HB       VAL  36   9.095  14.494  10.480
 1162   HG11  VAL  36          HG11      VAL  36  10.521  14.278   8.480
 1163   HG12  VAL  36          HG12      VAL  36  11.471  13.050   9.318
 1164   HG13  VAL  36          HG13      VAL  36  11.438  14.706   9.924
 1165   HG21  VAL  36          HG21      VAL  36   7.881  12.404  10.188
 1166   HG22  VAL  36          HG22      VAL  36   9.298  11.674   9.428
 1167   HG23  VAL  36          HG23      VAL  36   8.460  13.009   8.634
 1168    H    THR  37           H        THR  37   9.278  14.855  13.195
 1169    HA   THR  37           HA       THR  37   7.402  13.272  14.702
 1170    HB   THR  37           HB       THR  37   7.816  16.264  14.783
 1171    HG1  THR  37           HG1      THR  37   9.438  15.921  16.212
 1172   HG21  THR  37          HG21      THR  37   6.721  14.329  16.828
 1173   HG22  THR  37          HG22      THR  37   5.779  15.487  15.887
 1174   HG23  THR  37          HG23      THR  37   6.955  16.060  17.071
 1175    H    VAL  38           H        VAL  38   5.506  12.797  13.820
 1176    HA   VAL  38           HA       VAL  38   4.421  14.459  11.700
 1177    HB   VAL  38           HB       VAL  38   3.419  11.820  12.780
 1178   HG11  VAL  38          HG11      VAL  38   2.731  13.310  10.252
 1179   HG12  VAL  38          HG12      VAL  38   1.675  13.078  11.646
 1180   HG13  VAL  38          HG13      VAL  38   2.172  11.692  10.672
 1181   HG21  VAL  38          HG21      VAL  38   5.115  12.401  10.359
 1182   HG22  VAL  38          HG22      VAL  38   4.463  10.828  10.812
 1183   HG23  VAL  38          HG23      VAL  38   5.657  11.618  11.843
 1184    H    LEU  39           H        LEU  39   2.660  15.700  11.866
 1185    HA   LEU  39           HA       LEU  39   1.342  15.844  14.483
 1186    HB2  LEU  39           HB3      LEU  39   1.203  17.826  12.205
 1187    HB3  LEU  39           HB2      LEU  39   0.669  18.073  13.859
 1188    HG   LEU  39           HG       LEU  39   3.541  17.702  13.003
 1189   HD11  LEU  39          HD11      LEU  39   2.065  20.188  13.843
 1190   HD12  LEU  39          HD12      LEU  39   2.624  19.813  12.211
 1191   HD13  LEU  39          HD13      LEU  39   3.793  20.071  13.509
 1192   HD21  LEU  39          HD21      LEU  39   3.135  16.901  15.261
 1193   HD22  LEU  39          HD22      LEU  39   2.348  18.424  15.673
 1194   HD23  LEU  39          HD23      LEU  39   4.068  18.397  15.287
 1195    H    ALA  40           H        ALA  40  -0.577  14.895  14.649
 1196    HA   ALA  40           HA       ALA  40  -2.002  13.872  12.406
 1197    HB1  ALA  40           HB1      ALA  40  -2.925  14.197  15.258
 1198    HB2  ALA  40           HB2      ALA  40  -2.065  12.800  14.611
 1199    HB3  ALA  40           HB3      ALA  40  -3.684  13.188  14.028
 1200    H    GLU  41           H        GLU  41  -2.000  16.816  14.122
 1201    HA   GLU  41           HA       GLU  41  -4.425  17.764  12.762
 1202    HB2  GLU  41           HB3      GLU  41  -2.794  19.053  14.971
 1203    HB3  GLU  41           HB2      GLU  41  -4.312  19.655  14.327
 1204    HG2  GLU  41           HG3      GLU  41  -4.119  16.955  15.599
 1205    HG3  GLU  41           HG2      GLU  41  -4.345  18.416  16.561
 1206    H    VAL  42           H        VAL  42  -4.007  18.775  10.862
 1207    HA   VAL  42           HA       VAL  42  -1.342  19.954  10.525
 1208    HB   VAL  42           HB       VAL  42  -1.675  19.845   8.125
 1209   HG11  VAL  42          HG11      VAL  42  -1.793  17.414   7.834
 1210   HG12  VAL  42          HG12      VAL  42  -2.406  17.256   9.481
 1211   HG13  VAL  42          HG13      VAL  42  -0.777  17.871   9.202
 1212   HG21  VAL  42          HG21      VAL  42  -3.647  18.811   7.131
 1213   HG22  VAL  42          HG22      VAL  42  -4.068  20.274   8.022
 1214   HG23  VAL  42          HG23      VAL  42  -4.391  18.688   8.723
 1215    H    ASN  43           H        ASN  43  -1.078  22.076  10.382
 1216    HA   ASN  43           HA       ASN  43  -3.500  23.720  10.301
 1217    HB2  ASN  43           HB3      ASN  43  -2.207  25.492  11.371
 1218    HB3  ASN  43           HB2      ASN  43  -2.085  24.010  12.308
 1219   HD21  ASN  43          HD21      ASN  43  -0.097  22.963  12.460
 1220   HD22  ASN  43          HD22      ASN  43   1.378  23.723  11.977
 1221    H    ILE  44           H        ILE  44  -3.991  24.583   8.450
 1222    HA   ILE  44           HA       ILE  44  -1.805  25.550   6.720
 1223    HB   ILE  44           HB       ILE  44  -4.592  24.771   5.825
 1224   HG12  ILE  44          HG13      ILE  44  -1.988  23.260   5.484
 1225   HG13  ILE  44          HG12      ILE  44  -3.293  22.801   6.577
 1226   HG21  ILE  44          HG21      ILE  44  -2.112  25.412   4.229
 1227   HG22  ILE  44          HG22      ILE  44  -3.488  26.490   4.458
 1228   HG23  ILE  44          HG23      ILE  44  -3.693  24.978   3.576
 1229   HD11  ILE  44          HD11      ILE  44  -4.780  22.553   4.614
 1230   HD12  ILE  44          HD12      ILE  44  -3.405  21.452   4.600
 1231   HD13  ILE  44          HD13      ILE  44  -3.398  22.882   3.569
 1232    H    ASN  45           H        ASN  45  -1.714  27.542   7.731
 1233    HA   ASN  45           HA       ASN  45  -2.186  29.733   8.063
 1234    HB2  ASN  45           HB3      ASN  45  -4.232  29.168   5.907
 1235    HB3  ASN  45           HB2      ASN  45  -4.034  30.764   6.621
 1236   HD21  ASN  45          HD21      ASN  45  -1.334  28.604   6.104
 1237   HD22  ASN  45          HD22      ASN  45  -0.606  29.511   4.826
 1238    H    ASN  46           H        ASN  46  -2.950  28.254  10.011
 1239    HA   ASN  46           HA       ASN  46  -4.159  28.293  11.918
 1240    HB2  ASN  46           HB3      ASN  46  -5.638  30.520  10.527
 1241    HB3  ASN  46           HB2      ASN  46  -6.088  29.943  12.128
 1242   HD21  ASN  46          HD21      ASN  46  -4.752  30.352  13.868
 1243   HD22  ASN  46          HD22      ASN  46  -3.456  31.495  13.793
 1244    H    SER  47           H        SER  47  -5.524  27.504   8.915
 1245    HA   SER  47           HA       SER  47  -7.938  26.381  10.052
 1246    HB2  SER  47           HB3      SER  47  -6.744  26.016   7.284
 1247    HB3  SER  47           HB2      SER  47  -8.373  25.558   7.780
 1248    HG   SER  47           HG       SER  47  -7.864  28.150   8.373
 1249    H    VAL  48           H        VAL  48  -7.854  24.572  11.183
 1250    HA   VAL  48           HA       VAL  48  -5.664  22.681  10.649
 1251    HB   VAL  48           HB       VAL  48  -7.169  23.069  13.242
 1252   HG11  VAL  48          HG11      VAL  48  -5.403  21.688  14.215
 1253   HG12  VAL  48          HG12      VAL  48  -4.688  21.476  12.616
 1254   HG13  VAL  48          HG13      VAL  48  -6.287  20.818  12.961
 1255   HG21  VAL  48          HG21      VAL  48  -5.822  25.034  12.721
 1256   HG22  VAL  48          HG22      VAL  48  -4.407  24.008  12.492
 1257   HG23  VAL  48          HG23      VAL  48  -5.148  24.141  14.085
 1258    H    PHE  49           H        PHE  49  -6.200  20.712   9.971
 1259    HA   PHE  49           HA       PHE  49  -8.706  19.554  10.915
 1260    HB2  PHE  49           HB3      PHE  49  -9.284  18.626   8.745
 1261    HB3  PHE  49           HB2      PHE  49  -9.160  20.374   8.614
 1262    HD1  PHE  49           HD1      PHE  49  -7.444  21.399   7.266
 1263    HD2  PHE  49           HD2      PHE  49  -7.671  17.167   7.682
 1264    HE1  PHE  49           HE1      PHE  49  -5.942  21.123   5.333
 1265    HE2  PHE  49           HE2      PHE  49  -6.166  16.890   5.759
 1266    HZ   PHE  49           HZ       PHE  49  -5.301  18.869   4.580
 1267    H    ARG  50           H        ARG  50  -8.686  17.197  10.841
 1268    HA   ARG  50           HA       ARG  50  -5.967  16.334  11.494
 1269    HB2  ARG  50           HB3      ARG  50  -6.963  14.610  12.840
 1270    HB3  ARG  50           HB2      ARG  50  -7.744  16.134  13.227
 1271    HG2  ARG  50           HG3      ARG  50  -9.644  15.484  11.800
 1272    HG3  ARG  50           HG2      ARG  50  -8.855  13.934  11.498
 1273    HD2  ARG  50           HD3      ARG  50  -8.845  13.533  13.951
 1274    HD3  ARG  50           HD2      ARG  50  -9.782  15.012  14.155
 1275    HE   ARG  50           HE       ARG  50 -10.979  13.138  12.327
 1276   HH11  ARG  50          HH11      ARG  50 -10.650  14.063  15.690
 1277   HH12  ARG  50          HH12      ARG  50 -12.132  13.302  16.171
 1278   HH21  ARG  50          HH21      ARG  50 -12.909  12.120  12.959
 1279   HH22  ARG  50          HH22      ARG  50 -13.417  12.186  14.617
 1280    H    GLN  51           H        GLN  51  -5.169  14.318  10.858
 1281    HA   GLN  51           HA       GLN  51  -6.485  13.177   8.479
 1282    HB2  GLN  51           HB3      GLN  51  -4.238  12.506   7.705
 1283    HB3  GLN  51           HB2      GLN  51  -4.377  14.251   7.874
 1284    HG2  GLN  51           HG3      GLN  51  -3.164  14.175   9.969
 1285    HG3  GLN  51           HG2      GLN  51  -3.084  12.414   9.885
 1286   HE21  GLN  51          HE21      GLN  51  -1.716  11.446   8.386
 1287   HE22  GLN  51          HE22      GLN  51  -0.428  12.317   7.626
 1288    H    TYR  52           H        TYR  52  -6.160  10.862   8.178
 1289    HA   TYR  52           HA       TYR  52  -5.797   9.452  10.739
 1290    HB2  TYR  52           HB3      TYR  52  -7.533   8.532   8.432
 1291    HB3  TYR  52           HB2      TYR  52  -7.465   7.853  10.055
 1292    HD1  TYR  52           HD1      TYR  52  -8.412   9.173  11.974
 1293    HD2  TYR  52           HD2      TYR  52  -8.927  10.366   7.923
 1294    HE1  TYR  52           HE1      TYR  52 -10.262  10.644  12.646
 1295    HE2  TYR  52           HE2      TYR  52 -10.776  11.842   8.585
 1296    HH   TYR  52           HH       TYR  52 -12.411  12.031  10.422
 1297    H    PHE  53           H        PHE  53  -4.465   7.684  10.742
 1298    HA   PHE  53           HA       PHE  53  -2.919   7.286   8.282
 1299    HB2  PHE  53           HB3      PHE  53  -2.266   6.252  11.047
 1300    HB3  PHE  53           HB2      PHE  53  -1.182   6.366   9.667
 1301    HD1  PHE  53           HD1      PHE  53  -0.269   8.521   8.982
 1302    HD2  PHE  53           HD2      PHE  53  -2.778   8.167  12.396
 1303    HE1  PHE  53           HE1      PHE  53   0.446  10.751   9.732
 1304    HE2  PHE  53           HE2      PHE  53  -2.071  10.396  13.154
 1305    HZ   PHE  53           HZ       PHE  53  -0.461  11.690  11.824
 1306    H    PHE  54           H        PHE  54  -3.690   5.731   7.040
 1307    HA   PHE  54           HA       PHE  54  -5.156   3.486   8.130
 1308    HB2  PHE  54           HB3      PHE  54  -5.946   4.531   6.062
 1309    HB3  PHE  54           HB2      PHE  54  -4.397   4.225   5.285
 1310    HD1  PHE  54           HD1      PHE  54  -4.174   2.360   3.950
 1311    HD2  PHE  54           HD2      PHE  54  -7.187   2.403   6.956
 1312    HE1  PHE  54           HE1      PHE  54  -5.025   0.209   3.121
 1313    HE2  PHE  54           HE2      PHE  54  -8.042   0.249   6.132
 1314    HZ   PHE  54           HZ       PHE  54  -6.964  -0.851   4.213
 1315    H    GLU  55           H        GLU  55  -3.826   2.109   9.182
 1316    HA   GLU  55           HA       GLU  55  -1.450   1.162   7.714
 1317    HB2  GLU  55           HB3      GLU  55  -1.897   0.974  10.700
 1318    HB3  GLU  55           HB2      GLU  55  -0.414   0.634   9.821
 1319    HG2  GLU  55           HG3      GLU  55  -0.473   3.103   9.129
 1320    HG3  GLU  55           HG2      GLU  55  -1.678   3.292  10.406
 1321    H    THR  56           H        THR  56  -1.844  -0.699   6.767
 1322    HA   THR  56           HA       THR  56  -3.533  -2.695   8.097
 1323    HB   THR  56           HB       THR  56  -2.410  -2.746   5.284
 1324    HG1  THR  56           HG1      THR  56  -4.022  -1.463   4.839
 1325   HG21  THR  56          HG21      THR  56  -2.884  -4.974   6.166
 1326   HG22  THR  56          HG22      THR  56  -4.059  -4.541   4.924
 1327   HG23  THR  56          HG23      THR  56  -4.509  -4.462   6.627
 1328    H    LYS  57           H        LYS  57  -2.454  -4.003   9.400
 1329    HA   LYS  57           HA       LYS  57   0.394  -4.471   8.831
 1330    HB2  LYS  57           HB3      LYS  57  -1.091  -4.408  11.466
 1331    HB3  LYS  57           HB2      LYS  57   0.618  -4.791  11.286
 1332    HG2  LYS  57           HG3      LYS  57   1.111  -2.604  10.502
 1333    HG3  LYS  57           HG2      LYS  57  -0.597  -2.203  10.360
 1334    HD2  LYS  57           HD3      LYS  57  -0.809  -2.419  12.813
 1335    HD3  LYS  57           HD2      LYS  57   0.929  -2.712  12.907
 1336    HE2  LYS  57           HE3      LYS  57   1.391  -0.542  11.982
 1337    HE3  LYS  57           HE2      LYS  57  -0.324  -0.251  11.718
 1338    HZ1  LYS  57           HZ1      LYS  57   0.381   0.899  13.665
 1339    HZ2  LYS  57           HZ2      LYS  57   1.050  -0.505  14.333
 1340    HZ3  LYS  57           HZ3      LYS  57  -0.626  -0.374  14.145
 1341    H    CYS  58           H        CYS  58   1.294  -6.479   9.277
 1342    HA   CYS  58           HA       CYS  58  -0.485  -8.706   8.780
 1343    HB2  CYS  58           HB3      CYS  58   2.514  -8.734   9.226
 1344    HB3  CYS  58           HB2      CYS  58   1.546 -10.025   8.530
 1345    H    ARG  59           H        ARG  59  -1.667  -8.976  10.664
 1346    HA   ARG  59           HA       ARG  59  -0.464  -9.047  13.241
 1347    HB2  ARG  59           HB3      ARG  59  -2.641  -9.953  14.007
 1348    HB3  ARG  59           HB2      ARG  59  -2.804  -8.487  13.056
 1349    HG2  ARG  59           HG3      ARG  59  -3.517  -9.747  11.146
 1350    HG3  ARG  59           HG2      ARG  59  -3.215 -11.266  11.988
 1351    HD2  ARG  59           HD3      ARG  59  -5.219  -9.169  12.813
 1352    HD3  ARG  59           HD2      ARG  59  -5.602 -10.666  11.964
 1353    HE   ARG  59           HE       ARG  59  -4.201 -11.309  14.302
 1354   HH11  ARG  59          HH11      ARG  59  -7.288  -9.964  13.349
 1355   HH12  ARG  59          HH12      ARG  59  -8.126 -10.569  14.742
 1356   HH21  ARG  59          HH21      ARG  59  -5.296 -12.104  16.139
 1357   HH22  ARG  59          HH22      ARG  59  -6.994 -11.793  16.328
 1358    H    ALA  60           H        ALA  60  -0.925 -11.356  10.731
 1359    HA   ALA  60           HA       ALA  60   0.587 -13.284  12.345
 1360    HB1  ALA  60           HB1      ALA  60  -1.792 -14.015  12.191
 1361    HB2  ALA  60           HB2      ALA  60  -0.656 -15.144  11.453
 1362    HB3  ALA  60           HB3      ALA  60  -1.617 -14.072  10.437
 1363    H    SER  61           H        SER  61   2.534 -13.085  11.403
 1364    HA   SER  61           HA       SER  61   2.848 -12.570   8.605
 1365    HB2  SER  61           HB3      SER  61   4.457 -11.748  10.319
 1366    HB3  SER  61           HB2      SER  61   4.938 -13.415  10.631
 1367    HG   SER  61           HG       SER  61   5.330 -11.861   8.293
 1368    H    ASN  62           H        ASN  62   2.751 -15.358  10.645
 1369    HA   ASN  62           HA       ASN  62   2.917 -17.051   8.248
 1370    HB2  ASN  62           HB3      ASN  62   4.223 -17.584  10.925
 1371    HB3  ASN  62           HB2      ASN  62   3.941 -18.843   9.732
 1372   HD21  ASN  62          HD21      ASN  62   4.527 -17.091   7.464
 1373   HD22  ASN  62          HD22      ASN  62   6.242 -16.888   7.462
 1374    HA   PRO  63           HA       PRO  63  -1.142 -17.605  10.446
 1375    HB2  PRO  63           HB3      PRO  63  -2.317 -18.532   8.093
 1376    HB3  PRO  63           HB2      PRO  63  -2.403 -16.873   8.701
 1377    HG2  PRO  63           HG3      PRO  63  -0.615 -18.050   6.625
 1378    HG3  PRO  63           HG2      PRO  63  -1.364 -16.445   6.682
 1379    HD2  PRO  63           HD3      PRO  63   1.241 -16.793   7.251
 1380    HD3  PRO  63           HD2      PRO  63   0.253 -15.601   8.134
 1381    H    VAL  64           H        VAL  64   0.612 -19.695   8.180
 1382    HA   VAL  64           HA       VAL  64  -0.409 -22.007   9.683
 1383    HB   VAL  64           HB       VAL  64   0.251 -23.420   7.779
 1384   HG11  VAL  64          HG11      VAL  64  -1.548 -21.129   7.015
 1385   HG12  VAL  64          HG12      VAL  64  -2.025 -22.576   7.904
 1386   HG13  VAL  64          HG13      VAL  64  -1.494 -22.705   6.228
 1387   HG21  VAL  64          HG21      VAL  64   2.065 -22.044   6.900
 1388   HG22  VAL  64          HG22      VAL  64   0.895 -20.831   6.386
 1389   HG23  VAL  64          HG23      VAL  64   0.885 -22.433   5.650
 1390    H    GLU  65           H        GLU  65   1.410 -23.905   9.259
 1391    HA   GLU  65           HA       GLU  65   3.194 -23.489  11.291
 1392    HB2  GLU  65           HB3      GLU  65   4.379 -25.509  10.479
 1393    HB3  GLU  65           HB2      GLU  65   2.636 -25.705  10.559
 1394    HG2  GLU  65           HG3      GLU  65   2.478 -25.365   8.152
 1395    HG3  GLU  65           HG2      GLU  65   4.226 -25.146   8.069
 1396    H    SER  66           H        SER  66   3.863 -23.000   7.823
 1397    HA   SER  66           HA       SER  66   6.180 -21.418   8.576
 1398    HB2  SER  66           HB3      SER  66   6.442 -23.826   6.755
 1399    HB3  SER  66           HB2      SER  66   7.716 -22.654   7.095
 1400    HG   SER  66           HG       SER  66   6.717 -23.555   9.411
 1401    H    GLY  67           H        GLY  67   3.934 -20.334   7.521
 1402    HA2  GLY  67           HA3      GLY  67   4.777 -18.627   5.660
 1403    HA3  GLY  67           HA2      GLY  67   4.391 -20.022   4.663
 1404    H    CYS  68           H        CYS  68   2.799 -18.925   3.560
 1405    HA   CYS  68           HA       CYS  68   0.503 -17.911   5.039
 1406    HB2  CYS  68           HB3      CYS  68   1.004 -17.928   2.051
 1407    HB3  CYS  68           HB2      CYS  68  -0.212 -16.983   2.915
 1408    H    ARG  69           H        ARG  69  -1.699 -18.476   4.098
 1409    HA   ARG  69           HA       ARG  69  -2.033 -21.301   4.334
 1410    HB2  ARG  69           HB3      ARG  69  -4.037 -19.161   3.559
 1411    HB3  ARG  69           HB2      ARG  69  -4.442 -20.834   3.929
 1412    HG2  ARG  69           HG3      ARG  69  -3.561 -20.498   6.217
 1413    HG3  ARG  69           HG2      ARG  69  -3.271 -18.804   5.819
 1414    HD2  ARG  69           HD3      ARG  69  -5.364 -18.996   7.008
 1415    HD3  ARG  69           HD2      ARG  69  -5.675 -18.531   5.334
 1416    HE   ARG  69           HE       ARG  69  -5.830 -21.315   5.500
 1417   HH11  ARG  69          HH11      ARG  69  -7.555 -18.497   6.656
 1418   HH12  ARG  69          HH12      ARG  69  -9.079 -19.317   6.768
 1419   HH21  ARG  69          HH21      ARG  69  -7.836 -22.397   5.634
 1420   HH22  ARG  69          HH22      ARG  69  -9.240 -21.541   6.186
 1421    H    GLY  70           H        GLY  70  -1.869 -22.773   2.785
 1422    HA2  GLY  70           HA3      GLY  70  -2.627 -23.664   0.689
 1423    HA3  GLY  70           HA2      GLY  70  -2.644 -22.030   0.042
 1424    H    ILE  71           H        ILE  71   0.008 -21.539   1.364
 1425    HA   ILE  71           HA       ILE  71   1.565 -22.183  -0.944
 1426    HB   ILE  71           HB       ILE  71   2.407 -20.944   1.678
 1427   HG12  ILE  71          HG13      ILE  71   0.716 -19.597   0.577
 1428   HG13  ILE  71          HG12      ILE  71   2.281 -18.808   0.426
 1429   HG21  ILE  71          HG21      ILE  71   3.830 -21.029  -0.978
 1430   HG22  ILE  71          HG22      ILE  71   4.307 -21.879   0.492
 1431   HG23  ILE  71          HG23      ILE  71   4.353 -20.118   0.436
 1432   HD11  ILE  71          HD11      ILE  71   0.860 -20.383  -1.707
 1433   HD12  ILE  71          HD12      ILE  71   2.463 -19.668  -1.872
 1434   HD13  ILE  71          HD13      ILE  71   1.054 -18.633  -1.640
 1435    H    ASP  72           H        ASP  72   3.044 -23.741  -1.231
 1436    HA   ASP  72           HA       ASP  72   3.344 -25.783   0.811
 1437    HB2  ASP  72           HB3      ASP  72   4.493 -25.603  -1.990
 1438    HB3  ASP  72           HB2      ASP  72   4.662 -26.987  -0.917
 1439    H    SER  73           H        SER  73   4.719 -25.287   2.385
 1440    HA   SER  73           HA       SER  73   6.756 -23.382   2.249
 1441    HB2  SER  73           HB3      SER  73   6.465 -25.686   4.194
 1442    HB3  SER  73           HB2      SER  73   7.440 -24.235   4.447
 1443    HG   SER  73           HG       SER  73   5.627 -23.022   4.615
 1444    H    LYS  74           H        LYS  74   6.750 -26.709   1.322
 1445    HA   LYS  74           HA       LYS  74   9.588 -27.072   1.440
 1446    HB2  LYS  74           HB3      LYS  74   7.425 -28.630   0.026
 1447    HB3  LYS  74           HB2      LYS  74   9.112 -29.113   0.065
 1448    HG2  LYS  74           HG3      LYS  74   8.980 -29.206   2.541
 1449    HG3  LYS  74           HG2      LYS  74   7.256 -28.862   2.420
 1450    HD2  LYS  74           HD3      LYS  74   8.656 -31.222   1.184
 1451    HD3  LYS  74           HD2      LYS  74   7.708 -31.263   2.669
 1452    HE2  LYS  74           HE3      LYS  74   5.735 -30.533   1.388
 1453    HE3  LYS  74           HE2      LYS  74   6.701 -30.571  -0.086
 1454    HZ1  LYS  74           HZ1      LYS  74   5.394 -32.583   0.173
 1455    HZ2  LYS  74           HZ2      LYS  74   6.129 -32.900   1.660
 1456    HZ3  LYS  74           HZ3      LYS  74   7.047 -32.934   0.239
 1457    H    HIS  75           H        HIS  75   7.337 -25.833  -0.899
 1458    HA   HIS  75           HA       HIS  75   9.403 -25.815  -2.977
 1459    HB2  HIS  75           HB3      HIS  75   6.433 -25.367  -3.016
 1460    HB3  HIS  75           HB2      HIS  75   7.430 -24.749  -4.326
 1461    HD1  HIS  75           HD1      HIS  75   7.918 -26.337  -6.172
 1462    HD2  HIS  75           HD2      HIS  75   6.713 -28.294  -2.704
 1463    HE1  HIS  75           HE1      HIS  75   7.708 -28.765  -6.803
 1464    HE2  HIS  75           HE2      HIS  75   6.899 -29.916  -4.711
 1465    H    TRP  76           H        TRP  76   7.747 -23.732  -0.762
 1466    HA   TRP  76           HA       TRP  76   9.427 -21.495  -1.633
 1467    HB2  TRP  76           HB3      TRP  76   6.433 -21.321  -1.202
 1468    HB3  TRP  76           HB2      TRP  76   7.497 -19.938  -1.457
 1469    HD1  TRP  76           HD1      TRP  76   5.391 -22.382  -3.284
 1470    HE1  TRP  76           HE1      TRP  76   5.717 -22.117  -5.819
 1471    HE3  TRP  76           HE3      TRP  76   9.538 -19.393  -3.270
 1472    HZ2  TRP  76           HZ2      TRP  76   7.488 -20.815  -7.581
 1473    HZ3  TRP  76           HZ3      TRP  76  10.488 -18.685  -5.424
 1474    HH2  TRP  76           HH2      TRP  76   9.484 -19.383  -7.536
 1475    H    ASN  77           H        ASN  77  10.450 -20.638   0.160
 1476    HA   ASN  77           HA       ASN  77   9.249 -21.021   2.775
 1477    HB2  ASN  77           HB3      ASN  77  11.753 -20.940   2.461
 1478    HB3  ASN  77           HB2      ASN  77  11.590 -19.244   2.025
 1479   HD21  ASN  77          HD21      ASN  77  11.415 -21.569   4.598
 1480   HD22  ASN  77          HD22      ASN  77  11.405 -20.425   5.898
 1481    H    SER  78           H        SER  78   8.111 -19.404   3.898
 1482    HA   SER  78           HA       SER  78   7.357 -17.112   2.253
 1483    HB2  SER  78           HB3      SER  78   5.905 -18.930   1.538
 1484    HB3  SER  78           HB2      SER  78   5.452 -19.258   3.209
 1485    HG   SER  78           HG       SER  78   4.889 -16.912   1.711
 1486    H    TYR  79           H        TYR  79   6.443 -15.432   3.301
 1487    HA   TYR  79           HA       TYR  79   5.320 -15.597   5.887
 1488    HB2  TYR  79           HB3      TYR  79   6.865 -14.197   7.129
 1489    HB3  TYR  79           HB2      TYR  79   7.736 -15.599   6.518
 1490    HD1  TYR  79           HD1      TYR  79   7.219 -11.965   6.075
 1491    HD2  TYR  79           HD2      TYR  79   9.593 -15.345   5.050
 1492    HE1  TYR  79           HE1      TYR  79   8.929 -10.471   5.132
 1493    HE2  TYR  79           HE2      TYR  79  11.307 -13.857   4.098
 1494    HH   TYR  79           HH       TYR  79  11.496 -11.587   3.190
 1495    H    CYS  80           H        CYS  80   4.500 -13.455   6.569
 1496    HA   CYS  80           HA       CYS  80   3.778 -11.953   4.164
 1497    HB2  CYS  80           HB3      CYS  80   2.475 -11.860   6.889
 1498    HB3  CYS  80           HB2      CYS  80   1.831 -11.210   5.380
 1499    H    THR  81           H        THR  81   4.252  -9.871   3.877
 1500    HA   THR  81           HA       THR  81   5.475  -8.391   6.102
 1501    HB   THR  81           HB       THR  81   7.271  -9.313   4.602
 1502    HG1  THR  81           HG1      THR  81   8.036  -7.553   5.553
 1503   HG21  THR  81          HG21      THR  81   7.581  -8.285   2.392
 1504   HG22  THR  81          HG22      THR  81   6.034  -7.455   2.568
 1505   HG23  THR  81          HG23      THR  81   6.087  -9.215   2.472
 1506    H    THR  82           H        THR  82   5.204  -6.128   5.982
 1507    HA   THR  82           HA       THR  82   2.761  -5.416   4.621
 1508    HB   THR  82           HB       THR  82   3.161  -3.212   5.893
 1509    HG1  THR  82           HG1      THR  82   5.011  -3.110   6.878
 1510   HG21  THR  82          HG21      THR  82   2.337  -4.197   7.994
 1511   HG22  THR  82          HG22      THR  82   2.746  -5.801   7.386
 1512   HG23  THR  82          HG23      THR  82   1.501  -4.844   6.582
 1513    H    THR  83           H        THR  83   2.491  -3.850   3.100
 1514    HA   THR  83           HA       THR  83   4.904  -2.870   1.757
 1515    HB   THR  83           HB       THR  83   2.031  -2.598   0.849
 1516    HG1  THR  83           HG1      THR  83   3.646  -4.793   0.940
 1517   HG21  THR  83          HG21      THR  83   3.643  -1.099  -0.240
 1518   HG22  THR  83          HG22      THR  83   3.027  -2.309  -1.365
 1519   HG23  THR  83          HG23      THR  83   4.640  -2.487  -0.674
 1520    H    HIS  84           H        HIS  84   5.512  -0.765   1.910
 1521    HA   HIS  84           HA       HIS  84   3.731   0.979   3.461
 1522    HB2  HIS  84           HB3      HIS  84   5.734   2.280   4.068
 1523    HB3  HIS  84           HB2      HIS  84   5.881   0.599   4.554
 1524    HD1  HIS  84           HD1      HIS  84   7.868  -0.686   3.686
 1525    HD2  HIS  84           HD2      HIS  84   7.413   3.008   1.827
 1526    HE1  HIS  84           HE1      HIS  84   9.968  -0.333   2.354
 1527    HE2  HIS  84           HE2      HIS  84   9.741   1.978   1.381
 1528    H    THR  85           H        THR  85   3.015   2.853   2.692
 1529    HA   THR  85           HA       THR  85   4.033   3.742   0.071
 1530    HB   THR  85           HB       THR  85   1.639   2.955   0.062
 1531    HG1  THR  85           HG1      THR  85   1.255   4.437  -1.413
 1532   HG21  THR  85          HG21      THR  85   1.216   5.361   1.840
 1533   HG22  THR  85          HG22      THR  85   0.987   3.673   2.297
 1534   HG23  THR  85          HG23      THR  85  -0.061   4.408   1.085
 1535    H    PHE  86           H        PHE  86   3.489   6.255  -0.149
 1536    HA   PHE  86           HA       PHE  86   4.497   7.453   2.347
 1537    HB2  PHE  86           HB3      PHE  86   5.235   8.221  -0.493
 1538    HB3  PHE  86           HB2      PHE  86   5.808   9.026   0.970
 1539    HD1  PHE  86           HD1      PHE  86   7.198   7.690   2.608
 1540    HD2  PHE  86           HD2      PHE  86   6.322   6.336  -1.328
 1541    HE1  PHE  86           HE1      PHE  86   9.078   6.108   2.740
 1542    HE2  PHE  86           HE2      PHE  86   8.198   4.751  -1.207
 1543    HZ   PHE  86           HZ       PHE  86   9.579   4.632   0.829
 1544    H    VAL  87           H        VAL  87   3.146   8.825   3.215
 1545    HA   VAL  87           HA       VAL  87   1.202  10.188   1.468
 1546    HB   VAL  87           HB       VAL  87  -0.228  10.397   3.501
 1547   HG11  VAL  87          HG11      VAL  87  -0.926   8.025   3.552
 1548   HG12  VAL  87          HG12      VAL  87   0.540   7.607   2.662
 1549   HG13  VAL  87          HG13      VAL  87  -0.681   8.641   1.918
 1550   HG21  VAL  87          HG21      VAL  87   1.526  10.193   5.197
 1551   HG22  VAL  87          HG22      VAL  87   1.773   8.508   4.736
 1552   HG23  VAL  87          HG23      VAL  87   0.241   9.012   5.449
 1553    H    LYS  88           H        LYS  88   0.718  12.359   1.846
 1554    HA   LYS  88           HA       LYS  88   2.910  13.956   2.774
 1555    HB2  LYS  88           HB3      LYS  88   0.126  14.799   1.936
 1556    HB3  LYS  88           HB2      LYS  88   1.493  15.875   2.160
 1557    HG2  LYS  88           HG3      LYS  88   2.643  14.810   0.290
 1558    HG3  LYS  88           HG2      LYS  88   1.276  13.717   0.072
 1559    HD2  LYS  88           HD3      LYS  88  -0.183  15.678  -0.291
 1560    HD3  LYS  88           HD2      LYS  88   1.237  16.716  -0.170
 1561    HE2  LYS  88           HE3      LYS  88   2.200  15.742  -2.126
 1562    HE3  LYS  88           HE2      LYS  88   0.939  14.508  -2.194
 1563    HZ1  LYS  88           HZ1      LYS  88   0.461  16.229  -3.781
 1564    HZ2  LYS  88           HZ2      LYS  88   0.577  17.428  -2.594
 1565    HZ3  LYS  88           HZ3      LYS  88  -0.685  16.302  -2.538
 1566    H    ALA  89           H        ALA  89   3.256  14.372   4.835
 1567    HA   ALA  89           HA       ALA  89   0.925  14.878   6.568
 1568    HB1  ALA  89           HB1      ALA  89   1.882  12.665   7.067
 1569    HB2  ALA  89           HB2      ALA  89   2.052  13.786   8.415
 1570    HB3  ALA  89           HB3      ALA  89   3.440  13.428   7.390
 1571    H    LEU  90           H        LEU  90   1.169  16.502   8.089
 1572    HA   LEU  90           HA       LEU  90   3.292  18.390   7.569
 1573    HB2  LEU  90           HB3      LEU  90   0.927  19.103   8.026
 1574    HB3  LEU  90           HB2      LEU  90   1.113  18.495   9.665
 1575    HG   LEU  90           HG       LEU  90   3.018  20.134   9.948
 1576   HD11  LEU  90          HD11      LEU  90   1.904  21.209   7.362
 1577   HD12  LEU  90          HD12      LEU  90   3.522  20.554   7.622
 1578   HD13  LEU  90          HD13      LEU  90   3.040  22.056   8.413
 1579   HD21  LEU  90          HD21      LEU  90   0.815  20.530  10.896
 1580   HD22  LEU  90          HD22      LEU  90   0.270  21.232   9.372
 1581   HD23  LEU  90          HD23      LEU  90   1.524  22.037  10.317
 1582    H    THR  91           H        THR  91   5.202  18.013   8.448
 1583    HA   THR  91           HA       THR  91   5.281  16.686  11.074
 1584    HB   THR  91           HB       THR  91   7.489  15.801  10.401
 1585    HG1  THR  91           HG1      THR  91   7.112  17.541   8.356
 1586   HG21  THR  91          HG21      THR  91   5.537  14.396  10.066
 1587   HG22  THR  91          HG22      THR  91   6.666  14.165   8.735
 1588   HG23  THR  91          HG23      THR  91   5.226  15.156   8.505
 1589    H    THR  92           H        THR  92   7.144  17.209  12.411
 1590    HA   THR  92           HA       THR  92   8.452  19.740  11.744
 1591    HB   THR  92           HB       THR  92   6.659  20.353  13.265
 1592    HG1  THR  92           HG1      THR  92   8.048  21.119  15.049
 1593   HG21  THR  92          HG21      THR  92   7.843  18.356  15.196
 1594   HG22  THR  92          HG22      THR  92   6.320  18.164  14.328
 1595   HG23  THR  92          HG23      THR  92   6.498  19.449  15.521
 1596    H    ASP  93           H        ASP  93  10.584  19.806  12.265
 1597    HA   ASP  93           HA       ASP  93  11.688  17.371  13.470
 1598    HB2  ASP  93           HB3      ASP  93  13.778  17.891  12.360
 1599    HB3  ASP  93           HB2      ASP  93  12.473  17.953  11.181
 1600    H    GLU  94           H        GLU  94  10.996  20.562  14.152
 1601    HA   GLU  94           HA       GLU  94  12.213  20.364  16.716
 1602    HB2  GLU  94           HB3      GLU  94  13.535  22.509  16.515
 1603    HB3  GLU  94           HB2      GLU  94  14.222  21.105  15.716
 1604    HG2  GLU  94           HG3      GLU  94  13.562  21.904  13.579
 1605    HG3  GLU  94           HG2      GLU  94  12.618  23.203  14.294
 1606    H    LYS  95           H        LYS  95  11.012  22.856  14.447
 1607    HA   LYS  95           HA       LYS  95   8.899  23.510  16.341
 1608    HB2  LYS  95           HB3      LYS  95  10.915  25.537  15.361
 1609    HB3  LYS  95           HB2      LYS  95   9.409  25.949  16.163
 1610    HG2  LYS  95           HG3      LYS  95  10.141  24.812  18.178
 1611    HG3  LYS  95           HG2      LYS  95  11.629  24.314  17.370
 1612    HD2  LYS  95           HD3      LYS  95  12.212  26.684  17.057
 1613    HD3  LYS  95           HD2      LYS  95  10.768  27.141  17.958
 1614    HE2  LYS  95           HE3      LYS  95  11.611  25.998  19.923
 1615    HE3  LYS  95           HE2      LYS  95  13.017  25.443  19.021
 1616    HZ1  LYS  95           HZ1      LYS  95  12.352  28.277  19.593
 1617    HZ2  LYS  95           HZ2      LYS  95  13.710  27.736  18.747
 1618    HZ3  LYS  95           HZ3      LYS  95  13.534  27.367  20.386
 1619    H    GLN  96           H        GLN  96  10.424  24.548  13.290
 1620    HA   GLN  96           HA       GLN  96   8.027  25.571  12.175
 1621    HB2  GLN  96           HB3      GLN  96  10.230  26.344  11.443
 1622    HB3  GLN  96           HB2      GLN  96  10.609  24.741  10.840
 1623    HG2  GLN  96           HG3      GLN  96  10.027  26.262   9.040
 1624    HG3  GLN  96           HG2      GLN  96   8.872  24.937   9.158
 1625   HE21  GLN  96          HE21      GLN  96   6.756  25.376   9.604
 1626   HE22  GLN  96          HE22      GLN  96   6.119  26.978   9.759
 1627    H    ALA  97           H        ALA  97   6.338  24.365  11.689
 1628    HA   ALA  97           HA       ALA  97   6.519  21.594  11.015
 1629    HB1  ALA  97           HB1      ALA  97   4.566  22.498  12.179
 1630    HB2  ALA  97           HB2      ALA  97   4.106  21.732  10.659
 1631    HB3  ALA  97           HB3      ALA  97   4.183  23.490  10.772
 1632    H    ALA  98           H        ALA  98   6.466  20.635   9.042
 1633    HA   ALA  98           HA       ALA  98   6.049  22.255   6.654
 1634    HB1  ALA  98           HB1      ALA  98   8.444  22.442   7.075
 1635    HB2  ALA  98           HB2      ALA  98   8.145  21.468   5.635
 1636    HB3  ALA  98           HB3      ALA  98   8.579  20.685   7.155
 1637    H    TRP  99           H        TRP  99   5.579  21.008   4.793
 1638    HA   TRP  99           HA       TRP  99   4.291  18.505   5.433
 1639    HB2  TRP  99           HB3      TRP  99   4.452  20.126   2.887
 1640    HB3  TRP  99           HB2      TRP  99   3.577  18.607   3.015
 1641    HD1  TRP  99           HD1      TRP  99   3.423  22.249   4.184
 1642    HE1  TRP  99           HE1      TRP  99   1.043  22.736   5.040
 1643    HE3  TRP  99           HE3      TRP  99   1.519  17.516   3.997
 1644    HZ2  TRP  99           HZ2      TRP  99  -1.325  21.296   5.564
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.816  17.154   4.690
 1646    HH2  TRP  99           HH2      TRP  99  -2.206  19.007   5.457
 1647    H    ARG 100           H        ARG 100   5.189  16.591   5.272
 1648    HA   ARG 100           HA       ARG 100   7.324  16.173   3.289
 1649    HB2  ARG 100           HB3      ARG 100   7.224  15.023   6.092
 1650    HB3  ARG 100           HB2      ARG 100   8.455  14.673   4.888
 1651    HG2  ARG 100           HG3      ARG 100   7.929  17.349   6.166
 1652    HG3  ARG 100           HG2      ARG 100   9.260  16.255   6.539
 1653    HD2  ARG 100           HD3      ARG 100  10.111  16.496   4.268
 1654    HD3  ARG 100           HD2      ARG 100   8.765  17.561   3.869
 1655    HE   ARG 100           HE       ARG 100  10.714  18.257   5.962
 1656   HH11  ARG 100          HH11      ARG 100   8.906  19.069   3.073
 1657   HH12  ARG 100          HH12      ARG 100   9.545  20.678   2.971
 1658   HH21  ARG 100          HH21      ARG 100  11.547  20.371   5.839
 1659   HH22  ARG 100          HH22      ARG 100  11.059  21.418   4.546
 1660    H    PHE 101           H        PHE 101   7.722  13.658   3.178
 1661    HA   PHE 101           HA       PHE 101   5.068  12.416   2.823
 1662    HB2  PHE 101           HB3      PHE 101   7.617  11.975   1.230
 1663    HB3  PHE 101           HB2      PHE 101   6.138  11.053   1.021
 1664    HD1  PHE 101           HD1      PHE 101   7.553  14.480   0.747
 1665    HD2  PHE 101           HD2      PHE 101   4.438  11.802  -0.379
 1666    HE1  PHE 101           HE1      PHE 101   6.758  16.108  -0.915
 1667    HE2  PHE 101           HE2      PHE 101   3.639  13.430  -2.039
 1668    HZ   PHE 101           HZ       PHE 101   4.799  15.583  -2.309
 1669    H    ILE 102           H        ILE 102   4.731  10.865   4.307
 1670    HA   ILE 102           HA       ILE 102   7.120   9.519   5.406
 1671    HB   ILE 102           HB       ILE 102   5.811   9.122   7.465
 1672   HG12  ILE 102          HG13      ILE 102   3.782  11.030   6.305
 1673   HG13  ILE 102          HG12      ILE 102   3.568   9.286   6.328
 1674   HG21  ILE 102          HG21      ILE 102   5.889  11.425   8.308
 1675   HG22  ILE 102          HG22      ILE 102   6.043  12.012   6.651
 1676   HG23  ILE 102          HG23      ILE 102   7.316  11.016   7.356
 1677   HD11  ILE 102          HD11      ILE 102   3.860  11.073   8.730
 1678   HD12  ILE 102          HD12      ILE 102   3.684   9.318   8.772
 1679   HD13  ILE 102          HD13      ILE 102   2.373  10.324   8.152
 1680    H    ARG 103           H        ARG 103   7.071   7.337   5.801
 1681    HA   ARG 103           HA       ARG 103   5.374   5.836   4.029
 1682    HB2  ARG 103           HB3      ARG 103   6.641   3.862   4.830
 1683    HB3  ARG 103           HB2      ARG 103   7.694   5.149   4.261
 1684    HG2  ARG 103           HG3      ARG 103   8.392   5.688   6.418
 1685    HG3  ARG 103           HG2      ARG 103   7.034   4.850   7.164
 1686    HD2  ARG 103           HD3      ARG 103   9.145   3.410   5.575
 1687    HD3  ARG 103           HD2      ARG 103   9.300   3.702   7.306
 1688    HE   ARG 103           HE       ARG 103   6.850   2.529   7.044
 1689   HH11  ARG 103          HH11      ARG 103  10.095   1.646   6.066
 1690   HH12  ARG 103          HH12      ARG 103   9.822  -0.060   6.249
 1691   HH21  ARG 103          HH21      ARG 103   6.489   0.270   7.304
 1692   HH22  ARG 103          HH22      ARG 103   7.780  -0.838   6.938
 1693    H    ILE 104           H        ILE 104   3.548   4.862   4.490
 1694    HA   ILE 104           HA       ILE 104   3.135   3.927   7.245
 1695    HB   ILE 104           HB       ILE 104   0.689   4.143   6.922
 1696   HG12  ILE 104          HG13      ILE 104   1.385   5.784   4.483
 1697   HG13  ILE 104          HG12      ILE 104   0.750   4.145   4.422
 1698   HG21  ILE 104          HG21      ILE 104   0.572   6.578   7.214
 1699   HG22  ILE 104          HG22      ILE 104   2.236   6.711   6.650
 1700   HG23  ILE 104          HG23      ILE 104   1.882   5.853   8.149
 1701   HD11  ILE 104          HD11      ILE 104  -0.646   6.535   5.593
 1702   HD12  ILE 104          HD12      ILE 104  -1.289   4.894   5.525
 1703   HD13  ILE 104          HD13      ILE 104  -0.991   5.788   4.034
 1704    H    ASP 105           H        ASP 105   2.608   1.824   7.440
 1705    HA   ASP 105           HA       ASP 105   2.812   0.144   5.125
 1706    HB2  ASP 105           HB3      ASP 105   2.242  -0.450   8.039
 1707    HB3  ASP 105           HB2      ASP 105   2.352  -1.702   6.799
 1708    H    THR 106           H        THR 106   1.190  -0.038   3.762
 1709    HA   THR 106           HA       THR 106  -1.504   0.572   4.765
 1710    HB   THR 106           HB       THR 106  -0.722   2.175   3.145
 1711    HG1  THR 106           HG1      THR 106  -2.806   0.445   2.492
 1712   HG21  THR 106          HG21      THR 106  -0.109   1.544   0.863
 1713   HG22  THR 106          HG22      THR 106  -0.303  -0.160   1.276
 1714   HG23  THR 106          HG23      THR 106   0.967   0.794   2.040
 1715    H    ALA 107           H        ALA 107   0.305  -2.054   3.724
 1716    HA   ALA 107           HA       ALA 107  -2.061  -3.672   3.412
 1717    HB1  ALA 107           HB1      ALA 107  -1.510  -4.530   1.202
 1718    HB2  ALA 107           HB2      ALA 107  -0.144  -3.418   1.099
 1719    HB3  ALA 107           HB3      ALA 107  -1.791  -2.789   1.146
 1720    H    CYS 108           H        CYS 108  -1.505  -5.985   3.138
 1721    HA   CYS 108           HA       CYS 108   1.184  -6.642   4.134
 1722    HB2  CYS 108           HB3      CYS 108  -0.419  -6.841   5.990
 1723    HB3  CYS 108           HB2      CYS 108  -1.451  -7.875   5.003
 1724    H    VAL 109           H        VAL 109   2.222  -7.979   2.791
 1725    HA   VAL 109           HA       VAL 109   0.599  -9.523   0.873
 1726    HB   VAL 109           HB       VAL 109   2.365  -9.244  -0.782
 1727   HG11  VAL 109          HG11      VAL 109   0.609  -7.578  -0.745
 1728   HG12  VAL 109          HG12      VAL 109   2.143  -6.829  -1.191
 1729   HG13  VAL 109          HG13      VAL 109   1.505  -6.628   0.442
 1730   HG21  VAL 109          HG21      VAL 109   3.757  -7.539   1.284
 1731   HG22  VAL 109          HG22      VAL 109   4.266  -7.751  -0.390
 1732   HG23  VAL 109          HG23      VAL 109   4.288  -9.123   0.719
 1733    H    CYS 110           H        CYS 110   1.683 -11.448   0.001
 1734    HA   CYS 110           HA       CYS 110   3.175 -12.817   2.130
 1735    HB2  CYS 110           HB3      CYS 110   1.004 -13.816   1.645
 1736    HB3  CYS 110           HB2      CYS 110   1.406 -13.929  -0.061
 1737    H    VAL 111           H        VAL 111   5.253 -13.271   1.746
 1738    HA   VAL 111           HA       VAL 111   6.233 -13.068  -1.006
 1739    HB   VAL 111           HB       VAL 111   8.457 -12.942  -0.098
 1740   HG11  VAL 111          HG11      VAL 111   6.567 -11.259   1.531
 1741   HG12  VAL 111          HG12      VAL 111   7.210 -10.872  -0.065
 1742   HG13  VAL 111          HG13      VAL 111   8.291 -10.953   1.324
 1743   HG21  VAL 111          HG21      VAL 111   7.269 -13.469   2.615
 1744   HG22  VAL 111          HG22      VAL 111   8.961 -13.125   2.263
 1745   HG23  VAL 111          HG23      VAL 111   8.221 -14.613   1.670
 1746    H    LEU 112           H        LEU 112   7.417 -14.718  -2.017
 1747    HA   LEU 112           HA       LEU 112   7.431 -17.331  -0.652
 1748    HB2  LEU 112           HB3      LEU 112   6.919 -16.843  -3.596
 1749    HB3  LEU 112           HB2      LEU 112   6.998 -18.410  -2.815
 1750    HG   LEU 112           HG       LEU 112   4.861 -16.311  -2.435
 1751   HD11  LEU 112          HD11      LEU 112   4.862 -19.052  -3.686
 1752   HD12  LEU 112          HD12      LEU 112   4.611 -17.507  -4.501
 1753   HD13  LEU 112          HD13      LEU 112   3.413 -18.107  -3.353
 1754   HD21  LEU 112          HD21      LEU 112   5.268 -17.384  -0.313
 1755   HD22  LEU 112          HD22      LEU 112   5.218 -18.974  -1.074
 1756   HD23  LEU 112          HD23      LEU 112   3.760 -17.986  -1.003
 1757    H    SER 113           H        SER 113   9.365 -18.389  -0.718
 1758    HA   SER 113           HA       SER 113  11.152 -18.273  -2.899
 1759    HB2  SER 113           HB3      SER 113  13.043 -17.095  -1.629
 1760    HB3  SER 113           HB2      SER 113  11.760 -16.073  -2.277
 1761    HG   SER 113           HG       SER 113  10.792 -16.274  -0.116
 1762    H    ARG 114           H        ARG 114  10.885 -20.625  -2.353
 1763    HA   ARG 114           HA       ARG 114  12.932 -21.310  -0.347
 1764    HB2  ARG 114           HB3      ARG 114  10.904 -22.673  -0.214
 1765    HB3  ARG 114           HB2      ARG 114  11.101 -23.157  -1.891
 1766    HG2  ARG 114           HG3      ARG 114  11.822 -24.936  -0.446
 1767    HG3  ARG 114           HG2      ARG 114  13.216 -24.274  -1.297
 1768    HD2  ARG 114           HD3      ARG 114  12.434 -23.453   1.494
 1769    HD3  ARG 114           HD2      ARG 114  13.551 -24.772   1.154
 1770    HE   ARG 114           HE       ARG 114  14.688 -22.768  -0.198
 1771   HH11  ARG 114          HH11      ARG 114  13.457 -22.942   3.072
 1772   HH12  ARG 114          HH12      ARG 114  14.536 -21.729   3.683
 1773   HH21  ARG 114          HH21      ARG 114  16.109 -21.160   0.591
 1774   HH22  ARG 114          HH22      ARG 114  16.060 -20.723   2.271
 1775    H    LYS 115           H        LYS 115  12.141 -21.561  -3.754
 1776    HA   LYS 115           HA       LYS 115  14.814 -22.641  -4.284
 1777    HB2  LYS 115           HB3      LYS 115  12.452 -22.513  -6.169
 1778    HB3  LYS 115           HB2      LYS 115  13.932 -23.434  -6.391
 1779    HG2  LYS 115           HG3      LYS 115  13.333 -24.825  -4.449
 1780    HG3  LYS 115           HG2      LYS 115  11.830 -23.911  -4.283
 1781    HD2  LYS 115           HD3      LYS 115  11.324 -25.923  -5.461
 1782    HD3  LYS 115           HD2      LYS 115  11.248 -24.593  -6.614
 1783    HE2  LYS 115           HE3      LYS 115  12.389 -26.465  -7.615
 1784    HE3  LYS 115           HE2      LYS 115  13.525 -25.143  -7.362
 1785    HZ1  LYS 115           HZ1      LYS 115  14.487 -27.260  -6.725
 1786    HZ2  LYS 115           HZ2      LYS 115  13.234 -27.534  -5.628
 1787    HZ3  LYS 115           HZ3      LYS 115  14.320 -26.267  -5.365
 1788    H    ALA 116           H        ALA 116  13.633 -19.763  -3.921
 1789    HA   ALA 116           HA       ALA 116  14.741 -18.577  -6.361
 1790    HB1  ALA 116           HB1      ALA 116  12.520 -17.804  -5.659
 1791    HB2  ALA 116           HB2      ALA 116  13.705 -16.500  -5.637
 1792    HB3  ALA 116           HB3      ALA 116  13.201 -17.258  -4.126
 1793    H    THR 117           H        THR 117  15.416 -19.158  -3.064
 1794    HA   THR 117           HA       THR 117  17.215 -16.996  -2.612
 1795    HB   THR 117           HB       THR 117  17.944 -18.476  -0.649
 1796    HG1  THR 117           HG1      THR 117  17.228 -20.471  -1.550
 1797   HG21  THR 117          HG21      THR 117  15.026 -17.733  -0.912
 1798   HG22  THR 117          HG22      THR 117  16.325 -16.662  -0.390
 1799   HG23  THR 117          HG23      THR 117  15.872 -18.046   0.603
 1800    H    ARG 118           H        ARG 118  19.547 -17.455  -2.006
 1801    HA   ARG 118           HA       ARG 118  20.707 -19.206  -4.064
 1802    HB2  ARG 118           HB3      ARG 118  21.972 -16.861  -2.624
 1803    HB3  ARG 118           HB2      ARG 118  22.724 -17.804  -3.895
 1804    HG2  ARG 118           HG3      ARG 118  20.227 -16.159  -4.252
 1805    HG3  ARG 118           HG2      ARG 118  21.854 -15.593  -4.615
 1806    HD2  ARG 118           HD3      ARG 118  20.909 -16.291  -6.671
 1807    HD3  ARG 118           HD2      ARG 118  22.054 -17.546  -6.206
 1808    HE   ARG 118           HE       ARG 118  19.730 -18.491  -5.226
 1809   HH11  ARG 118          HH11      ARG 118  20.589 -17.212  -8.368
 1810   HH12  ARG 118          HH12      ARG 118  19.459 -18.209  -9.226
 1811   HH21  ARG 118          HH21      ARG 118  18.260 -19.820  -6.342
 1812   HH22  ARG 118          HH22      ARG 118  18.125 -19.691  -8.067
  Start of MODEL   18
    1    H1   SER   1           H1       SER   1  31.518  -6.798  -6.805
    2    H2   SER   1           H2       SER   1  32.299  -5.559  -5.963
    3    H3   SER   1           H3       SER   1  31.785  -5.308  -7.551
    4    HA   SER   1           HA       SER   1  30.021  -5.802  -5.237
    5    HB2  SER   1           HB3      SER   1  31.144  -3.569  -5.238
    6    HB3  SER   1           HB2      SER   1  30.450  -3.255  -6.826
    7    HG   SER   1           HG       SER   1  29.010  -3.742  -4.419
    8    H    SER   2           H        SER   2  29.002  -7.471  -6.476
    9    HA   SER   2           HA       SER   2  27.028  -6.357  -8.328
   10    HB2  SER   2           HB3      SER   2  28.658  -8.846  -8.913
   11    HB3  SER   2           HB2      SER   2  27.313  -8.252  -9.888
   12    HG   SER   2           HG       SER   2  28.790  -6.195  -9.760
   13    H    THR   3           H        THR   3  26.792  -7.017  -5.626
   14    HA   THR   3           HA       THR   3  25.730  -9.666  -5.316
   15    HB   THR   3           HB       THR   3  24.954  -8.647  -3.063
   16    HG1  THR   3           HG1      THR   3  25.338  -6.439  -4.005
   17   HG21  THR   3          HG21      THR   3  27.896  -8.756  -3.742
   18   HG22  THR   3          HG22      THR   3  26.889 -10.136  -3.306
   19   HG23  THR   3          HG23      THR   3  27.201  -8.864  -2.124
   20    H    HIS   4           H        HIS   4  23.770 -10.295  -5.838
   21    HA   HIS   4           HA       HIS   4  21.549  -8.406  -5.627
   22    HB2  HIS   4           HB3      HIS   4  20.559  -9.421  -7.728
   23    HB3  HIS   4           HB2      HIS   4  21.950  -8.377  -7.975
   24    HD1  HIS   4           HD1      HIS   4  24.186  -9.538  -8.701
   25    HD2  HIS   4           HD2      HIS   4  20.880 -12.057  -8.541
   26    HE1  HIS   4           HE1      HIS   4  24.858 -11.619  -9.942
   27    HE2  HIS   4           HE2      HIS   4  22.915 -13.194  -9.664
   28    HA   PRO   5           HA       PRO   5  20.638 -12.316  -3.427
   29    HB2  PRO   5           HB3      PRO   5  19.537 -11.210  -1.242
   30    HB3  PRO   5           HB2      PRO   5  21.291 -11.256  -1.467
   31    HG2  PRO   5           HG3      PRO   5  19.377  -8.998  -1.931
   32    HG3  PRO   5           HG2      PRO   5  20.976  -8.961  -1.168
   33    HD2  PRO   5           HD3      PRO   5  20.505  -8.236  -3.770
   34    HD3  PRO   5           HD2      PRO   5  22.063  -8.853  -3.187
   35    H    VAL   6           H        VAL   6  19.094 -11.492  -5.562
   36    HA   VAL   6           HA       VAL   6  16.997 -11.434  -6.453
   37    HB   VAL   6           HB       VAL   6  16.117 -12.928  -3.982
   38   HG11  VAL   6          HG11      VAL   6  15.167 -13.025  -6.843
   39   HG12  VAL   6          HG12      VAL   6  14.330 -12.258  -5.494
   40   HG13  VAL   6          HG13      VAL   6  14.547 -14.008  -5.517
   41   HG21  VAL   6          HG21      VAL   6  17.481 -14.053  -6.425
   42   HG22  VAL   6          HG22      VAL   6  16.759 -14.997  -5.123
   43   HG23  VAL   6          HG23      VAL   6  18.156 -13.971  -4.798
   44    H    PHE   7           H        PHE   7  17.511  -9.101  -5.500
   45    HA   PHE   7           HA       PHE   7  16.989  -7.266  -4.269
   46    HB2  PHE   7           HB3      PHE   7  14.527  -6.614  -4.531
   47    HB3  PHE   7           HB2      PHE   7  15.477  -6.839  -5.987
   48    HD1  PHE   7           HD1      PHE   7  12.824  -8.289  -3.884
   49    HD2  PHE   7           HD2      PHE   7  14.943  -8.519  -7.565
   50    HE1  PHE   7           HE1      PHE   7  11.121  -9.825  -4.763
   51    HE2  PHE   7           HE2      PHE   7  13.246 -10.059  -8.450
   52    HZ   PHE   7           HZ       PHE   7  11.331 -10.716  -7.054
   53    H    HIS   8           H        HIS   8  17.443  -9.217  -2.530
   54    HA   HIS   8           HA       HIS   8  17.270  -9.751  -0.345
   55    HB2  HIS   8           HB3      HIS   8  15.689  -7.196  -0.371
   56    HB3  HIS   8           HB2      HIS   8  15.851  -8.142   1.103
   57    HD1  HIS   8           HD1      HIS   8  17.641  -5.751  -1.050
   58    HD2  HIS   8           HD2      HIS   8  18.540  -8.320   2.090
   59    HE1  HIS   8           HE1      HIS   8  19.904  -5.037  -0.220
   60    HE2  HIS   8           HE2      HIS   8  20.500  -6.723   1.552
   61    H    MET   9           H        MET   9  15.325 -10.713  -2.347
   62    HA   MET   9           HA       MET   9  13.350 -11.783  -2.572
   63    HB2  MET   9           HB3      MET   9  13.050 -13.629  -0.854
   64    HB3  MET   9           HB2      MET   9  14.566 -13.596  -1.734
   65    HG2  MET   9           HG3      MET   9  15.582 -12.442   0.243
   66    HG3  MET   9           HG2      MET   9  14.079 -12.746   1.109
   67    HE1  MET   9           HE1      MET   9  17.017 -14.440  -0.882
   68    HE2  MET   9           HE2      MET   9  15.587 -15.224  -1.558
   69    HE3  MET   9           HE3      MET   9  16.715 -16.149  -0.569
   70    H    GLY  10           H        GLY  10  12.770  -9.335  -1.740
   71    HA2  GLY  10           HA3      GLY  10  10.463  -9.801   0.042
   72    HA3  GLY  10           HA2      GLY  10  11.382  -8.301   0.060
   73    H    GLU  11           H        GLU  11   8.869  -7.831  -0.310
   74    HA   GLU  11           HA       GLU  11   7.335  -6.840  -1.649
   75    HB2  GLU  11           HB3      GLU  11   9.620  -6.750  -3.632
   76    HB3  GLU  11           HB2      GLU  11   8.096  -5.882  -3.807
   77    HG2  GLU  11           HG3      GLU  11  10.111  -5.482  -1.595
   78    HG3  GLU  11           HG2      GLU  11   9.892  -4.434  -2.997
   79    H    PHE  12           H        PHE  12   8.362  -9.874  -2.143
   80    HA   PHE  12           HA       PHE  12   7.317 -10.561  -4.662
   81    HB2  PHE  12           HB3      PHE  12   7.852 -12.131  -2.169
   82    HB3  PHE  12           HB2      PHE  12   6.936 -12.870  -3.476
   83    HD1  PHE  12           HD1      PHE  12  10.094 -12.577  -2.122
   84    HD2  PHE  12           HD2      PHE  12   8.090 -12.456  -5.871
   85    HE1  PHE  12           HE1      PHE  12  12.180 -13.204  -3.253
   86    HE2  PHE  12           HE2      PHE  12  10.178 -13.079  -7.012
   87    HZ   PHE  12           HZ       PHE  12  12.226 -13.456  -5.700
   88    H    SER  13           H        SER  13   5.333 -10.808  -5.381
   89    HA   SER  13           HA       SER  13   3.139 -10.925  -3.434
   90    HB2  SER  13           HB3      SER  13   3.125  -9.427  -6.071
   91    HB3  SER  13           HB2      SER  13   1.812  -9.483  -4.902
   92    HG   SER  13           HG       SER  13   4.312  -8.622  -4.007
   93    H    VAL  14           H        VAL  14   2.121 -12.826  -3.623
   94    HA   VAL  14           HA       VAL  14   2.402 -14.647  -5.719
   95    HB   VAL  14           HB       VAL  14   0.384 -15.782  -4.845
   96   HG11  VAL  14          HG11      VAL  14   2.283 -14.820  -2.711
   97   HG12  VAL  14          HG12      VAL  14   2.543 -16.183  -3.798
   98   HG13  VAL  14          HG13      VAL  14   1.248 -16.244  -2.602
   99   HG21  VAL  14          HG21      VAL  14  -0.955 -13.814  -4.284
  100   HG22  VAL  14          HG22      VAL  14   0.165 -13.416  -2.982
  101   HG23  VAL  14          HG23      VAL  14  -0.795 -14.893  -2.899
  102    H    CYS  15           H        CYS  15   0.270 -11.959  -5.319
  103    HA   CYS  15           HA       CYS  15  -0.764 -12.387  -8.033
  104    HB2  CYS  15           HB3      CYS  15  -2.482 -12.041  -6.277
  105    HB3  CYS  15           HB2      CYS  15  -1.737 -10.493  -5.873
  106    H    ASP  16           H        ASP  16   0.576 -11.441  -9.450
  107    HA   ASP  16           HA       ASP  16   2.605  -9.657  -8.769
  108    HB2  ASP  16           HB3      ASP  16   1.342 -10.184 -11.471
  109    HB3  ASP  16           HB2      ASP  16   2.800  -9.224 -11.243
  110    H    SER  17           H        SER  17   2.477  -7.672  -8.096
  111    HA   SER  17           HA       SER  17   0.461  -5.878  -9.266
  112    HB2  SER  17           HB3      SER  17   1.445  -5.932  -6.395
  113    HB3  SER  17           HB2      SER  17   0.306  -4.760  -7.068
  114    HG   SER  17           HG       SER  17  -0.108  -7.577  -6.967
  115    H    VAL  18           H        VAL  18   1.141  -3.778  -9.722
  116    HA   VAL  18           HA       VAL  18   4.044  -3.358  -9.478
  117    HB   VAL  18           HB       VAL  18   3.425  -3.694 -11.797
  118   HG11  VAL  18          HG11      VAL  18   1.933  -2.170 -12.982
  119   HG12  VAL  18          HG12      VAL  18   1.544  -1.375 -11.457
  120   HG13  VAL  18          HG13      VAL  18   1.093  -3.062 -11.713
  121   HG21  VAL  18          HG21      VAL  18   4.284  -1.600 -12.758
  122   HG22  VAL  18          HG22      VAL  18   5.224  -2.149 -11.372
  123   HG23  VAL  18          HG23      VAL  18   4.078  -0.821 -11.190
  124    H    SER  19           H        SER  19   4.600  -1.759  -8.182
  125    HA   SER  19           HA       SER  19   2.622   0.239  -7.420
  126    HB2  SER  19           HB3      SER  19   4.522   0.868  -5.770
  127    HB3  SER  19           HB2      SER  19   3.679  -0.665  -5.528
  128    HG   SER  19           HG       SER  19   5.553  -1.575  -5.704
  129    H    VAL  20           H        VAL  20   2.534   2.106  -8.488
  130    HA   VAL  20           HA       VAL  20   5.006   3.103  -9.754
  131    HB   VAL  20           HB       VAL  20   2.181   3.495 -10.747
  132   HG11  VAL  20          HG11      VAL  20   3.654   5.310 -11.368
  133   HG12  VAL  20          HG12      VAL  20   3.253   4.334 -12.781
  134   HG13  VAL  20          HG13      VAL  20   4.831   4.164 -12.012
  135   HG21  VAL  20          HG21      VAL  20   2.832   1.163 -10.960
  136   HG22  VAL  20          HG22      VAL  20   4.320   1.641 -11.779
  137   HG23  VAL  20          HG23      VAL  20   2.757   1.939 -12.542
  138    H    TRP  21           H        TRP  21   5.520   5.225  -9.459
  139    HA   TRP  21           HA       TRP  21   3.807   6.817  -7.707
  140    HB2  TRP  21           HB3      TRP  21   6.614   7.290  -8.754
  141    HB3  TRP  21           HB2      TRP  21   5.738   8.429  -7.739
  142    HD1  TRP  21           HD1      TRP  21   7.519   5.040  -7.590
  143    HE1  TRP  21           HE1      TRP  21   7.979   4.456  -5.125
  144    HE3  TRP  21           HE3      TRP  21   4.875   8.812  -5.350
  145    HZ2  TRP  21           HZ2      TRP  21   7.306   5.457  -2.574
  146    HZ3  TRP  21           HZ3      TRP  21   4.838   8.923  -2.893
  147    HH2  TRP  21           HH2      TRP  21   6.026   7.282  -1.537
  148    H    VAL  22           H        VAL  22   2.156   7.572  -8.915
  149    HA   VAL  22           HA       VAL  22   2.680   8.497 -11.636
  150    HB   VAL  22           HB       VAL  22   0.037   8.150 -10.216
  151   HG11  VAL  22          HG11      VAL  22  -0.916   8.202 -12.476
  152   HG12  VAL  22          HG12      VAL  22   0.686   8.546 -13.132
  153   HG13  VAL  22          HG13      VAL  22  -0.098   9.709 -12.062
  154   HG21  VAL  22          HG21      VAL  22  -0.179   6.078 -11.509
  155   HG22  VAL  22          HG22      VAL  22   1.185   6.021 -10.394
  156   HG23  VAL  22          HG23      VAL  22   1.463   6.292 -12.115
  157    H    GLY  23           H        GLY  23   3.039  10.570 -11.991
  158    HA2  GLY  23           HA3      GLY  23   1.467  12.535 -10.442
  159    HA3  GLY  23           HA2      GLY  23   3.173  12.808 -10.809
  160    H    ASP  24           H        ASP  24   1.265  11.175 -13.142
  161    HA   ASP  24           HA       ASP  24   1.369  13.573 -14.843
  162    HB2  ASP  24           HB3      ASP  24   1.598  12.081 -16.762
  163    HB3  ASP  24           HB2      ASP  24   2.860  11.745 -15.576
  164    H    LYS  25           H        LYS  25  -0.736  11.195 -13.490
  165    HA   LYS  25           HA       LYS  25  -2.765  11.396 -15.483
  166    HB2  LYS  25           HB3      LYS  25  -4.148  10.094 -14.068
  167    HB3  LYS  25           HB2      LYS  25  -2.520   9.486 -13.829
  168    HG2  LYS  25           HG3      LYS  25  -2.343  10.519 -11.712
  169    HG3  LYS  25           HG2      LYS  25  -3.798  11.484 -11.986
  170    HD2  LYS  25           HD3      LYS  25  -5.126   9.413 -12.058
  171    HD3  LYS  25           HD2      LYS  25  -3.671   8.483 -11.706
  172    HE2  LYS  25           HE3      LYS  25  -4.853  10.615  -9.922
  173    HE3  LYS  25           HE2      LYS  25  -5.056   8.876  -9.697
  174    HZ1  LYS  25           HZ1      LYS  25  -3.309   9.696  -8.291
  175    HZ2  LYS  25           HZ2      LYS  25  -2.491  10.360  -9.610
  176    HZ3  LYS  25           HZ3      LYS  25  -2.645   8.678  -9.472
  177    H    THR  26           H        THR  26  -4.783  12.488 -15.330
  178    HA   THR  26           HA       THR  26  -4.542  14.947 -13.732
  179    HB   THR  26           HB       THR  26  -4.176  15.288 -16.168
  180    HG1  THR  26           HG1      THR  26  -6.428  16.465 -14.895
  181   HG21  THR  26          HG21      THR  26  -7.055  14.400 -16.389
  182   HG22  THR  26          HG22      THR  26  -5.650  13.567 -17.050
  183   HG23  THR  26          HG23      THR  26  -6.117  15.143 -17.685
  184    H    THR  27           H        THR  27  -6.252  12.198 -13.807
  185    HA   THR  27           HA       THR  27  -8.557  13.484 -12.579
  186    HB   THR  27           HB       THR  27  -9.956  11.611 -13.800
  187    HG1  THR  27           HG1      THR  27  -8.827  11.955 -16.129
  188   HG21  THR  27          HG21      THR  27  -9.146  14.211 -15.104
  189   HG22  THR  27          HG22      THR  27 -10.446  13.985 -13.933
  190   HG23  THR  27          HG23      THR  27 -10.565  13.256 -15.535
  191    H    ALA  28           H        ALA  28  -9.616  12.265 -11.044
  192    HA   ALA  28           HA       ALA  28  -8.978   9.461 -10.696
  193    HB1  ALA  28           HB1      ALA  28  -7.125  10.514  -9.500
  194    HB2  ALA  28           HB2      ALA  28  -8.209   9.679  -8.389
  195    HB3  ALA  28           HB3      ALA  28  -8.271  11.436  -8.528
  196    H    THR  29           H        THR  29 -10.211   8.563  -8.799
  197    HA   THR  29           HA       THR  29 -12.864   9.779  -8.791
  198    HB   THR  29           HB       THR  29 -12.104   7.056  -7.738
  199    HG1  THR  29           HG1      THR  29 -12.823   7.896 -10.367
  200   HG21  THR  29          HG21      THR  29 -14.734   8.202  -8.690
  201   HG22  THR  29          HG22      THR  29 -14.277   7.937  -7.008
  202   HG23  THR  29          HG23      THR  29 -14.474   6.561  -8.095
  203    H    ASP  30           H        ASP  30 -13.507  10.913  -7.146
  204    HA   ASP  30           HA       ASP  30 -12.056  11.239  -4.732
  205    HB2  ASP  30           HB3      ASP  30 -13.482  12.998  -5.744
  206    HB3  ASP  30           HB2      ASP  30 -14.910  12.013  -5.427
  207    H    ILE  31           H        ILE  31 -13.059  10.896  -2.539
  208    HA   ILE  31           HA       ILE  31 -13.667   8.185  -2.122
  209    HB   ILE  31           HB       ILE  31 -12.629   9.556  -0.384
  210   HG12  ILE  31          HG13      ILE  31 -15.340   8.548   0.512
  211   HG13  ILE  31          HG12      ILE  31 -13.913   7.542   0.280
  212   HG21  ILE  31          HG21      ILE  31 -13.780  11.657  -0.810
  213   HG22  ILE  31          HG22      ILE  31 -13.906  11.202   0.889
  214   HG23  ILE  31          HG23      ILE  31 -15.282  10.974  -0.190
  215   HD11  ILE  31          HD11      ILE  31 -14.200   9.771   2.279
  216   HD12  ILE  31          HD12      ILE  31 -12.766   8.773   2.049
  217   HD13  ILE  31          HD13      ILE  31 -14.265   8.042   2.624
  218    H    LYS  32           H        LYS  32 -15.687  10.958  -2.715
  219    HA   LYS  32           HA       LYS  32 -18.135   9.707  -1.857
  220    HB2  LYS  32           HB3      LYS  32 -17.667  12.173  -3.539
  221    HB3  LYS  32           HB2      LYS  32 -19.200  11.705  -2.813
  222    HG2  LYS  32           HG3      LYS  32 -18.329  12.047  -0.609
  223    HG3  LYS  32           HG2      LYS  32 -16.704  12.297  -1.242
  224    HD2  LYS  32           HD3      LYS  32 -17.505  14.287  -2.434
  225    HD3  LYS  32           HD2      LYS  32 -19.100  14.061  -1.714
  226    HE2  LYS  32           HE3      LYS  32 -18.156  14.341   0.505
  227    HE3  LYS  32           HE2      LYS  32 -16.540  14.475  -0.182
  228    HZ1  LYS  32           HZ1      LYS  32 -17.480  16.638   0.366
  229    HZ2  LYS  32           HZ2      LYS  32 -18.775  16.365  -0.682
  230    HZ3  LYS  32           HZ3      LYS  32 -17.205  16.499  -1.294
  231    H    GLY  33           H        GLY  33 -16.173   9.375  -4.546
  232    HA2  GLY  33           HA3      GLY  33 -16.619   7.761  -6.228
  233    HA3  GLY  33           HA2      GLY  33 -18.343   8.017  -5.981
  234    H    LYS  34           H        LYS  34 -16.606  10.901  -6.099
  235    HA   LYS  34           HA       LYS  34 -17.727  11.562  -8.683
  236    HB2  LYS  34           HB3      LYS  34 -16.050  13.181  -6.762
  237    HB3  LYS  34           HB2      LYS  34 -16.788  13.811  -8.224
  238    HG2  LYS  34           HG3      LYS  34 -18.291  12.664  -5.887
  239    HG3  LYS  34           HG2      LYS  34 -18.034  14.375  -6.190
  240    HD2  LYS  34           HD3      LYS  34 -19.177  14.071  -8.392
  241    HD3  LYS  34           HD2      LYS  34 -19.593  12.435  -7.877
  242    HE2  LYS  34           HE3      LYS  34 -21.459  13.872  -7.415
  243    HE3  LYS  34           HE2      LYS  34 -20.713  13.410  -5.891
  244    HZ1  LYS  34           HZ1      LYS  34 -21.251  15.753  -5.912
  245    HZ2  LYS  34           HZ2      LYS  34 -20.316  15.992  -7.295
  246    HZ3  LYS  34           HZ3      LYS  34 -19.575  15.545  -5.842
  247    H    GLU  35           H        GLU  35 -16.439  12.482 -10.390
  248    HA   GLU  35           HA       GLU  35 -13.686  11.462 -10.444
  249    HB2  GLU  35           HB3      GLU  35 -15.102  10.621 -12.253
  250    HB3  GLU  35           HB2      GLU  35 -15.520  12.266 -12.708
  251    HG2  GLU  35           HG3      GLU  35 -13.296  12.715 -13.427
  252    HG3  GLU  35           HG2      GLU  35 -12.719  11.186 -12.768
  253    H    VAL  36           H        VAL  36 -12.182  12.928 -10.054
  254    HA   VAL  36           HA       VAL  36 -12.821  15.737 -10.653
  255    HB   VAL  36           HB       VAL  36 -11.391  16.355  -8.704
  256   HG11  VAL  36          HG11      VAL  36 -13.795  14.639  -8.104
  257   HG12  VAL  36          HG12      VAL  36 -13.806  16.360  -8.495
  258   HG13  VAL  36          HG13      VAL  36 -13.067  15.801  -6.994
  259   HG21  VAL  36          HG21      VAL  36 -11.564  13.413  -8.066
  260   HG22  VAL  36          HG22      VAL  36 -10.900  14.665  -7.016
  261   HG23  VAL  36          HG23      VAL  36 -10.104  14.281  -8.543
  262    H    THR  37           H        THR  37 -11.123  17.109 -11.218
  263    HA   THR  37           HA       THR  37  -9.030  15.837 -12.739
  264    HB   THR  37           HB       THR  37  -9.582  18.774 -12.292
  265    HG1  THR  37           HG1      THR  37 -11.102  17.071 -13.497
  266   HG21  THR  37          HG21      THR  37  -7.315  18.320 -13.103
  267   HG22  THR  37          HG22      THR  37  -8.292  19.102 -14.345
  268   HG23  THR  37          HG23      THR  37  -7.979  17.369 -14.431
  269    H    VAL  38           H        VAL  38  -7.266  15.180 -11.730
  270    HA   VAL  38           HA       VAL  38  -6.551  16.308  -9.167
  271    HB   VAL  38           HB       VAL  38  -5.350  13.979 -10.669
  272   HG11  VAL  38          HG11      VAL  38  -3.756  14.969  -9.114
  273   HG12  VAL  38          HG12      VAL  38  -4.307  13.396  -8.536
  274   HG13  VAL  38          HG13      VAL  38  -4.950  14.873  -7.818
  275   HG21  VAL  38          HG21      VAL  38  -7.295  14.055  -8.371
  276   HG22  VAL  38          HG22      VAL  38  -6.563  12.602  -9.051
  277   HG23  VAL  38          HG23      VAL  38  -7.658  13.580 -10.029
  278    H    LEU  39           H        LEU  39  -5.051  17.775  -8.879
  279    HA   LEU  39           HA       LEU  39  -3.189  18.368 -11.057
  280    HB2  LEU  39           HB3      LEU  39  -3.679  19.937  -8.519
  281    HB3  LEU  39           HB2      LEU  39  -2.824  20.480  -9.950
  282    HG   LEU  39           HG       LEU  39  -5.779  19.885  -9.821
  283   HD11  LEU  39          HD11      LEU  39  -5.217  21.853  -8.522
  284   HD12  LEU  39          HD12      LEU  39  -6.056  22.310 -10.004
  285   HD13  LEU  39          HD13      LEU  39  -4.306  22.512  -9.879
  286   HD21  LEU  39          HD21      LEU  39  -4.101  21.093 -12.012
  287   HD22  LEU  39          HD22      LEU  39  -5.859  20.941 -12.022
  288   HD23  LEU  39          HD23      LEU  39  -4.848  19.495 -12.034
  289    H    ALA  40           H        ALA  40  -1.285  17.382 -10.925
  290    HA   ALA  40           HA       ALA  40  -0.355  16.089  -8.566
  291    HB1  ALA  40           HB1      ALA  40   1.644  15.581  -9.864
  292    HB2  ALA  40           HB2      ALA  40   1.141  16.729 -11.105
  293    HB3  ALA  40           HB3      ALA  40   0.189  15.273 -10.813
  294    H    GLU  41           H        GLU  41  -0.119  19.236  -9.812
  295    HA   GLU  41           HA       GLU  41   2.048  19.931  -7.957
  296    HB2  GLU  41           HB3      GLU  41   0.852  21.594 -10.183
  297    HB3  GLU  41           HB2      GLU  41   2.268  21.994  -9.228
  298    HG2  GLU  41           HG3      GLU  41   3.371  19.966 -10.166
  299    HG3  GLU  41           HG2      GLU  41   1.990  19.783 -11.242
  300    H    VAL  42           H        VAL  42   1.362  20.653  -6.050
  301    HA   VAL  42           HA       VAL  42  -1.301  21.843  -5.857
  302    HB   VAL  42           HB       VAL  42  -1.148  21.540  -3.457
  303   HG11  VAL  42          HG11      VAL  42  -1.904  19.649  -4.761
  304   HG12  VAL  42          HG12      VAL  42  -0.996  19.099  -3.354
  305   HG13  VAL  42          HG13      VAL  42  -0.243  19.086  -4.949
  306   HG21  VAL  42          HG21      VAL  42   0.774  20.493  -2.387
  307   HG22  VAL  42          HG22      VAL  42   1.226  22.019  -3.146
  308   HG23  VAL  42          HG23      VAL  42   1.641  20.491  -3.922
  309    H    ASN  43           H        ASN  43  -1.651  23.908  -5.213
  310    HA   ASN  43           HA       ASN  43   0.729  25.632  -5.211
  311    HB2  ASN  43           HB3      ASN  43  -2.136  26.409  -5.826
  312    HB3  ASN  43           HB2      ASN  43  -0.704  27.409  -6.041
  313   HD21  ASN  43          HD21      ASN  43  -2.647  24.871  -7.345
  314   HD22  ASN  43          HD22      ASN  43  -1.822  24.732  -8.856
  315    H    ILE  44           H        ILE  44   1.264  25.843  -3.089
  316    HA   ILE  44           HA       ILE  44  -0.871  26.766  -1.269
  317    HB   ILE  44           HB       ILE  44   1.773  25.485  -0.532
  318   HG12  ILE  44          HG13      ILE  44  -1.030  24.348  -0.344
  319   HG13  ILE  44          HG12      ILE  44   0.146  23.915  -1.584
  320   HG21  ILE  44          HG21      ILE  44   0.984  27.087   1.136
  321   HG22  ILE  44          HG22      ILE  44   0.877  25.435   1.742
  322   HG23  ILE  44          HG23      ILE  44  -0.577  26.266   1.193
  323   HD11  ILE  44          HD11      ILE  44   0.435  23.449   1.378
  324   HD12  ILE  44          HD12      ILE  44   1.632  23.032   0.152
  325   HD13  ILE  44          HD13      ILE  44   0.061  22.232   0.157
  326    H    ASN  45           H        ASN  45  -0.817  28.928  -1.449
  327    HA   ASN  45           HA       ASN  45  -0.118  31.085  -1.294
  328    HB2  ASN  45           HB3      ASN  45   2.149  29.926   0.350
  329    HB3  ASN  45           HB2      ASN  45   1.670  31.617   0.307
  330   HD21  ASN  45          HD21      ASN  45  -1.208  30.937   0.274
  331   HD22  ASN  45          HD22      ASN  45  -1.580  30.424   1.886
  332    H    ASN  46           H        ASN  46   0.494  29.963  -3.633
  333    HA   ASN  46           HA       ASN  46   1.720  30.289  -5.510
  334    HB2  ASN  46           HB3      ASN  46   3.248  32.288  -3.829
  335    HB3  ASN  46           HB2      ASN  46   3.420  32.094  -5.570
  336   HD21  ASN  46          HD21      ASN  46   1.753  32.754  -6.929
  337   HD22  ASN  46          HD22      ASN  46   0.511  33.829  -6.388
  338    H    SER  47           H        SER  47   2.672  28.558  -3.075
  339    HA   SER  47           HA       SER  47   5.319  27.971  -4.210
  340    HB2  SER  47           HB3      SER  47   5.194  28.543  -1.742
  341    HB3  SER  47           HB2      SER  47   4.256  27.068  -1.519
  342    HG   SER  47           HG       SER  47   6.457  26.484  -2.924
  343    H    VAL  48           H        VAL  48   5.348  26.299  -5.523
  344    HA   VAL  48           HA       VAL  48   3.072  24.473  -5.515
  345    HB   VAL  48           HB       VAL  48   5.210  24.892  -7.605
  346   HG11  VAL  48          HG11      VAL  48   4.314  22.642  -7.695
  347   HG12  VAL  48          HG12      VAL  48   3.748  23.588  -9.072
  348   HG13  VAL  48          HG13      VAL  48   2.670  23.280  -7.708
  349   HG21  VAL  48          HG21      VAL  48   2.343  25.817  -7.522
  350   HG22  VAL  48          HG22      VAL  48   3.449  26.016  -8.879
  351   HG23  VAL  48          HG23      VAL  48   3.771  26.840  -7.353
  352    H    PHE  49           H        PHE  49   3.220  22.442  -4.896
  353    HA   PHE  49           HA       PHE  49   5.868  21.156  -4.840
  354    HB2  PHE  49           HB3      PHE  49   3.684  21.023  -2.756
  355    HB3  PHE  49           HB2      PHE  49   4.940  19.794  -2.873
  356    HD1  PHE  49           HD1      PHE  49   4.116  23.150  -1.787
  357    HD2  PHE  49           HD2      PHE  49   7.295  20.401  -2.468
  358    HE1  PHE  49           HE1      PHE  49   5.607  24.531  -0.397
  359    HE2  PHE  49           HE2      PHE  49   8.787  21.779  -1.079
  360    HZ   PHE  49           HZ       PHE  49   7.943  23.846  -0.043
  361    H    ARG  50           H        ARG  50   5.946  19.063  -5.579
  362    HA   ARG  50           HA       ARG  50   3.502  18.137  -6.910
  363    HB2  ARG  50           HB3      ARG  50   6.417  17.504  -7.398
  364    HB3  ARG  50           HB2      ARG  50   5.099  16.660  -8.201
  365    HG2  ARG  50           HG3      ARG  50   4.320  18.808  -9.104
  366    HG3  ARG  50           HG2      ARG  50   5.715  19.598  -8.376
  367    HD2  ARG  50           HD3      ARG  50   7.215  18.288  -9.748
  368    HD3  ARG  50           HD2      ARG  50   5.857  17.376 -10.410
  369    HE   ARG  50           HE       ARG  50   5.426  20.114 -10.876
  370   HH11  ARG  50          HH11      ARG  50   7.546  17.537 -11.945
  371   HH12  ARG  50          HH12      ARG  50   7.794  18.228 -13.513
  372   HH21  ARG  50          HH21      ARG  50   5.749  21.020 -12.913
  373   HH22  ARG  50          HH22      ARG  50   6.775  20.222 -14.067
  374    H    GLN  51           H        GLN  51   2.477  16.379  -6.274
  375    HA   GLN  51           HA       GLN  51   3.873  14.587  -4.404
  376    HB2  GLN  51           HB3      GLN  51   1.506  14.024  -3.585
  377    HB3  GLN  51           HB2      GLN  51   2.204  15.557  -3.091
  378    HG2  GLN  51           HG3      GLN  51   0.899  16.712  -4.799
  379    HG3  GLN  51           HG2      GLN  51   0.209  15.171  -5.316
  380   HE21  GLN  51          HE21      GLN  51  -1.330  14.175  -4.045
  381   HE22  GLN  51          HE22      GLN  51  -2.133  14.983  -2.741
  382    H    TYR  52           H        TYR  52   4.552  13.002  -5.681
  383    HA   TYR  52           HA       TYR  52   2.973  11.901  -7.802
  384    HB2  TYR  52           HB3      TYR  52   5.350  10.587  -6.462
  385    HB3  TYR  52           HB2      TYR  52   4.757  10.323  -8.097
  386    HD1  TYR  52           HD1      TYR  52   4.707  12.583  -9.567
  387    HD2  TYR  52           HD2      TYR  52   7.236  11.872  -6.220
  388    HE1  TYR  52           HE1      TYR  52   6.273  14.284 -10.396
  389    HE2  TYR  52           HE2      TYR  52   8.810  13.572  -7.042
  390    HH   TYR  52           HH       TYR  52   9.416  14.652  -9.147
  391    H    PHE  53           H        PHE  53   1.540  10.273  -7.699
  392    HA   PHE  53           HA       PHE  53   0.789   9.419  -5.029
  393    HB2  PHE  53           HB3      PHE  53  -0.581   8.962  -7.691
  394    HB3  PHE  53           HB2      PHE  53  -1.263   8.598  -6.106
  395    HD1  PHE  53           HD1      PHE  53  -1.735  10.461  -4.529
  396    HD2  PHE  53           HD2      PHE  53  -0.675  11.134  -8.589
  397    HE1  PHE  53           HE1      PHE  53  -2.619  12.749  -4.373
  398    HE2  PHE  53           HE2      PHE  53  -1.555  13.426  -8.445
  399    HZ   PHE  53           HZ       PHE  53  -2.526  14.236  -6.336
  400    H    PHE  54           H        PHE  54   1.150   7.487  -4.214
  401    HA   PHE  54           HA       PHE  54   2.588   5.514  -5.765
  402    HB2  PHE  54           HB3      PHE  54   3.198   6.031  -3.404
  403    HB3  PHE  54           HB2      PHE  54   1.622   5.447  -2.886
  404    HD1  PHE  54           HD1      PHE  54   1.216   3.133  -2.572
  405    HD2  PHE  54           HD2      PHE  54   4.846   4.447  -4.368
  406    HE1  PHE  54           HE1      PHE  54   2.155   0.875  -2.315
  407    HE2  PHE  54           HE2      PHE  54   5.791   2.190  -4.115
  408    HZ   PHE  54           HZ       PHE  54   4.445   0.401  -3.087
  409    H    GLU  55           H        GLU  55   1.219   4.645  -7.228
  410    HA   GLU  55           HA       GLU  55  -1.299   3.491  -6.217
  411    HB2  GLU  55           HB3      GLU  55  -0.674   4.382  -9.047
  412    HB3  GLU  55           HB2      GLU  55  -2.224   3.795  -8.451
  413    HG2  GLU  55           HG3      GLU  55  -2.358   5.751  -6.953
  414    HG3  GLU  55           HG2      GLU  55  -0.836   6.342  -7.620
  415    H    THR  56           H        THR  56  -1.350   1.370  -6.172
  416    HA   THR  56           HA       THR  56   0.610  -0.118  -7.752
  417    HB   THR  56           HB       THR  56  -1.173  -1.130  -5.526
  418    HG1  THR  56           HG1      THR  56   0.395  -0.587  -4.163
  419   HG21  THR  56          HG21      THR  56   1.260  -2.326  -6.860
  420   HG22  THR  56          HG22      THR  56  -0.403  -2.890  -7.025
  421   HG23  THR  56          HG23      THR  56   0.420  -3.007  -5.468
  422    H    LYS  57           H        LYS  57   0.014  -1.087  -9.551
  423    HA   LYS  57           HA       LYS  57  -2.852  -1.481 -10.054
  424    HB2  LYS  57           HB3      LYS  57  -0.514  -1.357 -11.969
  425    HB3  LYS  57           HB2      LYS  57  -2.178  -1.665 -12.444
  426    HG2  LYS  57           HG3      LYS  57  -2.817   0.541 -11.575
  427    HG3  LYS  57           HG2      LYS  57  -1.132   0.851 -11.158
  428    HD2  LYS  57           HD3      LYS  57  -1.625   1.907 -13.262
  429    HD3  LYS  57           HD2      LYS  57  -0.542   0.546 -13.545
  430    HE2  LYS  57           HE3      LYS  57  -2.497  -0.821 -14.172
  431    HE3  LYS  57           HE2      LYS  57  -3.522   0.595 -13.972
  432    HZ1  LYS  57           HZ1      LYS  57  -2.299   1.700 -15.719
  433    HZ2  LYS  57           HZ2      LYS  57  -2.919   0.232 -16.286
  434    HZ3  LYS  57           HZ3      LYS  57  -1.279   0.363 -15.897
  435    H    CYS  58           H        CYS  58  -3.575  -3.425 -10.986
  436    HA   CYS  58           HA       CYS  58  -2.136  -5.715  -9.937
  437    HB2  CYS  58           HB3      CYS  58  -4.690  -5.237  -9.761
  438    HB3  CYS  58           HB2      CYS  58  -4.753  -5.854 -11.406
  439    H    ARG  59           H        ARG  59  -0.566  -6.479 -11.185
  440    HA   ARG  59           HA       ARG  59  -0.473  -6.146 -14.018
  441    HB2  ARG  59           HB3      ARG  59   1.174  -7.870 -12.160
  442    HB3  ARG  59           HB2      ARG  59   1.526  -7.646 -13.863
  443    HG2  ARG  59           HG3      ARG  59   1.965  -5.306 -13.507
  444    HG3  ARG  59           HG2      ARG  59   1.470  -5.437 -11.821
  445    HD2  ARG  59           HD3      ARG  59   3.917  -5.454 -12.073
  446    HD3  ARG  59           HD2      ARG  59   3.307  -6.943 -11.364
  447    HE   ARG  59           HE       ARG  59   3.649  -7.051 -14.226
  448   HH11  ARG  59          HH11      ARG  59   5.204  -7.473 -11.117
  449   HH12  ARG  59          HH12      ARG  59   6.412  -8.557 -11.724
  450   HH21  ARG  59          HH21      ARG  59   5.259  -8.474 -15.031
  451   HH22  ARG  59          HH22      ARG  59   6.445  -9.124 -13.944
  452    H    ALA  60           H        ALA  60  -0.979  -8.933 -11.884
  453    HA   ALA  60           HA       ALA  60  -2.361 -10.306 -14.071
  454    HB1  ALA  60           HB1      ALA  60  -0.037 -11.114 -14.108
  455    HB2  ALA  60           HB2      ALA  60  -1.166 -12.387 -13.648
  456    HB3  ALA  60           HB3      ALA  60  -0.185 -11.592 -12.417
  457    H    SER  61           H        SER  61  -4.335 -10.571 -13.264
  458    HA   SER  61           HA       SER  61  -4.748 -10.877 -10.422
  459    HB2  SER  61           HB3      SER  61  -6.720 -10.833 -12.715
  460    HB3  SER  61           HB2      SER  61  -7.146 -10.807 -11.003
  461    HG   SER  61           HG       SER  61  -5.497  -8.881 -11.155
  462    H    ASN  62           H        ASN  62  -4.468 -12.914 -13.166
  463    HA   ASN  62           HA       ASN  62  -4.879 -15.226 -11.441
  464    HB2  ASN  62           HB3      ASN  62  -6.288 -14.877 -14.101
  465    HB3  ASN  62           HB2      ASN  62  -6.145 -16.417 -13.263
  466   HD21  ASN  62          HD21      ASN  62  -7.292 -16.723 -11.321
  467   HD22  ASN  62          HD22      ASN  62  -8.631 -15.725 -10.896
  468    HA   PRO  63           HA       PRO  63  -0.960 -15.261 -14.070
  469    HB2  PRO  63           HB3      PRO  63   0.303 -16.677 -11.980
  470    HB3  PRO  63           HB2      PRO  63   0.525 -14.969 -12.380
  471    HG2  PRO  63           HG3      PRO  63  -1.169 -16.227 -10.290
  472    HG3  PRO  63           HG2      PRO  63  -0.341 -14.661 -10.278
  473    HD2  PRO  63           HD3      PRO  63  -3.013 -14.848 -10.611
  474    HD3  PRO  63           HD2      PRO  63  -2.052 -13.602 -11.448
  475    H    VAL  64           H        VAL  64  -2.538 -17.708 -12.036
  476    HA   VAL  64           HA       VAL  64  -2.089 -19.623 -14.230
  477    HB   VAL  64           HB       VAL  64  -2.175 -21.467 -12.578
  478   HG11  VAL  64          HG11      VAL  64   0.073 -21.188 -11.696
  479   HG12  VAL  64          HG12      VAL  64   0.008 -19.463 -12.054
  480   HG13  VAL  64          HG13      VAL  64  -0.026 -20.638 -13.368
  481   HG21  VAL  64          HG21      VAL  64  -2.021 -19.265 -10.530
  482   HG22  VAL  64          HG22      VAL  64  -1.862 -20.989 -10.200
  483   HG23  VAL  64          HG23      VAL  64  -3.390 -20.343 -10.797
  484    H    GLU  65           H        GLU  65  -3.790 -21.553 -13.866
  485    HA   GLU  65           HA       GLU  65  -6.288 -20.423 -14.466
  486    HB2  GLU  65           HB3      GLU  65  -5.584 -22.628 -15.269
  487    HB3  GLU  65           HB2      GLU  65  -5.633 -23.252 -13.626
  488    HG2  GLU  65           HG3      GLU  65  -8.048 -22.791 -13.552
  489    HG3  GLU  65           HG2      GLU  65  -7.971 -22.248 -15.228
  490    H    SER  66           H        SER  66  -5.160 -22.041 -11.504
  491    HA   SER  66           HA       SER  66  -7.658 -21.796 -10.158
  492    HB2  SER  66           HB3      SER  66  -6.232 -22.388  -8.118
  493    HB3  SER  66           HB2      SER  66  -6.246 -23.561  -9.437
  494    HG   SER  66           HG       SER  66  -4.203 -23.161  -9.839
  495    H    GLY  67           H        GLY  67  -5.252 -19.561 -10.854
  496    HA2  GLY  67           HA3      GLY  67  -5.910 -17.232 -10.250
  497    HA3  GLY  67           HA2      GLY  67  -6.087 -17.838  -8.604
  498    H    CYS  68           H        CYS  68  -4.308 -18.108  -7.331
  499    HA   CYS  68           HA       CYS  68  -1.848 -16.903  -8.382
  500    HB2  CYS  68           HB3      CYS  68  -2.787 -17.370  -5.534
  501    HB3  CYS  68           HB2      CYS  68  -1.234 -16.648  -5.969
  502    H    ARG  69           H        ARG  69   0.080 -17.979  -8.428
  503    HA   ARG  69           HA       ARG  69  -0.041 -20.818  -8.567
  504    HB2  ARG  69           HB3      ARG  69   1.530 -19.001  -9.748
  505    HB3  ARG  69           HB2      ARG  69   2.584 -19.397  -8.401
  506    HG2  ARG  69           HG3      ARG  69   1.570 -21.284 -10.520
  507    HG3  ARG  69           HG2      ARG  69   3.210 -20.681 -10.320
  508    HD2  ARG  69           HD3      ARG  69   3.399 -22.772  -9.393
  509    HD3  ARG  69           HD2      ARG  69   3.020 -21.804  -7.966
  510    HE   ARG  69           HE       ARG  69   0.630 -22.781  -9.113
  511   HH11  ARG  69          HH11      ARG  69   3.433 -23.930  -7.352
  512   HH12  ARG  69          HH12      ARG  69   2.580 -25.245  -6.608
  513   HH21  ARG  69          HH21      ARG  69  -0.491 -24.503  -8.111
  514   HH22  ARG  69          HH22      ARG  69   0.359 -25.566  -7.033
  515    H    GLY  70           H        GLY  70  -0.312 -21.925  -6.726
  516    HA2  GLY  70           HA3      GLY  70   1.397 -22.838  -5.021
  517    HA3  GLY  70           HA2      GLY  70   1.320 -21.198  -4.389
  518    H    ILE  71           H        ILE  71  -1.494 -20.899  -4.997
  519    HA   ILE  71           HA       ILE  71  -2.579 -21.743  -2.544
  520    HB   ILE  71           HB       ILE  71  -3.987 -20.811  -5.051
  521   HG12  ILE  71          HG13      ILE  71  -2.416 -19.148  -4.238
  522   HG13  ILE  71          HG12      ILE  71  -4.059 -18.619  -3.897
  523   HG21  ILE  71          HG21      ILE  71  -5.863 -20.240  -3.586
  524   HG22  ILE  71          HG22      ILE  71  -5.016 -20.972  -2.224
  525   HG23  ILE  71          HG23      ILE  71  -5.530 -21.974  -3.583
  526   HD11  ILE  71          HD11      ILE  71  -2.098 -19.798  -1.942
  527   HD12  ILE  71          HD12      ILE  71  -3.777 -19.414  -1.570
  528   HD13  ILE  71          HD13      ILE  71  -2.657 -18.127  -2.017
  529    H    ASP  72           H        ASP  72  -3.874 -23.422  -1.986
  530    HA   ASP  72           HA       ASP  72  -3.800 -25.811  -3.518
  531    HB2  ASP  72           HB3      ASP  72  -3.906 -25.699  -1.009
  532    HB3  ASP  72           HB2      ASP  72  -5.583 -25.180  -1.152
  533    H    SER  73           H        SER  73  -4.933 -26.042  -5.323
  534    HA   SER  73           HA       SER  73  -7.153 -24.351  -5.927
  535    HB2  SER  73           HB3      SER  73  -7.121 -25.793  -8.073
  536    HB3  SER  73           HB2      SER  73  -5.708 -24.788  -7.731
  537    HG   SER  73           HG       SER  73  -4.999 -26.838  -8.261
  538    H    LYS  74           H        LYS  74  -6.945 -27.337  -4.365
  539    HA   LYS  74           HA       LYS  74  -9.493 -28.307  -5.372
  540    HB2  LYS  74           HB3      LYS  74  -7.640 -29.887  -4.984
  541    HB3  LYS  74           HB2      LYS  74  -7.646 -29.466  -3.281
  542    HG2  LYS  74           HG3      LYS  74  -9.757 -30.472  -2.943
  543    HG3  LYS  74           HG2      LYS  74 -10.031 -30.642  -4.679
  544    HD2  LYS  74           HD3      LYS  74  -9.389 -32.772  -3.671
  545    HD3  LYS  74           HD2      LYS  74  -8.177 -32.215  -4.821
  546    HE2  LYS  74           HE3      LYS  74  -6.815 -31.373  -2.985
  547    HE3  LYS  74           HE2      LYS  74  -8.025 -31.923  -1.828
  548    HZ1  LYS  74           HZ1      LYS  74  -6.233 -33.503  -1.986
  549    HZ2  LYS  74           HZ2      LYS  74  -6.437 -33.638  -3.657
  550    HZ3  LYS  74           HZ3      LYS  74  -7.643 -34.195  -2.612
  551    H    HIS  75           H        HIS  75  -8.127 -26.867  -2.487
  552    HA   HIS  75           HA       HIS  75 -10.708 -27.088  -1.118
  553    HB2  HIS  75           HB3      HIS  75  -7.994 -26.195  -0.117
  554    HB3  HIS  75           HB2      HIS  75  -9.452 -26.234   0.868
  555    HD1  HIS  75           HD1      HIS  75  -6.905 -28.462  -0.740
  556    HD2  HIS  75           HD2      HIS  75 -10.231 -28.778   1.739
  557    HE1  HIS  75           HE1      HIS  75  -6.856 -30.812   0.173
  558    HE2  HIS  75           HE2      HIS  75  -8.815 -30.938   1.757
  559    H    TRP  76           H        TRP  76  -8.601 -24.743  -2.621
  560    HA   TRP  76           HA       TRP  76 -10.477 -22.619  -1.824
  561    HB2  TRP  76           HB3      TRP  76  -7.458 -22.477  -1.930
  562    HB3  TRP  76           HB2      TRP  76  -8.498 -21.059  -1.810
  563    HD1  TRP  76           HD1      TRP  76  -6.811 -23.661   0.258
  564    HE1  TRP  76           HE1      TRP  76  -7.426 -23.343   2.736
  565    HE3  TRP  76           HE3      TRP  76 -10.651 -20.323  -0.272
  566    HZ2  TRP  76           HZ2      TRP  76  -9.282 -21.872   4.263
  567    HZ3  TRP  76           HZ3      TRP  76 -11.792 -19.509   1.750
  568    HH2  TRP  76           HH2      TRP  76 -11.120 -20.271   3.971
  569    H    ASN  77           H        ASN  77 -10.694 -20.890  -3.245
  570    HA   ASN  77           HA       ASN  77  -9.469 -21.190  -5.914
  571    HB2  ASN  77           HB3      ASN  77 -11.946 -21.474  -5.968
  572    HB3  ASN  77           HB2      ASN  77 -12.126 -19.894  -5.225
  573   HD21  ASN  77          HD21      ASN  77  -9.791 -20.771  -7.706
  574   HD22  ASN  77          HD22      ASN  77 -10.445 -19.745  -8.934
  575    H    SER  78           H        SER  78  -8.353 -19.392  -6.654
  576    HA   SER  78           HA       SER  78  -8.351 -17.097  -4.818
  577    HB2  SER  78           HB3      SER  78  -5.893 -16.857  -5.501
  578    HB3  SER  78           HB2      SER  78  -6.296 -18.195  -4.428
  579    HG   SER  78           HG       SER  78  -6.531 -18.939  -7.019
  580    H    TYR  79           H        TYR  79  -8.501 -15.117  -5.645
  581    HA   TYR  79           HA       TYR  79  -7.681 -14.568  -8.349
  582    HB2  TYR  79           HB3      TYR  79  -9.820 -13.525  -9.035
  583    HB3  TYR  79           HB2      TYR  79  -9.984 -15.259  -8.776
  584    HD1  TYR  79           HD1      TYR  79 -10.999 -11.940  -7.651
  585    HD2  TYR  79           HD2      TYR  79 -11.247 -16.113  -6.861
  586    HE1  TYR  79           HE1      TYR  79 -12.930 -11.540  -6.177
  587    HE2  TYR  79           HE2      TYR  79 -13.168 -15.723  -5.382
  588    HH   TYR  79           HH       TYR  79 -14.892 -12.848  -5.322
  589    H    CYS  80           H        CYS  80  -7.805 -12.165  -8.762
  590    HA   CYS  80           HA       CYS  80  -6.891 -10.952  -6.259
  591    HB2  CYS  80           HB3      CYS  80  -6.240 -10.286  -9.131
  592    HB3  CYS  80           HB2      CYS  80  -5.595  -9.432  -7.726
  593    H    THR  81           H        THR  81  -7.527  -9.025  -5.543
  594    HA   THR  81           HA       THR  81  -9.117  -7.275  -7.253
  595    HB   THR  81           HB       THR  81 -10.864  -8.486  -6.083
  596    HG1  THR  81           HG1      THR  81 -10.922  -6.249  -4.468
  597   HG21  THR  81          HG21      THR  81  -9.430  -7.742  -3.534
  598   HG22  THR  81          HG22      THR  81  -9.576  -9.362  -4.215
  599   HG23  THR  81          HG23      THR  81 -11.009  -8.518  -3.631
  600    H    THR  82           H        THR  82  -8.809  -5.081  -6.740
  601    HA   THR  82           HA       THR  82  -6.393  -4.664  -5.203
  602    HB   THR  82           HB       THR  82  -6.613  -2.284  -6.072
  603    HG1  THR  82           HG1      THR  82  -8.380  -1.801  -7.084
  604   HG21  THR  82          HG21      THR  82  -5.111  -3.910  -7.092
  605   HG22  THR  82          HG22      THR  82  -5.850  -2.885  -8.324
  606   HG23  THR  82          HG23      THR  82  -6.435  -4.532  -8.078
  607    H    THR  83           H        THR  83  -6.230  -3.725  -3.281
  608    HA   THR  83           HA       THR  83  -8.658  -2.679  -2.034
  609    HB   THR  83           HB       THR  83  -7.330  -4.285  -0.711
  610    HG1  THR  83           HG1      THR  83  -8.159  -3.147   0.851
  611   HG21  THR  83          HG21      THR  83  -5.149  -3.557   0.234
  612   HG22  THR  83          HG22      THR  83  -5.159  -2.200  -0.893
  613   HG23  THR  83          HG23      THR  83  -5.102  -3.856  -1.502
  614    H    HIS  84           H        HIS  84  -8.632  -0.530  -1.067
  615    HA   HIS  84           HA       HIS  84  -6.790   1.250  -2.501
  616    HB2  HIS  84           HB3      HIS  84  -8.731   2.682  -3.164
  617    HB3  HIS  84           HB2      HIS  84  -8.722   1.101  -3.940
  618    HD1  HIS  84           HD1      HIS  84 -10.725   3.260  -1.698
  619    HD2  HIS  84           HD2      HIS  84 -10.742  -0.684  -2.998
  620    HE1  HIS  84           HE1      HIS  84 -12.994   2.363  -1.097
  621    HE2  HIS  84           HE2      HIS  84 -12.905  -0.073  -1.722
  622    H    THR  85           H        THR  85  -6.508   3.295  -1.664
  623    HA   THR  85           HA       THR  85  -7.773   3.831   0.942
  624    HB   THR  85           HB       THR  85  -5.363   3.235   1.209
  625    HG1  THR  85           HG1      THR  85  -5.032   4.856   2.637
  626   HG21  THR  85          HG21      THR  85  -4.520   4.045  -0.929
  627   HG22  THR  85          HG22      THR  85  -3.650   4.803   0.404
  628   HG23  THR  85          HG23      THR  85  -4.893   5.703  -0.464
  629    H    PHE  86           H        PHE  86  -7.322   6.348   1.411
  630    HA   PHE  86           HA       PHE  86  -8.054   7.797  -1.044
  631    HB2  PHE  86           HB3      PHE  86  -9.301   8.232   1.688
  632    HB3  PHE  86           HB2      PHE  86  -9.719   9.077   0.197
  633    HD1  PHE  86           HD1      PHE  86 -10.725   7.720  -1.702
  634    HD2  PHE  86           HD2      PHE  86 -10.357   6.243   2.274
  635    HE1  PHE  86           HE1      PHE  86 -12.442   6.020  -2.177
  636    HE2  PHE  86           HE2      PHE  86 -12.068   4.542   1.804
  637    HZ   PHE  86           HZ       PHE  86 -13.113   4.431  -0.423
  638    H    VAL  87           H        VAL  87  -6.660   9.360  -1.437
  639    HA   VAL  87           HA       VAL  87  -5.228  10.582   0.840
  640    HB   VAL  87           HB       VAL  87  -3.377  11.056  -0.782
  641   HG11  VAL  87          HG11      VAL  87  -3.189   9.186   0.742
  642   HG12  VAL  87          HG12      VAL  87  -2.499   8.753  -0.822
  643   HG13  VAL  87          HG13      VAL  87  -4.095   8.158  -0.369
  644   HG21  VAL  87          HG21      VAL  87  -4.637  10.912  -2.861
  645   HG22  VAL  87          HG22      VAL  87  -4.927   9.194  -2.580
  646   HG23  VAL  87          HG23      VAL  87  -3.289   9.775  -2.868
  647    H    LYS  88           H        LYS  88  -5.085  12.830   0.906
  648    HA   LYS  88           HA       LYS  88  -6.987  14.189  -0.786
  649    HB2  LYS  88           HB3      LYS  88  -6.685  16.135   0.602
  650    HB3  LYS  88           HB2      LYS  88  -6.885  14.726   1.628
  651    HG2  LYS  88           HG3      LYS  88  -4.660  14.766   2.313
  652    HG3  LYS  88           HG2      LYS  88  -4.162  15.770   0.954
  653    HD2  LYS  88           HD3      LYS  88  -5.427  17.642   1.861
  654    HD3  LYS  88           HD2      LYS  88  -5.947  16.648   3.219
  655    HE2  LYS  88           HE3      LYS  88  -3.092  17.357   2.565
  656    HE3  LYS  88           HE2      LYS  88  -4.078  18.153   3.789
  657    HZ1  LYS  88           HZ1      LYS  88  -2.655  16.494   4.790
  658    HZ2  LYS  88           HZ2      LYS  88  -3.290  15.293   3.779
  659    HZ3  LYS  88           HZ3      LYS  88  -4.280  16.028   4.936
  660    H    ALA  89           H        ALA  89  -6.573  15.161  -2.559
  661    HA   ALA  89           HA       ALA  89  -3.873  16.225  -3.066
  662    HB1  ALA  89           HB1      ALA  89  -4.192  14.149  -4.344
  663    HB2  ALA  89           HB2      ALA  89  -4.079  15.553  -5.404
  664    HB3  ALA  89           HB3      ALA  89  -5.650  14.823  -5.070
  665    H    LEU  90           H        LEU  90  -3.853  18.072  -4.493
  666    HA   LEU  90           HA       LEU  90  -6.173  19.733  -4.237
  667    HB2  LEU  90           HB3      LEU  90  -3.808  20.597  -4.240
  668    HB3  LEU  90           HB2      LEU  90  -3.714  20.182  -5.945
  669    HG   LEU  90           HG       LEU  90  -5.685  21.748  -6.302
  670   HD11  LEU  90          HD11      LEU  90  -5.981  23.492  -4.592
  671   HD12  LEU  90          HD12      LEU  90  -4.934  22.581  -3.506
  672   HD13  LEU  90          HD13      LEU  90  -6.474  21.898  -4.026
  673   HD21  LEU  90          HD21      LEU  90  -4.268  23.736  -6.313
  674   HD22  LEU  90          HD22      LEU  90  -3.401  22.328  -6.928
  675   HD23  LEU  90          HD23      LEU  90  -3.093  22.908  -5.291
  676    H    THR  91           H        THR  91  -7.902  19.193  -5.405
  677    HA   THR  91           HA       THR  91  -7.487  18.507  -8.239
  678    HB   THR  91           HB       THR  91  -9.268  16.881  -8.143
  679    HG1  THR  91           HG1      THR  91  -9.726  18.093  -5.677
  680   HG21  THR  91          HG21      THR  91  -7.457  16.462  -5.760
  681   HG22  THR  91          HG22      THR  91  -7.052  16.070  -7.427
  682   HG23  THR  91          HG23      THR  91  -8.357  15.211  -6.615
  683    H    THR  92           H        THR  92  -9.305  19.028  -9.630
  684    HA   THR  92           HA       THR  92 -11.159  20.963  -8.431
  685    HB   THR  92           HB       THR  92  -9.463  22.210  -9.699
  686    HG1  THR  92           HG1      THR  92 -11.641  22.956  -9.656
  687   HG21  THR  92          HG21      THR  92 -10.447  20.652 -12.094
  688   HG22  THR  92          HG22      THR  92  -8.858  20.501 -11.343
  689   HG23  THR  92          HG23      THR  92  -9.321  22.008 -12.133
  690    H    ASP  93           H        ASP  93 -13.246  20.727  -8.963
  691    HA   ASP  93           HA       ASP  93 -13.951  18.478 -10.685
  692    HB2  ASP  93           HB3      ASP  93 -16.170  18.645  -9.691
  693    HB3  ASP  93           HB2      ASP  93 -14.953  18.632  -8.420
  694    H    GLU  94           H        GLU  94 -13.539  21.762 -10.969
  695    HA   GLU  94           HA       GLU  94 -14.850  21.825 -13.513
  696    HB2  GLU  94           HB3      GLU  94 -16.720  22.272 -11.911
  697    HB3  GLU  94           HB2      GLU  94 -15.866  23.708 -11.380
  698    HG2  GLU  94           HG3      GLU  94 -17.548  24.360 -12.923
  699    HG3  GLU  94           HG2      GLU  94 -15.979  24.571 -13.691
  700    H    LYS  95           H        LYS  95 -14.266  24.581 -11.330
  701    HA   LYS  95           HA       LYS  95 -11.788  25.168 -12.784
  702    HB2  LYS  95           HB3      LYS  95 -14.056  27.127 -12.395
  703    HB3  LYS  95           HB2      LYS  95 -12.452  27.563 -12.958
  704    HG2  LYS  95           HG3      LYS  95 -12.796  26.014 -14.886
  705    HG3  LYS  95           HG2      LYS  95 -14.465  25.822 -14.349
  706    HD2  LYS  95           HD3      LYS  95 -14.724  28.292 -14.505
  707    HD3  LYS  95           HD2      LYS  95 -13.117  28.367 -15.226
  708    HE2  LYS  95           HE3      LYS  95 -15.497  26.881 -16.320
  709    HE3  LYS  95           HE2      LYS  95 -14.848  28.394 -16.939
  710    HZ1  LYS  95           HZ1      LYS  95 -12.773  27.218 -17.442
  711    HZ2  LYS  95           HZ2      LYS  95 -14.089  26.562 -18.273
  712    HZ3  LYS  95           HZ3      LYS  95 -13.464  25.768 -16.920
  713    H    GLN  96           H        GLN  96 -13.012  24.562  -9.893
  714    HA   GLN  96           HA       GLN  96 -11.279  26.520  -8.541
  715    HB2  GLN  96           HB3      GLN  96 -13.803  25.191  -7.541
  716    HB3  GLN  96           HB2      GLN  96 -12.706  26.089  -6.505
  717    HG2  GLN  96           HG3      GLN  96 -14.123  27.239  -8.897
  718    HG3  GLN  96           HG2      GLN  96 -14.680  27.382  -7.230
  719   HE21  GLN  96          HE21      GLN  96 -12.319  28.404  -9.564
  720   HE22  GLN  96          HE22      GLN  96 -11.678  29.714  -8.638
  721    H    ALA  97           H        ALA  97  -9.568  25.718  -7.549
  722    HA   ALA  97           HA       ALA  97  -9.247  22.831  -7.422
  723    HB1  ALA  97           HB1      ALA  97  -6.911  23.313  -6.907
  724    HB2  ALA  97           HB2      ALA  97  -7.279  25.035  -6.809
  725    HB3  ALA  97           HB3      ALA  97  -7.434  24.186  -8.347
  726    H    ALA  98           H        ALA  98  -9.340  21.646  -5.618
  727    HA   ALA  98           HA       ALA  98  -9.021  22.896  -3.009
  728    HB1  ALA  98           HB1      ALA  98 -11.411  23.142  -3.482
  729    HB2  ALA  98           HB2      ALA  98 -11.134  22.011  -2.159
  730    HB3  ALA  98           HB3      ALA  98 -11.534  21.406  -3.767
  731    H    TRP  99           H        TRP  99  -8.672  21.361  -1.320
  732    HA   TRP  99           HA       TRP  99  -7.286  19.014  -2.242
  733    HB2  TRP  99           HB3      TRP  99  -7.835  20.071   0.541
  734    HB3  TRP  99           HB2      TRP  99  -6.854  18.653   0.202
  735    HD1  TRP  99           HD1      TRP  99  -6.835  22.467  -0.332
  736    HE1  TRP  99           HE1      TRP  99  -4.395  23.226  -0.649
  737    HE3  TRP  99           HE3      TRP  99  -4.572  17.889  -0.422
  738    HZ2  TRP  99           HZ2      TRP  99  -1.852  22.040  -0.899
  739    HZ3  TRP  99           HZ3      TRP  99  -2.126  17.789  -0.699
  740    HH2  TRP  99           HH2      TRP  99  -0.796  19.820  -0.933
  741    H    ARG 100           H        ARG 100  -8.549  17.420  -2.967
  742    HA   ARG 100           HA       ARG 100 -10.814  16.561  -1.273
  743    HB2  ARG 100           HB3      ARG 100 -10.385  15.951  -4.208
  744    HB3  ARG 100           HB2      ARG 100 -11.823  15.604  -3.263
  745    HG2  ARG 100           HG3      ARG 100 -10.813  18.366  -3.903
  746    HG3  ARG 100           HG2      ARG 100 -12.073  17.516  -4.795
  747    HD2  ARG 100           HD3      ARG 100 -13.419  17.409  -2.724
  748    HD3  ARG 100           HD2      ARG 100 -12.173  18.345  -1.897
  749    HE   ARG 100           HE       ARG 100 -13.075  19.644  -4.263
  750   HH11  ARG 100          HH11      ARG 100 -13.969  19.018  -0.940
  751   HH12  ARG 100          HH12      ARG 100 -14.918  20.463  -0.795
  752   HH21  ARG 100          HH21      ARG 100 -14.317  21.539  -4.080
  753   HH22  ARG 100          HH22      ARG 100 -15.110  21.906  -2.581
  754    H    PHE 101           H        PHE 101 -11.123  14.273  -1.040
  755    HA   PHE 101           HA       PHE 101  -8.583  12.848  -0.993
  756    HB2  PHE 101           HB3      PHE 101 -11.281  12.243   0.234
  757    HB3  PHE 101           HB2      PHE 101  -9.947  11.100   0.264
  758    HD1  PHE 101           HD1      PHE 101 -11.017  14.462   1.407
  759    HD2  PHE 101           HD2      PHE 101  -8.202  11.290   1.811
  760    HE1  PHE 101           HE1      PHE 101 -10.134  15.507   3.449
  761    HE2  PHE 101           HE2      PHE 101  -7.314  12.335   3.852
  762    HZ   PHE 101           HZ       PHE 101  -8.281  14.445   4.673
  763    H    ILE 102           H        ILE 102  -8.022  11.599  -2.615
  764    HA   ILE 102           HA       ILE 102 -10.147  10.442  -4.296
  765    HB   ILE 102           HB       ILE 102  -8.431  10.310  -6.105
  766   HG12  ILE 102          HG13      ILE 102  -6.796  12.108  -4.311
  767   HG13  ILE 102          HG12      ILE 102  -6.447  10.408  -4.591
  768   HG21  ILE 102          HG21      ILE 102  -9.005  13.067  -5.033
  769   HG22  ILE 102          HG22      ILE 102 -10.051  12.109  -6.085
  770   HG23  ILE 102          HG23      ILE 102  -8.496  12.693  -6.681
  771   HD11  ILE 102          HD11      ILE 102  -6.129  10.885  -6.973
  772   HD12  ILE 102          HD12      ILE 102  -5.027  11.810  -5.950
  773   HD13  ILE 102          HD13      ILE 102  -6.440  12.592  -6.659
  774    H    ARG 103           H        ARG 103  -9.835   8.331  -5.092
  775    HA   ARG 103           HA       ARG 103  -8.581   6.680  -3.059
  776    HB2  ARG 103           HB3      ARG 103  -9.867   4.844  -4.016
  777    HB3  ARG 103           HB2      ARG 103 -10.908   6.230  -3.725
  778    HG2  ARG 103           HG3      ARG 103 -10.644   6.808  -6.156
  779    HG3  ARG 103           HG2      ARG 103  -9.847   5.248  -6.357
  780    HD2  ARG 103           HD3      ARG 103 -12.178   5.028  -6.934
  781    HD3  ARG 103           HD2      ARG 103 -11.865   4.149  -5.436
  782    HE   ARG 103           HE       ARG 103 -12.876   6.880  -5.225
  783   HH11  ARG 103          HH11      ARG 103 -13.478   3.442  -4.996
  784   HH12  ARG 103          HH12      ARG 103 -14.956   3.636  -4.107
  785   HH21  ARG 103          HH21      ARG 103 -14.825   7.136  -4.071
  786   HH22  ARG 103          HH22      ARG 103 -15.722   5.730  -3.580
  787    H    ILE 104           H        ILE 104  -6.804   5.551  -3.303
  788    HA   ILE 104           HA       ILE 104  -5.878   4.931  -6.026
  789    HB   ILE 104           HB       ILE 104  -3.522   5.113  -5.196
  790   HG12  ILE 104          HG13      ILE 104  -4.779   6.568  -2.864
  791   HG13  ILE 104          HG12      ILE 104  -4.076   4.958  -2.777
  792   HG21  ILE 104          HG21      ILE 104  -5.163   7.639  -5.111
  793   HG22  ILE 104          HG22      ILE 104  -4.472   6.882  -6.546
  794   HG23  ILE 104          HG23      ILE 104  -3.412   7.567  -5.315
  795   HD11  ILE 104          HD11      ILE 104  -2.590   7.467  -3.504
  796   HD12  ILE 104          HD12      ILE 104  -1.899   5.853  -3.334
  797   HD13  ILE 104          HD13      ILE 104  -2.570   6.679  -1.926
  798    H    ASP 105           H        ASP 105  -5.057   2.881  -6.306
  799    HA   ASP 105           HA       ASP 105  -5.829   0.969  -4.280
  800    HB2  ASP 105           HB3      ASP 105  -4.533   0.544  -6.990
  801    HB3  ASP 105           HB2      ASP 105  -5.126  -0.741  -5.938
  802    H    THR 106           H        THR 106  -4.537   0.029  -2.839
  803    HA   THR 106           HA       THR 106  -1.759   0.902  -2.790
  804    HB   THR 106           HB       THR 106  -1.848  -0.254  -0.479
  805    HG1  THR 106           HG1      THR 106  -3.854  -0.729   0.294
  806   HG21  THR 106          HG21      THR 106  -3.587   2.149  -1.055
  807   HG22  THR 106          HG22      THR 106  -1.851   2.170  -0.746
  808   HG23  THR 106          HG23      THR 106  -2.969   1.693   0.532
  809    H    ALA 107           H        ALA 107  -3.643  -1.998  -3.237
  810    HA   ALA 107           HA       ALA 107  -1.412  -3.435  -4.256
  811    HB1  ALA 107           HB1      ALA 107  -1.309  -5.212  -2.594
  812    HB2  ALA 107           HB2      ALA 107  -2.501  -4.373  -1.604
  813    HB3  ALA 107           HB3      ALA 107  -0.910  -3.658  -1.862
  814    H    CYS 108           H        CYS 108  -2.015  -5.411  -5.231
  815    HA   CYS 108           HA       CYS 108  -4.912  -5.819  -5.468
  816    HB2  CYS 108           HB3      CYS 108  -3.460  -5.551  -7.559
  817    HB3  CYS 108           HB2      CYS 108  -2.750  -7.115  -7.151
  818    H    VAL 109           H        VAL 109  -5.680  -7.228  -4.024
  819    HA   VAL 109           HA       VAL 109  -3.794  -9.058  -2.778
  820    HB   VAL 109           HB       VAL 109  -5.455  -9.402  -1.042
  821   HG11  VAL 109          HG11      VAL 109  -5.146  -6.488  -1.758
  822   HG12  VAL 109          HG12      VAL 109  -4.015  -7.468  -0.823
  823   HG13  VAL 109          HG13      VAL 109  -5.615  -7.109  -0.174
  824   HG21  VAL 109          HG21      VAL 109  -7.271  -7.632  -2.681
  825   HG22  VAL 109          HG22      VAL 109  -7.601  -8.218  -1.050
  826   HG23  VAL 109          HG23      VAL 109  -7.484  -9.360  -2.392
  827    H    CYS 110           H        CYS 110  -3.986 -11.221  -2.700
  828    HA   CYS 110           HA       CYS 110  -5.667 -12.480  -4.726
  829    HB2  CYS 110           HB3      CYS 110  -3.208 -13.010  -4.543
  830    HB3  CYS 110           HB2      CYS 110  -3.528 -13.719  -2.970
  831    H    VAL 111           H        VAL 111  -7.692 -12.742  -3.943
  832    HA   VAL 111           HA       VAL 111  -8.080 -13.332  -1.127
  833    HB   VAL 111           HB       VAL 111 -10.443 -13.042  -1.529
  834   HG11  VAL 111          HG11      VAL 111  -8.829 -10.955  -2.980
  835   HG12  VAL 111          HG12      VAL 111  -9.165 -11.007  -1.251
  836   HG13  VAL 111          HG13      VAL 111 -10.479 -10.744  -2.397
  837   HG21  VAL 111          HG21      VAL 111 -10.606 -14.180  -3.676
  838   HG22  VAL 111          HG22      VAL 111  -9.775 -12.835  -4.456
  839   HG23  VAL 111          HG23      VAL 111 -11.363 -12.589  -3.732
  840    H    LEU 112           H        LEU 112  -9.273 -15.140  -0.363
  841    HA   LEU 112           HA       LEU 112  -9.123 -17.453  -2.171
  842    HB2  LEU 112           HB3      LEU 112  -9.040 -17.363   0.851
  843    HB3  LEU 112           HB2      LEU 112  -9.031 -18.831  -0.107
  844    HG   LEU 112           HG       LEU 112  -6.859 -16.728  -0.043
  845   HD11  LEU 112          HD11      LEU 112  -6.930 -18.123   1.954
  846   HD12  LEU 112          HD12      LEU 112  -5.519 -18.504   0.967
  847   HD13  LEU 112          HD13      LEU 112  -6.920 -19.575   0.954
  848   HD21  LEU 112          HD21      LEU 112  -7.039 -19.296  -1.613
  849   HD22  LEU 112          HD22      LEU 112  -5.596 -18.295  -1.457
  850   HD23  LEU 112          HD23      LEU 112  -7.023 -17.658  -2.269
  851    H    SER 113           H        SER 113 -10.891 -18.618  -2.551
  852    HA   SER 113           HA       SER 113 -13.309 -18.073  -0.964
  853    HB2  SER 113           HB3      SER 113 -13.179 -18.649  -3.938
  854    HB3  SER 113           HB2      SER 113 -14.638 -18.325  -3.001
  855    HG   SER 113           HG       SER 113 -12.988 -16.328  -2.540
  856    H    ARG 114           H        ARG 114 -14.801 -19.878  -0.864
  857    HA   ARG 114           HA       ARG 114 -13.379 -22.337  -0.425
  858    HB2  ARG 114           HB3      ARG 114 -16.289 -21.609  -0.073
  859    HB3  ARG 114           HB2      ARG 114 -15.606 -23.171   0.360
  860    HG2  ARG 114           HG3      ARG 114 -14.831 -20.508   1.538
  861    HG3  ARG 114           HG2      ARG 114 -15.830 -21.741   2.309
  862    HD2  ARG 114           HD3      ARG 114 -12.935 -22.034   1.505
  863    HD3  ARG 114           HD2      ARG 114 -13.545 -21.831   3.145
  864    HE   ARG 114           HE       ARG 114 -14.838 -24.046   2.238
  865   HH11  ARG 114          HH11      ARG 114 -11.463 -23.127   2.451
  866   HH12  ARG 114          HH12      ARG 114 -10.906 -24.751   2.680
  867   HH21  ARG 114          HH21      ARG 114 -14.096 -26.178   2.529
  868   HH22  ARG 114          HH22      ARG 114 -12.400 -26.483   2.723
  869    H    LYS 115           H        LYS 115 -14.206 -21.148  -3.205
  870    HA   LYS 115           HA       LYS 115 -14.575 -21.965  -5.287
  871    HB2  LYS 115           HB3      LYS 115 -14.572 -24.691  -3.954
  872    HB3  LYS 115           HB2      LYS 115 -14.523 -24.412  -5.686
  873    HG2  LYS 115           HG3      LYS 115 -12.362 -23.270  -5.422
  874    HG3  LYS 115           HG2      LYS 115 -12.421 -23.603  -3.689
  875    HD2  LYS 115           HD3      LYS 115 -11.026 -25.243  -4.767
  876    HD3  LYS 115           HD2      LYS 115 -12.499 -26.015  -4.186
  877    HE2  LYS 115           HE3      LYS 115 -13.441 -25.961  -6.408
  878    HE3  LYS 115           HE2      LYS 115 -12.030 -25.102  -7.020
  879    HZ1  LYS 115           HZ1      LYS 115 -11.916 -27.455  -7.527
  880    HZ2  LYS 115           HZ2      LYS 115 -12.030 -27.847  -5.888
  881    HZ3  LYS 115           HZ3      LYS 115 -10.671 -27.021  -6.467
  882    H    ALA 116           H        ALA 116 -16.628 -21.125  -3.532
  883    HA   ALA 116           HA       ALA 116 -18.927 -22.099  -4.976
  884    HB1  ALA 116           HB1      ALA 116 -18.790 -23.703  -3.121
  885    HB2  ALA 116           HB2      ALA 116 -20.214 -22.672  -2.980
  886    HB3  ALA 116           HB3      ALA 116 -18.801 -22.367  -1.970
  887    H    THR 117           H        THR 117 -20.615 -20.588  -4.942
  888    HA   THR 117           HA       THR 117 -19.865 -17.990  -3.795
  889    HB   THR 117           HB       THR 117 -21.474 -17.028  -5.429
  890    HG1  THR 117           HG1      THR 117 -21.785 -18.860  -7.206
  891   HG21  THR 117          HG21      THR 117 -19.102 -17.163  -5.996
  892   HG22  THR 117          HG22      THR 117 -20.104 -17.405  -7.428
  893   HG23  THR 117          HG23      THR 117 -19.340 -18.786  -6.642
  894    H    ARG 118           H        ARG 118 -21.951 -16.592  -3.367
  895    HA   ARG 118           HA       ARG 118 -23.859 -18.266  -1.897
  896    HB2  ARG 118           HB3      ARG 118 -23.954 -16.202  -0.289
  897    HB3  ARG 118           HB2      ARG 118 -22.696 -17.403  -0.111
  898    HG2  ARG 118           HG3      ARG 118 -21.661 -15.307   0.152
  899    HG3  ARG 118           HG2      ARG 118 -21.193 -15.889  -1.441
  900    HD2  ARG 118           HD3      ARG 118 -23.601 -14.167  -1.305
  901    HD3  ARG 118           HD2      ARG 118 -22.052 -13.392  -0.976
  902    HE   ARG 118           HE       ARG 118 -21.462 -14.597  -3.237
  903   HH11  ARG 118          HH11      ARG 118 -24.412 -12.924  -2.389
  904   HH12  ARG 118          HH12      ARG 118 -24.722 -12.384  -4.007
  905   HH21  ARG 118          HH21      ARG 118 -21.860 -13.879  -5.374
  906   HH22  ARG 118          HH22      ARG 118 -23.269 -12.920  -5.701
  907    H1   SER   1           H1       SER   1 -33.329  -7.979   5.632
  908    H2   SER   1           H2       SER   1 -34.107  -6.601   5.036
  909    H3   SER   1           H3       SER   1 -33.599  -6.655   6.646
  910    HA   SER   1           HA       SER   1 -31.827  -6.707   4.284
  911    HB2  SER   1           HB3      SER   1 -32.945  -4.510   4.697
  912    HB3  SER   1           HB2      SER   1 -32.265  -4.504   6.322
  913    HG   SER   1           HG       SER   1 -30.809  -4.522   3.877
  914    H    SER   2           H        SER   2 -30.792  -8.567   5.183
  915    HA   SER   2           HA       SER   2 -28.834  -7.815   7.223
  916    HB2  SER   2           HB3      SER   2 -30.467 -10.369   7.337
  917    HB3  SER   2           HB2      SER   2 -29.116  -9.974   8.400
  918    HG   SER   2           HG       SER   2 -30.610  -7.924   8.639
  919    H    THR   3           H        THR   3 -28.606  -7.977   4.435
  920    HA   THR   3           HA       THR   3 -27.531 -10.514   3.656
  921    HB   THR   3           HB       THR   3 -26.756  -9.125   1.619
  922    HG1  THR   3           HG1      THR   3 -27.198  -7.112   2.999
  923   HG21  THR   3          HG21      THR   3 -29.695  -9.332   2.274
  924   HG22  THR   3          HG22      THR   3 -28.697 -10.615   1.593
  925   HG23  THR   3          HG23      THR   3 -29.006  -9.150   0.663
  926    H    HIS   4           H        HIS   4 -25.579 -11.228   4.065
  927    HA   HIS   4           HA       HIS   4 -23.357  -9.330   4.195
  928    HB2  HIS   4           HB3      HIS   4 -22.366 -10.714   6.075
  929    HB3  HIS   4           HB2      HIS   4 -23.756  -9.734   6.510
  930    HD1  HIS   4           HD1      HIS   4 -25.994 -11.007   7.008
  931    HD2  HIS   4           HD2      HIS   4 -22.689 -13.452   6.388
  932    HE1  HIS   4           HE1      HIS   4 -26.668 -13.282   7.839
  933    HE2  HIS   4           HE2      HIS   4 -24.709 -14.772   7.312
  934    HA   PRO   5           HA       PRO   5 -22.444 -12.769   1.310
  935    HB2  PRO   5           HB3      PRO   5 -21.343 -11.278  -0.628
  936    HB3  PRO   5           HB2      PRO   5 -23.097 -11.365  -0.420
  937    HG2  PRO   5           HG3      PRO   5 -21.185  -9.230   0.454
  938    HG3  PRO   5           HG2      PRO   5 -22.785  -9.056  -0.290
  939    HD2  PRO   5           HD3      PRO   5 -22.310  -8.824   2.401
  940    HD3  PRO   5           HD2      PRO   5 -23.872  -9.317   1.714
  941    H    VAL   6           H        VAL   6 -20.897 -12.343   3.569
  942    HA   VAL   6           HA       VAL   6 -18.799 -12.447   4.450
  943    HB   VAL   6           HB       VAL   6 -17.919 -13.468   1.748
  944   HG11  VAL   6          HG11      VAL   6 -16.972 -14.091   4.542
  945   HG12  VAL   6          HG12      VAL   6 -16.134 -13.086   3.360
  946   HG13  VAL   6          HG13      VAL   6 -16.348 -14.811   3.057
  947   HG21  VAL   6          HG21      VAL   6 -19.281 -15.023   3.942
  948   HG22  VAL   6          HG22      VAL   6 -18.562 -15.712   2.487
  949   HG23  VAL   6          HG23      VAL   6 -19.959 -14.644   2.359
  950    H    PHE   7           H        PHE   7 -19.321  -9.985   3.932
  951    HA   PHE   7           HA       PHE   7 -18.803  -7.954   3.068
  952    HB2  PHE   7           HB3      PHE   7 -16.337  -7.361   3.442
  953    HB3  PHE   7           HB2      PHE   7 -17.288  -7.848   4.833
  954    HD1  PHE   7           HD1      PHE   7 -14.633  -8.890   2.498
  955    HD2  PHE   7           HD2      PHE   7 -16.748  -9.792   6.079
  956    HE1  PHE   7           HE1      PHE   7 -12.926 -10.559   3.083
  957    HE2  PHE   7           HE2      PHE   7 -15.050 -11.468   6.666
  958    HZ   PHE   7           HZ       PHE   7 -13.135 -11.855   5.170
  959    H    HIS   8           H        HIS   8 -19.242  -9.574   0.997
  960    HA   HIS   8           HA       HIS   8 -19.076  -9.677  -1.252
  961    HB2  HIS   8           HB3      HIS   8 -17.493  -7.173  -0.751
  962    HB3  HIS   8           HB2      HIS   8 -17.658  -7.827  -2.376
  963    HD1  HIS   8           HD1      HIS   8 -19.449  -5.867   0.185
  964    HD2  HIS   8           HD2      HIS   8 -20.347  -7.821  -3.374
  965    HE1  HIS   8           HE1      HIS   8 -21.717  -5.024  -0.500
  966    HE2  HIS   8           HE2      HIS   8 -22.311  -6.355  -2.554
  967    H    MET   9           H        MET   9 -17.127 -10.989   0.544
  968    HA   MET   9           HA       MET   9 -15.154 -12.083   0.569
  969    HB2  MET   9           HB3      MET   9 -14.852 -13.582  -1.459
  970    HB3  MET   9           HB2      MET   9 -16.368 -13.712  -0.588
  971    HG2  MET   9           HG3      MET   9 -17.387 -12.219  -2.319
  972    HG3  MET   9           HG2      MET   9 -15.884 -12.355  -3.225
  973    HE1  MET   9           HE1      MET   9 -18.819 -14.385  -1.588
  974    HE2  MET   9           HE2      MET   9 -17.394 -15.279  -1.055
  975    HE3  MET   9           HE3      MET   9 -18.518 -16.010  -2.203
  976    H    GLY  10           H        GLY  10 -14.576  -9.524   0.199
  977    HA2  GLY  10           HA3      GLY  10 -12.270  -9.653  -1.641
  978    HA3  GLY  10           HA2      GLY  10 -13.191  -8.176  -1.383
  979    H    GLU  11           H        GLU  11 -10.673  -7.782  -0.928
  980    HA   GLU  11           HA       GLU  11  -9.142  -7.049   0.573
  981    HB2  GLU  11           HB3      GLU  11 -11.425  -7.327   2.539
  982    HB3  GLU  11           HB2      GLU  11  -9.902  -6.501   2.868
  983    HG2  GLU  11           HG3      GLU  11 -11.919  -5.711   0.766
  984    HG3  GLU  11           HG2      GLU  11 -11.708  -4.939   2.337
  985    H    PHE  12           H        PHE  12 -10.161 -10.123   0.495
  986    HA   PHE  12           HA       PHE  12  -9.117 -11.260   2.847
  987    HB2  PHE  12           HB3      PHE  12  -9.653 -12.347   0.108
  988    HB3  PHE  12           HB2      PHE  12  -8.738 -13.313   1.257
  989    HD1  PHE  12           HD1      PHE  12 -11.899 -12.779  -0.019
  990    HD2  PHE  12           HD2      PHE  12  -9.893 -13.352   3.689
  991    HE1  PHE  12           HE1      PHE  12 -13.985 -13.605   0.978
  992    HE2  PHE  12           HE2      PHE  12 -11.980 -14.175   4.695
  993    HZ   PHE  12           HZ       PHE  12 -14.030 -14.303   3.338
  994    H    SER  13           H        SER  13  -7.139 -11.625   3.501
  995    HA   SER  13           HA       SER  13  -4.938 -11.387   1.570
  996    HB2  SER  13           HB3      SER  13  -4.935 -10.409   4.440
  997    HB3  SER  13           HB2      SER  13  -3.620 -10.241   3.284
  998    HG   SER  13           HG       SER  13  -6.119  -9.231   2.559
  999    H    VAL  14           H        VAL  14  -3.924 -13.296   1.409
 1000    HA   VAL  14           HA       VAL  14  -4.209 -15.469   3.135
 1001    HB   VAL  14           HB       VAL  14  -2.191 -16.424   2.069
 1002   HG11  VAL  14          HG11      VAL  14  -4.088 -15.089   0.145
 1003   HG12  VAL  14          HG12      VAL  14  -4.346 -16.628   0.963
 1004   HG13  VAL  14          HG13      VAL  14  -3.050 -16.466  -0.223
 1005   HG21  VAL  14          HG21      VAL  14  -0.853 -14.386   1.878
 1006   HG22  VAL  14          HG22      VAL  14  -1.973 -13.758   0.671
 1007   HG23  VAL  14          HG23      VAL  14  -1.013 -15.194   0.319
 1008    H    CYS  15           H        CYS  15  -2.074 -12.756   3.234
 1009    HA   CYS  15           HA       CYS  15  -1.040 -13.672   5.824
 1010    HB2  CYS  15           HB3      CYS  15   0.677 -13.006   4.161
 1011    HB3  CYS  15           HB2      CYS  15  -0.070 -11.410   4.049
 1012    H    ASP  16           H        ASP  16  -2.380 -13.002   7.395
 1013    HA   ASP  16           HA       ASP  16  -4.415 -11.128   7.053
 1014    HB2  ASP  16           HB3      ASP  16  -3.150 -12.137   9.614
 1015    HB3  ASP  16           HB2      ASP  16  -4.609 -11.155   9.562
 1016    H    SER  17           H        SER  17  -4.289  -9.048   6.755
 1017    HA   SER  17           HA       SER  17  -2.268  -7.500   8.231
 1018    HB2  SER  17           HB3      SER  17  -3.253  -7.025   5.400
 1019    HB3  SER  17           HB2      SER  17  -2.112  -5.999   6.273
 1020    HG   SER  17           HG       SER  17  -1.702  -8.752   5.661
 1021    H    VAL  18           H        VAL  18  -2.950  -5.520   9.069
 1022    HA   VAL  18           HA       VAL  18  -5.855  -5.066   8.903
 1023    HB   VAL  18           HB       VAL  18  -5.237  -5.816  11.123
 1024   HG11  VAL  18          HG11      VAL  18  -3.744  -4.535  12.565
 1025   HG12  VAL  18          HG12      VAL  18  -3.354  -3.473  11.211
 1026   HG13  VAL  18          HG13      VAL  18  -2.902  -5.177  11.154
 1027   HG21  VAL  18          HG21      VAL  18  -6.096  -3.931  12.447
 1028   HG22  VAL  18          HG22      VAL  18  -7.036  -4.218  10.983
 1029   HG23  VAL  18          HG23      VAL  18  -5.888  -2.880  11.047
 1030    H    SER  19           H        SER  19  -6.414  -3.254   7.914
 1031    HA   SER  19           HA       SER  19  -4.435  -1.151   7.536
 1032    HB2  SER  19           HB3      SER  19  -6.339  -0.232   6.031
 1033    HB3  SER  19           HB2      SER  19  -5.484  -1.684   5.509
 1034    HG   SER  19           HG       SER  19  -7.345  -2.641   5.516
 1035    H    VAL  20           H        VAL  20  -4.343   0.490   8.932
 1036    HA   VAL  20           HA       VAL  20  -6.815   1.240  10.357
 1037    HB   VAL  20           HB       VAL  20  -3.992   1.441  11.407
 1038   HG11  VAL  20          HG11      VAL  20  -5.467   3.111  12.353
 1039   HG12  VAL  20          HG12      VAL  20  -5.060   1.892  13.560
 1040   HG13  VAL  20          HG13      VAL  20  -6.639   1.861  12.777
 1041   HG21  VAL  20          HG21      VAL  20  -4.641  -0.891  11.189
 1042   HG22  VAL  20          HG22      VAL  20  -6.130  -0.571  12.080
 1043   HG23  VAL  20          HG23      VAL  20  -4.570  -0.419  12.886
 1044    H    TRP  21           H        TRP  21  -7.330   3.371  10.455
 1045    HA   TRP  21           HA       TRP  21  -5.622   5.266   9.029
 1046    HB2  TRP  21           HB3      TRP  21  -8.430   5.532  10.144
 1047    HB3  TRP  21           HB2      TRP  21  -7.557   6.841   9.358
 1048    HD1  TRP  21           HD1      TRP  21  -9.332   3.539   8.589
 1049    HE1  TRP  21           HE1      TRP  21  -9.787   3.410   6.058
 1050    HE3  TRP  21           HE3      TRP  21  -6.697   7.659   7.078
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.118   4.864   3.734
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.658   8.219   4.681
 1053    HH2  TRP  21           HH2      TRP  21  -7.843   6.850   3.047
 1054    H    VAL  22           H        VAL  22  -3.971   5.783  10.355
 1055    HA   VAL  22           HA       VAL  22  -4.492   6.196  13.197
 1056    HB   VAL  22           HB       VAL  22  -1.850   6.113  11.740
 1057   HG11  VAL  22          HG11      VAL  22  -0.898   5.749  13.971
 1058   HG12  VAL  22          HG12      VAL  22  -2.499   5.966  14.679
 1059   HG13  VAL  22          HG13      VAL  22  -1.714   7.307  13.840
 1060   HG21  VAL  22          HG21      VAL  22  -1.633   3.839  12.633
 1061   HG22  VAL  22          HG22      VAL  22  -2.997   3.986  11.524
 1062   HG23  VAL  22          HG23      VAL  22  -3.276   3.939  13.266
 1063    H    GLY  23           H        GLY  23  -4.855   8.169  13.917
 1064    HA2  GLY  23           HA3      GLY  23  -3.283  10.385  12.763
 1065    HA3  GLY  23           HA2      GLY  23  -4.988  10.583  13.172
 1066    H    ASP  24           H        ASP  24  -3.084   8.548  15.170
 1067    HA   ASP  24           HA       ASP  24  -3.190  10.598  17.274
 1068    HB2  ASP  24           HB3      ASP  24  -3.410   8.777  18.893
 1069    HB3  ASP  24           HB2      ASP  24  -4.679   8.672  17.672
 1070    H    LYS  25           H        LYS  25  -1.079   8.506  15.516
 1071    HA   LYS  25           HA       LYS  25   0.951   8.345  17.512
 1072    HB2  LYS  25           HB3      LYS  25   2.334   7.324  15.883
 1073    HB3  LYS  25           HB2      LYS  25   0.707   6.767  15.537
 1074    HG2  LYS  25           HG3      LYS  25   0.528   8.174  13.645
 1075    HG3  LYS  25           HG2      LYS  25   1.985   9.070  14.089
 1076    HD2  LYS  25           HD3      LYS  25   3.309   7.018  13.777
 1077    HD3  LYS  25           HD2      LYS  25   1.852   6.172  13.260
 1078    HE2  LYS  25           HE3      LYS  25   3.040   8.592  11.897
 1079    HE3  LYS  25           HE2      LYS  25   3.238   6.922  11.356
 1080    HZ1  LYS  25           HZ1      LYS  25   1.487   8.000  10.128
 1081    HZ2  LYS  25           HZ2      LYS  25   0.671   8.401  11.552
 1082    HZ3  LYS  25           HZ3      LYS  25   0.825   6.775  11.097
 1083    H    THR  26           H        THR  26   2.963   9.448  17.564
 1084    HA   THR  26           HA       THR  26   2.723  12.156  16.441
 1085    HB   THR  26           HB       THR  26   2.362  12.039  18.897
 1086    HG1  THR  26           HG1      THR  26   4.606  13.440  17.864
 1087   HG21  THR  26          HG21      THR  26   5.240  11.134  18.950
 1088   HG22  THR  26          HG22      THR  26   3.835  10.189  19.447
 1089   HG23  THR  26          HG23      THR  26   4.301  11.625  20.359
 1090    H    THR  27           H        THR  27   4.432   9.444  16.001
 1091    HA   THR  27           HA       THR  27   6.740  10.935  15.037
 1092    HB   THR  27           HB       THR  27   8.133   8.865  15.904
 1093    HG1  THR  27           HG1      THR  27   7.036   8.778  18.255
 1094   HG21  THR  27          HG21      THR  27   7.328  11.189  17.653
 1095   HG22  THR  27          HG22      THR  27   8.625  11.180  16.457
 1096   HG23  THR  27          HG23      THR  27   8.748  10.170  17.897
 1097    H    ALA  28           H        ALA  28   7.803  10.016  13.302
 1098    HA   ALA  28           HA       ALA  28   7.159   7.321  12.452
 1099    HB1  ALA  28           HB1      ALA  28   5.309   8.574  11.466
 1100    HB2  ALA  28           HB2      ALA  28   6.396   7.961  10.220
 1101    HB3  ALA  28           HB3      ALA  28   6.455   9.662  10.683
 1102    H    THR  29           H        THR  29   8.398   6.778  10.422
 1103    HA   THR  29           HA       THR  29  11.048   7.983  10.637
 1104    HB   THR  29           HB       THR  29  10.293   5.503   9.094
 1105    HG1  THR  29           HG1      THR  29  10.938   5.863  11.835
 1106   HG21  THR  29          HG21      THR  29  12.922   6.459  10.234
 1107   HG22  THR  29          HG22      THR  29  12.461   6.511   8.532
 1108   HG23  THR  29          HG23      THR  29  12.665   4.958   9.345
 1109    H    ASP  30           H        ASP  30  11.690   9.403   9.228
 1110    HA   ASP  30           HA       ASP  30  10.237  10.167   6.915
 1111    HB2  ASP  30           HB3      ASP  30  11.664  11.716   8.227
 1112    HB3  ASP  30           HB2      ASP  30  13.092  10.807   7.737
 1113    H    ILE  31           H        ILE  31  11.242  10.236   4.693
 1114    HA   ILE  31           HA       ILE  31  11.850   7.646   3.785
 1115    HB   ILE  31           HB       ILE  31  10.812   9.310   2.329
 1116   HG12  ILE  31          HG13      ILE  31  13.525   8.489   1.264
 1117   HG13  ILE  31          HG12      ILE  31  12.099   7.456   1.306
 1118   HG21  ILE  31          HG21      ILE  31  11.958  11.301   3.133
 1119   HG22  ILE  31          HG22      ILE  31  12.086  11.163   1.380
 1120   HG23  ILE  31          HG23      ILE  31  13.462  10.745   2.401
 1121   HD11  ILE  31          HD11      ILE  31  12.386  10.014  -0.248
 1122   HD12  ILE  31          HD12      ILE  31  10.950   8.990  -0.205
 1123   HD13  ILE  31          HD13      ILE  31  12.450   8.378  -0.904
 1124    H    LYS  32           H        LYS  32  13.867  10.268   4.873
 1125    HA   LYS  32           HA       LYS  32  16.315   9.190   3.807
 1126    HB2  LYS  32           HB3      LYS  32  15.848  11.310   5.909
 1127    HB3  LYS  32           HB2      LYS  32  17.380  10.979   5.109
 1128    HG2  LYS  32           HG3      LYS  32  16.511  11.717   3.006
 1129    HG3  LYS  32           HG2      LYS  32  14.884  11.846   3.672
 1130    HD2  LYS  32           HD3      LYS  32  15.683  13.583   5.209
 1131    HD3  LYS  32           HD2      LYS  32  17.278  13.497   4.460
 1132    HE2  LYS  32           HE3      LYS  32  16.335  14.179   2.331
 1133    HE3  LYS  32           HE2      LYS  32  14.716  14.180   3.029
 1134    HZ1  LYS  32           HZ1      LYS  32  15.645  16.407   2.893
 1135    HZ2  LYS  32           HZ2      LYS  32  16.945  15.948   3.868
 1136    HZ3  LYS  32           HZ3      LYS  32  15.378  15.961   4.504
 1137    H    GLY  33           H        GLY  33  14.350   8.375   6.390
 1138    HA2  GLY  33           HA3      GLY  33  14.803   6.471   7.739
 1139    HA3  GLY  33           HA2      GLY  33  16.525   6.783   7.551
 1140    H    LYS  34           H        LYS  34  14.796   9.589   8.193
 1141    HA   LYS  34           HA       LYS  34  15.910   9.764  10.854
 1142    HB2  LYS  34           HB3      LYS  34  14.231  11.706   9.263
 1143    HB3  LYS  34           HB2      LYS  34  14.970  12.060  10.815
 1144    HG2  LYS  34           HG3      LYS  34  16.471  11.359   8.306
 1145    HG3  LYS  34           HG2      LYS  34  16.216  12.987   8.919
 1146    HD2  LYS  34           HD3      LYS  34  17.354  12.274  11.030
 1147    HD3  LYS  34           HD2      LYS  34  17.775  10.765  10.216
 1148    HE2  LYS  34           HE3      LYS  34  19.638  12.272  10.038
 1149    HE3  LYS  34           HE2      LYS  34  18.896  12.097   8.452
 1150    HZ1  LYS  34           HZ1      LYS  34  19.422  14.400   8.909
 1151    HZ2  LYS  34           HZ2      LYS  34  18.482  14.372  10.315
 1152    HZ3  LYS  34           HZ3      LYS  34  17.746  14.203   8.803
 1153    H    GLU  35           H        GLU  35  14.624  10.352  12.705
 1154    HA   GLU  35           HA       GLU  35  11.872   9.337  12.573
 1155    HB2  GLU  35           HB3      GLU  35  13.293   8.185  14.199
 1156    HB3  GLU  35           HB2      GLU  35  13.702   9.720  14.947
 1157    HG2  GLU  35           HG3      GLU  35  11.475  10.021  15.728
 1158    HG3  GLU  35           HG2      GLU  35  10.907   8.634  14.804
 1159    H    VAL  36           H        VAL  36  10.362  10.850  12.452
 1160    HA   VAL  36           HA       VAL  36  11.000  13.501  13.562
 1161    HB   VAL  36           HB       VAL  36   9.571  14.467  11.757
 1162   HG11  VAL  36          HG11      VAL  36  11.979  12.892  10.854
 1163   HG12  VAL  36          HG12      VAL  36  11.988  14.512  11.554
 1164   HG13  VAL  36          HG13      VAL  36  11.250  14.237   9.975
 1165   HG21  VAL  36          HG21      VAL  36   9.746  11.693  10.588
 1166   HG22  VAL  36          HG22      VAL  36   9.080  13.116   9.787
 1167   HG23  VAL  36          HG23      VAL  36   8.287  12.459  11.217
 1168    H    THR  37           H        THR  37   9.305  14.743  14.369
 1169    HA   THR  37           HA       THR  37   7.208  13.218  15.629
 1170    HB   THR  37           HB       THR  37   7.756  16.187  15.722
 1171    HG1  THR  37           HG1      THR  37   9.264  14.274  16.614
 1172   HG21  THR  37          HG21      THR  37   5.491  15.589  16.443
 1173   HG22  THR  37          HG22      THR  37   6.471  16.133  17.804
 1174   HG23  THR  37          HG23      THR  37   6.160  14.414  17.574
 1175    H    VAL  38           H        VAL  38   5.444  12.754  14.520
 1176    HA   VAL  38           HA       VAL  38   4.729  14.332  12.204
 1177    HB   VAL  38           HB       VAL  38   3.530  11.765  13.252
 1178   HG11  VAL  38          HG11      VAL  38   1.935  13.023  11.906
 1179   HG12  VAL  38          HG12      VAL  38   2.485  11.583  11.047
 1180   HG13  VAL  38          HG13      VAL  38   3.127  13.167  10.613
 1181   HG21  VAL  38          HG21      VAL  38   5.478  12.263  11.008
 1182   HG22  VAL  38          HG22      VAL  38   4.749  10.708  11.409
 1183   HG23  VAL  38          HG23      VAL  38   5.840  11.491  12.552
 1184    H    LEU  39           H        LEU  39   3.226  15.825  12.189
 1185    HA   LEU  39           HA       LEU  39   1.366  16.012  14.441
 1186    HB2  LEU  39           HB3      LEU  39   1.854  18.020  12.234
 1187    HB3  LEU  39           HB2      LEU  39   1.001  18.292  13.743
 1188    HG   LEU  39           HG       LEU  39   3.957  17.728  13.499
 1189   HD11  LEU  39          HD11      LEU  39   3.396  19.900  12.582
 1190   HD12  LEU  39          HD12      LEU  39   4.234  20.080  14.123
 1191   HD13  LEU  39          HD13      LEU  39   2.485  20.301  14.038
 1192   HD21  LEU  39          HD21      LEU  39   2.284  18.515  15.877
 1193   HD22  LEU  39          HD22      LEU  39   4.040  18.360  15.857
 1194   HD23  LEU  39          HD23      LEU  39   3.026  16.940  15.603
 1195    H    ALA  40           H        ALA  40  -0.530  15.044  14.124
 1196    HA   ALA  40           HA       ALA  40  -1.466  14.225  11.571
 1197    HB1  ALA  40           HB1      ALA  40  -3.463  13.486  12.754
 1198    HB2  ALA  40           HB2      ALA  40  -2.960  14.386  14.186
 1199    HB3  ALA  40           HB3      ALA  40  -2.008  13.009  13.630
 1200    H    GLU  41           H        GLU  41  -1.700  17.091  13.369
 1201    HA   GLU  41           HA       GLU  41  -3.870  18.110  11.680
 1202    HB2  GLU  41           HB3      GLU  41  -2.671  19.336  14.174
 1203    HB3  GLU  41           HB2      GLU  41  -4.087  19.907  13.306
 1204    HG2  GLU  41           HG3      GLU  41  -5.195  17.741  13.854
 1205    HG3  GLU  41           HG2      GLU  41  -3.813  17.361  14.876
 1206    H    VAL  42           H        VAL  42  -3.184  19.170   9.935
 1207    HA   VAL  42           HA       VAL  42  -0.525  20.377   9.965
 1208    HB   VAL  42           HB       VAL  42  -0.677  20.520   7.549
 1209   HG11  VAL  42          HG11      VAL  42   0.080  18.421   8.483
 1210   HG12  VAL  42          HG12      VAL  42  -0.830  18.139   6.998
 1211   HG13  VAL  42          HG13      VAL  42  -1.580  17.834   8.565
 1212   HG21  VAL  42          HG21      VAL  42  -2.599  19.684   6.305
 1213   HG22  VAL  42          HG22      VAL  42  -3.050  21.047   7.330
 1214   HG23  VAL  42          HG23      VAL  42  -3.465  19.404   7.814
 1215    H    ASN  43           H        ASN  43  -0.175  22.528   9.708
 1216    HA   ASN  43           HA       ASN  43  -2.553  24.225  10.027
 1217    HB2  ASN  43           HB3      ASN  43   0.314  24.875  10.770
 1218    HB3  ASN  43           HB2      ASN  43  -1.119  25.819  11.168
 1219   HD21  ASN  43          HD21      ASN  43   0.827  23.086  11.982
 1220   HD22  ASN  43          HD22      ASN  43  -0.001  22.660  13.438
 1221    H    ILE  44           H        ILE  44  -3.087  24.815   7.978
 1222    HA   ILE  44           HA       ILE  44  -0.956  26.060   6.359
 1223    HB   ILE  44           HB       ILE  44  -3.599  24.934   5.403
 1224   HG12  ILE  44          HG13      ILE  44  -0.797  23.853   5.008
 1225   HG13  ILE  44          HG12      ILE  44  -1.972  23.198   6.147
 1226   HG21  ILE  44          HG21      ILE  44  -2.810  26.811   4.051
 1227   HG22  ILE  44          HG22      ILE  44  -2.705  25.297   3.156
 1228   HG23  ILE  44          HG23      ILE  44  -1.251  26.016   3.846
 1229   HD11  ILE  44          HD11      ILE  44  -2.258  23.284   3.148
 1230   HD12  ILE  44          HD12      ILE  44  -3.455  22.649   4.277
 1231   HD13  ILE  44          HD13      ILE  44  -1.885  21.864   4.125
 1232    H    ASN  45           H        ASN  45  -1.008  28.155   6.921
 1233    HA   ASN  45           HA       ASN  45  -1.709  30.303   7.177
 1234    HB2  ASN  45           HB3      ASN  45  -3.976  29.464   5.348
 1235    HB3  ASN  45           HB2      ASN  45  -3.497  31.119   5.701
 1236   HD21  ASN  45          HD21      ASN  45  -0.615  30.441   5.600
 1237   HD22  ASN  45          HD22      ASN  45  -0.251  30.243   3.920
 1238    H    ASN  46           H        ASN  46  -2.329  28.773   9.265
 1239    HA   ASN  46           HA       ASN  46  -3.547  28.742  11.174
 1240    HB2  ASN  46           HB3      ASN  46  -5.083  31.015   9.895
 1241    HB3  ASN  46           HB2      ASN  46  -5.253  30.502  11.570
 1242   HD21  ASN  46          HD21      ASN  46  -3.581  30.900  13.023
 1243   HD22  ASN  46          HD22      ASN  46  -2.334  32.052  12.690
 1244    H    SER  47           H        SER  47  -4.501  27.489   8.464
 1245    HA   SER  47           HA       SER  47  -7.150  26.702   9.466
 1246    HB2  SER  47           HB3      SER  47  -7.036  27.716   7.149
 1247    HB3  SER  47           HB2      SER  47  -6.071  26.325   6.657
 1248    HG   SER  47           HG       SER  47  -8.291  25.484   7.919
 1249    H    VAL  48           H        VAL  48  -7.165  24.824  10.464
 1250    HA   VAL  48           HA       VAL  48  -4.896  23.022  10.110
 1251    HB   VAL  48           HB       VAL  48  -7.035  23.054  12.244
 1252   HG11  VAL  48          HG11      VAL  48  -6.139  20.823  11.917
 1253   HG12  VAL  48          HG12      VAL  48  -5.570  21.499  13.443
 1254   HG13  VAL  48          HG13      VAL  48  -4.496  21.448  12.046
 1255   HG21  VAL  48          HG21      VAL  48  -4.165  23.972  12.328
 1256   HG22  VAL  48          HG22      VAL  48  -5.272  23.922  13.700
 1257   HG23  VAL  48          HG23      VAL  48  -5.591  25.010  12.351
 1258    H    PHE  49           H        PHE  49  -5.045  21.142   9.124
 1259    HA   PHE  49           HA       PHE  49  -7.693  19.883   8.840
 1260    HB2  PHE  49           HB3      PHE  49  -5.510  20.137   6.765
 1261    HB3  PHE  49           HB2      PHE  49  -6.765  18.907   6.654
 1262    HD1  PHE  49           HD1      PHE  49  -5.943  22.404   6.204
 1263    HD2  PHE  49           HD2      PHE  49  -9.120  19.577   6.367
 1264    HE1  PHE  49           HE1      PHE  49  -7.435  24.019   5.091
 1265    HE2  PHE  49           HE2      PHE  49 -10.614  21.185   5.258
 1266    HZ   PHE  49           HZ       PHE  49  -9.772  23.408   4.620
 1267    H    ARG  50           H        ARG  50  -7.770  17.686   9.178
 1268    HA   ARG  50           HA       ARG  50  -5.322  16.540  10.321
 1269    HB2  ARG  50           HB3      ARG  50  -8.235  15.823  10.686
 1270    HB3  ARG  50           HB2      ARG  50  -6.916  14.848  11.321
 1271    HG2  ARG  50           HG3      ARG  50  -6.141  16.796  12.601
 1272    HG3  ARG  50           HG2      ARG  50  -7.536  17.704  12.029
 1273    HD2  ARG  50           HD3      ARG  50  -9.034  16.166  13.137
 1274    HD3  ARG  50           HD2      ARG  50  -7.675  15.145  13.618
 1275    HE   ARG  50           HE       ARG  50  -7.240  17.747  14.582
 1276   HH11  ARG  50          HH11      ARG  50  -9.360  15.021  15.146
 1277   HH12  ARG  50          HH12      ARG  50  -9.623  15.414  16.813
 1278   HH21  ARG  50          HH21      ARG  50  -7.572  18.263  16.758
 1279   HH22  ARG  50          HH22      ARG  50  -8.606  17.264  17.736
 1280    H    GLN  51           H        GLN  51  -4.296  14.928   9.371
 1281    HA   GLN  51           HA       GLN  51  -5.694  13.509   7.206
 1282    HB2  GLN  51           HB3      GLN  51  -3.326  13.104   6.300
 1283    HB3  GLN  51           HB2      GLN  51  -4.024  14.700   6.094
 1284    HG2  GLN  51           HG3      GLN  51  -2.720  15.525   7.985
 1285    HG3  GLN  51           HG2      GLN  51  -2.025  13.916   8.209
 1286   HE21  GLN  51          HE21      GLN  51  -0.488  13.173   6.768
 1287   HE22  GLN  51          HE22      GLN  51   0.303  14.208   5.626
 1288    H    TYR  52           H        TYR  52  -6.373  11.714   8.169
 1289    HA   TYR  52           HA       TYR  52  -4.794  10.246  10.055
 1290    HB2  TYR  52           HB3      TYR  52  -7.171   9.193   8.500
 1291    HB3  TYR  52           HB2      TYR  52  -6.576   8.639  10.061
 1292    HD1  TYR  52           HD1      TYR  52  -6.528  10.596  11.915
 1293    HD2  TYR  52           HD2      TYR  52  -9.054  10.493   8.495
 1294    HE1  TYR  52           HE1      TYR  52  -8.097  12.119  13.036
 1295    HE2  TYR  52           HE2      TYR  52 -10.630  12.016   9.606
 1296    HH   TYR  52           HH       TYR  52 -11.233  12.667  11.939
 1297    H    PHE  53           H        PHE  53  -3.359   8.660   9.655
 1298    HA   PHE  53           HA       PHE  53  -2.608   8.314   6.873
 1299    HB2  PHE  53           HB3      PHE  53  -1.236   7.377   9.407
 1300    HB3  PHE  53           HB2      PHE  53  -0.555   7.310   7.780
 1301    HD1  PHE  53           HD1      PHE  53  -0.086   9.432   6.572
 1302    HD2  PHE  53           HD2      PHE  53  -1.145   9.348  10.688
 1303    HE1  PHE  53           HE1      PHE  53   0.798  11.709   6.839
 1304    HE2  PHE  53           HE2      PHE  53  -0.263  11.627  10.966
 1305    HZ   PHE  53           HZ       PHE  53   0.706  12.811   9.040
 1306    H    PHE  54           H        PHE  54  -2.965   6.563   5.716
 1307    HA   PHE  54           HA       PHE  54  -4.402   4.340   6.878
 1308    HB2  PHE  54           HB3      PHE  54  -5.012   5.280   4.655
 1309    HB3  PHE  54           HB2      PHE  54  -3.437   4.802   4.036
 1310    HD1  PHE  54           HD1      PHE  54  -3.031   2.583   3.303
 1311    HD2  PHE  54           HD2      PHE  54  -6.660   3.545   5.309
 1312    HE1  PHE  54           HE1      PHE  54  -3.971   0.411   2.635
 1313    HE2  PHE  54           HE2      PHE  54  -7.605   1.374   4.647
 1314    HZ   PHE  54           HZ       PHE  54  -6.261  -0.196   3.308
 1315    H    GLU  55           H        GLU  55  -3.036   3.215   8.154
 1316    HA   GLU  55           HA       GLU  55  -0.517   2.270   6.952
 1317    HB2  GLU  55           HB3      GLU  55  -1.146   2.627   9.896
 1318    HB3  GLU  55           HB2      GLU  55   0.405   2.161   9.207
 1319    HG2  GLU  55           HG3      GLU  55   0.542   4.357   8.091
 1320    HG3  GLU  55           HG2      GLU  55  -0.979   4.818   8.859
 1321    H    THR  56           H        THR  56  -0.466   0.196   6.519
 1322    HA   THR  56           HA       THR  56  -2.421  -1.560   7.801
 1323    HB   THR  56           HB       THR  56  -0.638  -2.144   5.426
 1324    HG1  THR  56           HG1      THR  56  -2.208  -1.364   4.185
 1325   HG21  THR  56          HG21      THR  56  -3.071  -3.565   6.517
 1326   HG22  THR  56          HG22      THR  56  -1.407  -4.150   6.576
 1327   HG23  THR  56          HG23      THR  56  -2.230  -3.982   5.024
 1328    H    LYS  57           H        LYS  57  -1.824  -2.845   9.390
 1329    HA   LYS  57           HA       LYS  57   1.041  -3.319   9.811
 1330    HB2  LYS  57           HB3      LYS  57  -1.296  -3.552  11.720
 1331    HB3  LYS  57           HB2      LYS  57   0.369  -3.941  12.130
 1332    HG2  LYS  57           HG3      LYS  57   1.006  -1.614  11.679
 1333    HG3  LYS  57           HG2      LYS  57  -0.677  -1.233  11.326
 1334    HD2  LYS  57           HD3      LYS  57  -0.182  -0.575  13.586
 1335    HD3  LYS  57           HD2      LYS  57  -1.269  -1.963  13.618
 1336    HE2  LYS  57           HE3      LYS  57   0.688  -3.426  13.983
 1337    HE3  LYS  57           HE2      LYS  57   1.710  -1.993  14.057
 1338    HZ1  LYS  57           HZ1      LYS  57   0.466  -1.237  15.974
 1339    HZ2  LYS  57           HZ2      LYS  57   1.099  -2.780  16.259
 1340    HZ3  LYS  57           HZ3      LYS  57  -0.541  -2.593  15.894
 1341    H    CYS  58           H        CYS  58   1.764  -5.399  10.373
 1342    HA   CYS  58           HA       CYS  58   0.335  -7.461   8.919
 1343    HB2  CYS  58           HB3      CYS  58   2.885  -6.951   8.839
 1344    HB3  CYS  58           HB2      CYS  58   2.952  -7.855  10.345
 1345    H    ARG  59           H        ARG  59  -1.242  -8.439  10.006
 1346    HA   ARG  59           HA       ARG  59  -1.337  -8.634  12.848
 1347    HB2  ARG  59           HB3      ARG  59  -2.981  -9.985  10.705
 1348    HB3  ARG  59           HB2      ARG  59  -3.331 -10.082  12.418
 1349    HG2  ARG  59           HG3      ARG  59  -3.776  -7.722  12.512
 1350    HG3  ARG  59           HG2      ARG  59  -3.280  -7.531  10.830
 1351    HD2  ARG  59           HD3      ARG  59  -5.728  -7.602  11.066
 1352    HD3  ARG  59           HD2      ARG  59  -5.112  -8.932  10.093
 1353    HE   ARG  59           HE       ARG  59  -5.444  -9.576  12.879
 1354   HH11  ARG  59          HH11      ARG  59  -7.016  -9.430   9.753
 1355   HH12  ARG  59          HH12      ARG  59  -8.232 -10.592  10.167
 1356   HH21  ARG  59          HH21      ARG  59  -7.050 -11.109  13.429
 1357   HH22  ARG  59          HH22      ARG  59  -8.248 -11.551  12.253
 1358    H    ALA  60           H        ALA  60  -0.822 -10.980  10.243
 1359    HA   ALA  60           HA       ALA  60   0.554 -12.728  12.145
 1360    HB1  ALA  60           HB1      ALA  60  -1.768 -13.526  12.034
 1361    HB2  ALA  60           HB2      ALA  60  -0.645 -14.696  11.342
 1362    HB3  ALA  60           HB3      ALA  60  -1.624 -13.683  10.284
 1363    H    SER  61           H        SER  61   2.533 -12.864  11.306
 1364    HA   SER  61           HA       SER  61   2.938 -12.626   8.452
 1365    HB2  SER  61           HB3      SER  61   4.921 -12.988  10.711
 1366    HB3  SER  61           HB2      SER  61   5.342 -12.651   9.031
 1367    HG   SER  61           HG       SER  61   3.681 -10.794   9.526
 1368    H    ASN  62           H        ASN  62   2.651 -15.129  10.771
 1369    HA   ASN  62           HA       ASN  62   3.075 -17.089   8.653
 1370    HB2  ASN  62           HB3      ASN  62   4.480 -17.235  11.336
 1371    HB3  ASN  62           HB2      ASN  62   4.342 -18.593  10.225
 1372   HD21  ASN  62          HD21      ASN  62   5.489 -18.524   8.254
 1373   HD22  ASN  62          HD22      ASN  62   6.826 -17.460   8.027
 1374    HA   PRO  63           HA       PRO  63  -0.848 -17.605  11.231
 1375    HB2  PRO  63           HB3      PRO  63  -2.105 -18.619   8.916
 1376    HB3  PRO  63           HB2      PRO  63  -2.332 -17.016   9.622
 1377    HG2  PRO  63           HG3      PRO  63  -0.631 -17.862   7.338
 1378    HG3  PRO  63           HG2      PRO  63  -1.462 -16.322   7.613
 1379    HD2  PRO  63           HD3      PRO  63   1.209 -16.564   7.910
 1380    HD3  PRO  63           HD2      PRO  63   0.245 -15.495   8.962
 1381    H    VAL  64           H        VAL  64   0.730 -19.637   8.785
 1382    HA   VAL  64           HA       VAL  64   0.287 -21.925  10.587
 1383    HB   VAL  64           HB       VAL  64   0.378 -23.425   8.619
 1384   HG11  VAL  64          HG11      VAL  64  -1.868 -22.992   7.806
 1385   HG12  VAL  64          HG12      VAL  64  -1.807 -21.363   8.479
 1386   HG13  VAL  64          HG13      VAL  64  -1.770 -22.763   9.550
 1387   HG21  VAL  64          HG21      VAL  64   0.224 -20.881   7.020
 1388   HG22  VAL  64          HG22      VAL  64   0.064 -22.513   6.375
 1389   HG23  VAL  64          HG23      VAL  64   1.592 -21.992   7.080
 1390    H    GLU  65           H        GLU  65   1.989 -23.749   9.871
 1391    HA   GLU  65           HA       GLU  65   4.485 -22.750  10.670
 1392    HB2  GLU  65           HB3      GLU  65   3.781 -25.068  11.050
 1393    HB3  GLU  65           HB2      GLU  65   3.839 -25.375   9.321
 1394    HG2  GLU  65           HG3      GLU  65   6.250 -24.897   9.344
 1395    HG3  GLU  65           HG2      GLU  65   6.166 -24.678  11.091
 1396    H    SER  66           H        SER  66   3.367 -23.806   7.461
 1397    HA   SER  66           HA       SER  66   5.865 -23.303   6.192
 1398    HB2  SER  66           HB3      SER  66   4.433 -23.512   4.075
 1399    HB3  SER  66           HB2      SER  66   4.466 -24.908   5.153
 1400    HG   SER  66           HG       SER  66   2.426 -24.611   5.633
 1401    H    GLY  67           H        GLY  67   3.456 -21.237   7.285
 1402    HA2  GLY  67           HA3      GLY  67   4.108 -18.838   7.115
 1403    HA3  GLY  67           HA2      GLY  67   4.288 -19.134   5.389
 1404    H    CYS  68           H        CYS  68   2.512 -19.157   4.082
 1405    HA   CYS  68           HA       CYS  68   0.050 -18.170   5.335
 1406    HB2  CYS  68           HB3      CYS  68   0.988 -18.107   2.452
 1407    HB3  CYS  68           HB2      CYS  68  -0.566 -17.477   3.010
 1408    H    ARG  69           H        ARG  69  -1.873 -19.243   5.193
 1409    HA   ARG  69           HA       ARG  69  -1.758 -22.056   4.805
 1410    HB2  ARG  69           HB3      ARG  69  -3.331 -20.485   6.294
 1411    HB3  ARG  69           HB2      ARG  69  -4.383 -20.630   4.896
 1412    HG2  ARG  69           HG3      ARG  69  -3.369 -22.871   6.635
 1413    HG3  ARG  69           HG2      ARG  69  -5.007 -22.244   6.549
 1414    HD2  ARG  69           HD3      ARG  69  -5.198 -24.128   5.256
 1415    HD3  ARG  69           HD2      ARG  69  -4.815 -22.919   4.027
 1416    HE   ARG  69           HE       ARG  69  -2.432 -24.097   4.991
 1417   HH11  ARG  69          HH11      ARG  69  -5.231 -24.896   3.047
 1418   HH12  ARG  69          HH12      ARG  69  -4.381 -26.048   2.069
 1419   HH21  ARG  69          HH21      ARG  69  -1.310 -25.614   3.695
 1420   HH22  ARG  69          HH22      ARG  69  -2.151 -26.447   2.427
 1421    H    GLY  70           H        GLY  70  -1.482 -22.807   2.789
 1422    HA2  GLY  70           HA3      GLY  70  -3.195 -23.394   0.948
 1423    HA3  GLY  70           HA2      GLY  70  -3.118 -21.665   0.625
 1424    H    ILE  71           H        ILE  71  -0.306 -21.479   1.278
 1425    HA   ILE  71           HA       ILE  71   0.779 -21.860  -1.287
 1426    HB   ILE  71           HB       ILE  71   2.187 -21.404   1.349
 1427   HG12  ILE  71          HG13      ILE  71   0.616 -19.622   0.854
 1428   HG13  ILE  71          HG12      ILE  71   2.257 -19.037   0.613
 1429   HG21  ILE  71          HG21      ILE  71   4.061 -20.572   0.012
 1430   HG22  ILE  71          HG22      ILE  71   3.216 -21.043  -1.462
 1431   HG23  ILE  71          HG23      ILE  71   3.733 -22.275  -0.310
 1432   HD11  ILE  71          HD11      ILE  71   0.295 -19.839  -1.522
 1433   HD12  ILE  71          HD12      ILE  71   1.973 -19.388  -1.820
 1434   HD13  ILE  71          HD13      ILE  71   0.850 -18.209  -1.141
 1435    H    ASP  72           H        ASP  72   2.070 -23.409  -2.149
 1436    HA   ASP  72           HA       ASP  72   2.001 -26.037  -1.078
 1437    HB2  ASP  72           HB3      ASP  72   2.109 -25.465  -3.522
 1438    HB3  ASP  72           HB2      ASP  72   3.786 -24.977  -3.286
 1439    H    SER  73           H        SER  73   3.134 -26.593   0.654
 1440    HA   SER  73           HA       SER  73   5.350 -25.042   1.562
 1441    HB2  SER  73           HB3      SER  73   5.318 -26.861   3.402
 1442    HB3  SER  73           HB2      SER  73   3.910 -25.805   3.254
 1443    HG   SER  73           HG       SER  73   3.228 -27.943   3.411
 1444    H    LYS  74           H        LYS  74   5.147 -27.693  -0.524
 1445    HA   LYS  74           HA       LYS  74   7.694 -28.827   0.290
 1446    HB2  LYS  74           HB3      LYS  74   5.844 -30.307  -0.381
 1447    HB3  LYS  74           HB2      LYS  74   5.850 -29.583  -1.979
 1448    HG2  LYS  74           HG3      LYS  74   7.961 -30.512  -2.496
 1449    HG3  LYS  74           HG2      LYS  74   8.235 -30.994  -0.819
 1450    HD2  LYS  74           HD3      LYS  74   7.594 -32.905  -2.199
 1451    HD3  LYS  74           HD2      LYS  74   6.380 -32.569  -0.966
 1452    HE2  LYS  74           HE3      LYS  74   5.022 -31.403  -2.617
 1453    HE3  LYS  74           HE2      LYS  74   6.231 -31.733  -3.854
 1454    HZ1  LYS  74           HZ1      LYS  74   4.427 -33.306  -3.988
 1455    HZ2  LYS  74           HZ2      LYS  74   4.641 -33.759  -2.375
 1456    HZ3  LYS  74           HZ3      LYS  74   5.839 -34.109  -3.514
 1457    H    HIS  75           H        HIS  75   6.325 -26.891  -2.288
 1458    HA   HIS  75           HA       HIS  75   8.909 -26.851  -3.668
 1459    HB2  HIS  75           HB3      HIS  75   6.196 -25.790  -4.494
 1460    HB3  HIS  75           HB2      HIS  75   7.655 -25.648  -5.466
 1461    HD1  HIS  75           HD1      HIS  75   5.109 -28.133  -4.291
 1462    HD2  HIS  75           HD2      HIS  75   8.437 -27.989  -6.788
 1463    HE1  HIS  75           HE1      HIS  75   5.061 -30.272  -5.623
 1464    HE2  HIS  75           HE2      HIS  75   7.025 -30.118  -7.192
 1465    H    TRP  76           H        TRP  76   6.799 -24.820  -1.767
 1466    HA   TRP  76           HA       TRP  76   8.676 -22.588  -2.157
 1467    HB2  TRP  76           HB3      TRP  76   5.657 -22.466  -2.026
 1468    HB3  TRP  76           HB2      TRP  76   6.698 -21.051  -1.886
 1469    HD1  TRP  76           HD1      TRP  76   5.012 -23.232  -4.397
 1470    HE1  TRP  76           HE1      TRP  76   5.624 -22.465  -6.772
 1471    HE3  TRP  76           HE3      TRP  76   8.849 -20.041  -3.265
 1472    HZ2  TRP  76           HZ2      TRP  76   7.481 -20.736  -8.006
 1473    HZ3  TRP  76           HZ3      TRP  76   9.988 -18.870  -5.101
 1474    HH2  TRP  76           HH2      TRP  76   9.317 -19.212  -7.425
 1475    H    ASN  77           H        ASN  77   8.894 -21.149  -0.442
 1476    HA   ASN  77           HA       ASN  77   7.672 -21.928   2.127
 1477    HB2  ASN  77           HB3      ASN  77  10.149 -22.215   2.132
 1478    HB3  ASN  77           HB2      ASN  77  10.329 -20.527   1.685
 1479   HD21  ASN  77          HD21      ASN  77   8.001 -21.854   3.970
 1480   HD22  ASN  77          HD22      ASN  77   8.641 -21.044   5.359
 1481    H    SER  78           H        SER  78   6.559 -20.300   3.186
 1482    HA   SER  78           HA       SER  78   6.550 -17.707   1.803
 1483    HB2  SER  78           HB3      SER  78   4.094 -17.597   2.520
 1484    HB3  SER  78           HB2      SER  78   4.496 -18.716   1.219
 1485    HG   SER  78           HG       SER  78   4.729 -19.918   3.635
 1486    H    TYR  79           H        TYR  79   6.694 -15.912   2.976
 1487    HA   TYR  79           HA       TYR  79   5.877 -15.868   5.734
 1488    HB2  TYR  79           HB3      TYR  79   8.015 -14.967   6.597
 1489    HB3  TYR  79           HB2      TYR  79   8.181 -16.626   6.027
 1490    HD1  TYR  79           HD1      TYR  79   9.195 -13.153   5.529
 1491    HD2  TYR  79           HD2      TYR  79   9.445 -17.112   3.986
 1492    HE1  TYR  79           HE1      TYR  79  11.125 -12.489   4.151
 1493    HE2  TYR  79           HE2      TYR  79  11.369 -16.458   2.605
 1494    HH   TYR  79           HH       TYR  79  13.103 -13.637   3.081
 1495    H    CYS  80           H        CYS  80   6.001 -13.587   6.580
 1496    HA   CYS  80           HA       CYS  80   5.089 -11.933   4.344
 1497    HB2  CYS  80           HB3      CYS  80   4.434 -11.806   7.288
 1498    HB3  CYS  80           HB2      CYS  80   3.790 -10.709   6.064
 1499    H    THR  81           H        THR  81   5.723  -9.907   3.993
 1500    HA   THR  81           HA       THR  81   7.315  -8.500   5.996
 1501    HB   THR  81           HB       THR  81   9.061  -9.471   4.621
 1502    HG1  THR  81           HG1      THR  81   9.115  -6.986   3.428
 1503   HG21  THR  81          HG21      THR  81   7.620  -8.280   2.253
 1504   HG22  THR  81          HG22      THR  81   7.769  -9.997   2.627
 1505   HG23  THR  81          HG23      THR  81   9.201  -9.059   2.205
 1506    H    THR  82           H        THR  82   6.994  -6.248   5.901
 1507    HA   THR  82           HA       THR  82   4.584  -5.557   4.459
 1508    HB   THR  82           HB       THR  82   4.802  -3.375   5.750
 1509    HG1  THR  82           HG1      THR  82   6.585  -3.091   6.813
 1510   HG21  THR  82          HG21      THR  82   3.298  -5.160   6.453
 1511   HG22  THR  82          HG22      THR  82   4.037  -4.383   7.852
 1512   HG23  THR  82          HG23      THR  82   4.619  -5.956   7.306
 1513    H    THR  83           H        THR  83   4.423  -4.287   2.735
 1514    HA   THR  83           HA       THR  83   6.847  -3.021   1.703
 1515    HB   THR  83           HB       THR  83   5.522  -4.352   0.105
 1516    HG1  THR  83           HG1      THR  83   6.356  -2.932  -1.208
 1517   HG21  THR  83          HG21      THR  83   3.334  -3.474  -0.681
 1518   HG22  THR  83          HG22      THR  83   3.344  -2.346   0.677
 1519   HG23  THR  83          HG23      THR  83   3.296  -4.085   0.974
 1520    H    HIS  84           H        HIS  84   6.828  -0.739   1.160
 1521    HA   HIS  84           HA       HIS  84   4.980   0.751   2.889
 1522    HB2  HIS  84           HB3      HIS  84   6.920   2.041   3.798
 1523    HB3  HIS  84           HB2      HIS  84   6.916   0.345   4.272
 1524    HD1  HIS  84           HD1      HIS  84   8.917   2.881   2.468
 1525    HD2  HIS  84           HD2      HIS  84   8.931  -1.234   3.009
 1526    HE1  HIS  84           HE1      HIS  84  11.181   2.110   1.706
 1527    HE2  HIS  84           HE2      HIS  84  11.107  -0.398   1.898
 1528    H    THR  85           H        THR  85   4.700   2.917   2.442
 1529    HA   THR  85           HA       THR  85   5.960   3.922  -0.024
 1530    HB   THR  85           HB       THR  85   3.550   3.381  -0.395
 1531    HG1  THR  85           HG1      THR  85   3.211   5.241  -1.501
 1532   HG21  THR  85          HG21      THR  85   2.703   3.787   1.855
 1533   HG22  THR  85          HG22      THR  85   1.834   4.775   0.682
 1534   HG23  THR  85          HG23      THR  85   3.074   5.504   1.702
 1535    H    PHE  86           H        PHE  86   5.504   6.481  -0.021
 1536    HA   PHE  86           HA       PHE  86   6.237   7.457   2.658
 1537    HB2  PHE  86           HB3      PHE  86   7.482   8.386   0.052
 1538    HB3  PHE  86           HB2      PHE  86   7.902   8.944   1.672
 1539    HD1  PHE  86           HD1      PHE  86   8.909   7.262   3.288
 1540    HD2  PHE  86           HD2      PHE  86   8.542   6.540  -0.890
 1541    HE1  PHE  86           HE1      PHE  86  10.627   5.505   3.444
 1542    HE2  PHE  86           HE2      PHE  86  10.255   4.782  -0.742
 1543    HZ   PHE  86           HZ       PHE  86  11.299   4.262   1.424
 1544    H    VAL  87           H        VAL  87   4.839   8.921   3.329
 1545    HA   VAL  87           HA       VAL  87   3.408  10.539   1.315
 1546    HB   VAL  87           HB       VAL  87   1.557  10.704   2.997
 1547   HG11  VAL  87          HG11      VAL  87   1.372   9.148   1.155
 1548   HG12  VAL  87          HG12      VAL  87   0.680   8.435   2.614
 1549   HG13  VAL  87          HG13      VAL  87   2.277   7.933   2.059
 1550   HG21  VAL  87          HG21      VAL  87   2.821  10.183   5.011
 1551   HG22  VAL  87          HG22      VAL  87   3.111   8.545   4.421
 1552   HG23  VAL  87          HG23      VAL  87   1.472   9.064   4.813
 1553    H    LYS  88           H        LYS  88   3.261  12.762   1.664
 1554    HA   LYS  88           HA       LYS  88   5.169  13.786   3.573
 1555    HB2  LYS  88           HB3      LYS  88   4.863  15.957   2.567
 1556    HB3  LYS  88           HB2      LYS  88   5.064  14.758   1.301
 1557    HG2  LYS  88           HG3      LYS  88   2.840  14.922   0.633
 1558    HG3  LYS  88           HG2      LYS  88   2.340  15.658   2.154
 1559    HD2  LYS  88           HD3      LYS  88   3.607  17.667   1.606
 1560    HD3  LYS  88           HD2      LYS  88   4.123  16.939   0.087
 1561    HE2  LYS  88           HE3      LYS  88   1.269  17.513   0.866
 1562    HE3  LYS  88           HE2      LYS  88   2.252  18.522  -0.194
 1563    HZ1  LYS  88           HZ1      LYS  88   0.834  17.074  -1.484
 1564    HZ2  LYS  88           HZ2      LYS  88   1.456  15.709  -0.703
 1565    HZ3  LYS  88           HZ3      LYS  88   2.457  16.635  -1.707
 1566    H    ALA  89           H        ALA  89   4.754  14.419   5.499
 1567    HA   ALA  89           HA       ALA  89   2.053  15.366   6.191
 1568    HB1  ALA  89           HB1      ALA  89   2.375  13.092   7.067
 1569    HB2  ALA  89           HB2      ALA  89   2.260  14.276   8.368
 1570    HB3  ALA  89           HB3      ALA  89   3.832  13.624   7.905
 1571    H    LEU  90           H        LEU  90   2.031  16.921   7.929
 1572    HA   LEU  90           HA       LEU  90   4.347  18.605   7.984
 1573    HB2  LEU  90           HB3      LEU  90   1.982  19.452   8.146
 1574    HB3  LEU  90           HB2      LEU  90   1.892  18.728   9.747
 1575    HG   LEU  90           HG       LEU  90   3.863  20.203  10.385
 1576   HD11  LEU  90          HD11      LEU  90   4.156  22.232   9.023
 1577   HD12  LEU  90          HD12      LEU  90   3.107  21.535   7.790
 1578   HD13  LEU  90          HD13      LEU  90   4.649  20.769   8.172
 1579   HD21  LEU  90          HD21      LEU  90   2.443  22.155  10.760
 1580   HD22  LEU  90          HD22      LEU  90   1.577  20.658  11.107
 1581   HD23  LEU  90          HD23      LEU  90   1.269  21.528   9.604
 1582    H    THR  91           H        THR  91   6.079  17.860   9.032
 1583    HA   THR  91           HA       THR  91   5.664  16.665  11.693
 1584    HB   THR  91           HB       THR  91   7.447  15.087  11.300
 1585    HG1  THR  91           HG1      THR  91   7.905  16.734   9.104
 1586   HG21  THR  91          HG21      THR  91   5.635  15.104   8.882
 1587   HG22  THR  91          HG22      THR  91   5.231  14.414  10.449
 1588   HG23  THR  91          HG23      THR  91   6.538  13.719   9.496
 1589    H    THR  92           H        THR  92   7.488  16.922  13.155
 1590    HA   THR  92           HA       THR  92   9.336  19.048  12.334
 1591    HB   THR  92           HB       THR  92   7.625  20.030  13.804
 1592    HG1  THR  92           HG1      THR  92   9.824  20.770  13.895
 1593   HG21  THR  92          HG21      THR  92   8.625  18.068  15.872
 1594   HG22  THR  92          HG22      THR  92   7.033  18.052  15.113
 1595   HG23  THR  92          HG23      THR  92   7.495  19.389  16.165
 1596    H    ASP  93           H        ASP  93  11.423  18.720  12.814
 1597    HA   ASP  93           HA       ASP  93  12.123  16.190  14.090
 1598    HB2  ASP  93           HB3      ASP  93  14.351  16.540  13.153
 1599    HB3  ASP  93           HB2      ASP  93  13.134  16.748  11.897
 1600    H    GLU  94           H        GLU  94  11.724  19.371  14.970
 1601    HA   GLU  94           HA       GLU  94  13.026  18.961  17.489
 1602    HB2  GLU  94           HB3      GLU  94  14.900  19.686  16.005
 1603    HB3  GLU  94           HB2      GLU  94  14.049  21.193  15.730
 1604    HG2  GLU  94           HG3      GLU  94  15.715  21.572  17.367
 1605    HG3  GLU  94           HG2      GLU  94  14.148  21.633  18.161
 1606    H    LYS  95           H        LYS  95  12.434  22.062  15.835
 1607    HA   LYS  95           HA       LYS  95   9.965  22.385  17.380
 1608    HB2  LYS  95           HB3      LYS  95  12.236  24.379  17.356
 1609    HB3  LYS  95           HB2      LYS  95  10.630  24.705  17.991
 1610    HG2  LYS  95           HG3      LYS  95  10.977  22.828  19.603
 1611    HG3  LYS  95           HG2      LYS  95  12.643  22.737  19.036
 1612    HD2  LYS  95           HD3      LYS  95  12.914  25.133  19.650
 1613    HD3  LYS  95           HD2      LYS  95  11.303  25.081  20.370
 1614    HE2  LYS  95           HE3      LYS  95  13.678  23.405  21.172
 1615    HE3  LYS  95           HE2      LYS  95  13.027  24.777  22.066
 1616    HZ1  LYS  95           HZ1      LYS  95  10.946  23.532  22.327
 1617    HZ2  LYS  95           HZ2      LYS  95  12.258  22.724  23.023
 1618    HZ3  LYS  95           HZ3      LYS  95  11.640  22.203  21.541
 1619    H    GLN  96           H        GLN  96  11.194  22.321  14.422
 1620    HA   GLN  96           HA       GLN  96   9.451  24.491  13.461
 1621    HB2  GLN  96           HB3      GLN  96  11.975  23.371  12.232
 1622    HB3  GLN  96           HB2      GLN  96  10.876  24.443  11.378
 1623    HG2  GLN  96           HG3      GLN  96  12.291  25.135  13.941
 1624    HG3  GLN  96           HG2      GLN  96  12.850  25.583  12.331
 1625   HE21  GLN  96          HE21      GLN  96  10.482  26.151  14.811
 1626   HE22  GLN  96          HE22      GLN  96   9.842  27.609  14.145
 1627    H    ALA  97           H        ALA  97   7.739  23.882  12.338
 1628    HA   ALA  97           HA       ALA  97   7.421  21.065  11.682
 1629    HB1  ALA  97           HB1      ALA  97   5.086  21.631  11.267
 1630    HB2  ALA  97           HB2      ALA  97   5.450  23.342  11.485
 1631    HB3  ALA  97           HB3      ALA  97   5.609  22.225  12.842
 1632    H    ALA  98           H        ALA  98   7.527  20.235   9.692
 1633    HA   ALA  98           HA       ALA  98   7.199  21.941   7.358
 1634    HB1  ALA  98           HB1      ALA  98   9.591  22.099   7.868
 1635    HB2  ALA  98           HB2      ALA  98   9.313  21.232   6.358
 1636    HB3  ALA  98           HB3      ALA  98   9.715  20.341   7.826
 1637    H    TRP  99           H        TRP  99   6.838  20.744   5.421
 1638    HA   TRP  99           HA       TRP  99   5.466  18.263   5.891
 1639    HB2  TRP  99           HB3      TRP  99   6.010  19.815   3.351
 1640    HB3  TRP  99           HB2      TRP  99   5.031  18.357   3.421
 1641    HD1  TRP  99           HD1      TRP  99   5.010  22.006   4.646
 1642    HE1  TRP  99           HE1      TRP  99   2.573  22.694   5.101
 1643    HE3  TRP  99           HE3      TRP  99   2.746  17.490   3.897
 1644    HZ2  TRP  99           HZ2      TRP  99   0.028  21.483   5.127
 1645    HZ3  TRP  99           HZ3      TRP  99   0.300  17.339   4.151
 1646    HH2  TRP  99           HH2      TRP  99  -1.027  19.297   4.754
 1647    H    ARG 100           H        ARG 100   6.727  16.564   6.312
 1648    HA   ARG 100           HA       ARG 100   8.994  16.033   4.493
 1649    HB2  ARG 100           HB3      ARG 100   8.563  14.893   7.265
 1650    HB3  ARG 100           HB2      ARG 100  10.001  14.727   6.272
 1651    HG2  ARG 100           HG3      ARG 100   8.990  17.325   7.410
 1652    HG3  ARG 100           HG2      ARG 100  10.245  16.325   8.135
 1653    HD2  ARG 100           HD3      ARG 100  11.601  16.602   6.086
 1654    HD3  ARG 100           HD2      ARG 100  10.358  17.674   5.440
 1655    HE   ARG 100           HE       ARG 100  11.248  18.525   8.008
 1656   HH11  ARG 100          HH11      ARG 100  12.130  18.518   4.625
 1657   HH12  ARG 100          HH12      ARG 100  13.083  19.962   4.738
 1658   HH21  ARG 100          HH21      ARG 100  12.500  20.420   8.169
 1659   HH22  ARG 100          HH22      ARG 100  13.293  21.046   6.759
 1660    H    PHE 101           H        PHE 101   9.312  13.824   3.847
 1661    HA   PHE 101           HA       PHE 101   6.768  12.434   3.533
 1662    HB2  PHE 101           HB3      PHE 101   9.465  12.066   2.213
 1663    HB3  PHE 101           HB2      PHE 101   8.131  10.947   1.977
 1664    HD1  PHE 101           HD1      PHE 101   9.200  14.460   1.466
 1665    HD2  PHE 101           HD2      PHE 101   6.384  11.417   0.491
 1666    HE1  PHE 101           HE1      PHE 101   8.313  15.862  -0.347
 1667    HE2  PHE 101           HE2      PHE 101   5.493  12.819  -1.321
 1668    HZ   PHE 101           HZ       PHE 101   6.457  15.043  -1.743
 1669    H    ILE 102           H        ILE 102   6.204  10.911   4.900
 1670    HA   ILE 102           HA       ILE 102   8.330   9.463   6.338
 1671    HB   ILE 102           HB       ILE 102   6.615   8.998   8.091
 1672   HG12  ILE 102          HG13      ILE 102   4.977  11.096   6.659
 1673   HG13  ILE 102          HG12      ILE 102   4.628   9.374   6.622
 1674   HG21  ILE 102          HG21      ILE 102   7.189  11.905   7.544
 1675   HG22  ILE 102          HG22      ILE 102   8.233  10.770   8.403
 1676   HG23  ILE 102          HG23      ILE 102   6.679  11.237   9.094
 1677   HD11  ILE 102          HD11      ILE 102   4.311   9.405   9.051
 1678   HD12  ILE 102          HD12      ILE 102   3.210  10.502   8.216
 1679   HD13  ILE 102          HD13      ILE 102   4.624  11.141   9.057
 1680    H    ARG 103           H        ARG 103   8.018   7.243   6.733
 1681    HA   ARG 103           HA       ARG 103   6.766   5.991   4.429
 1682    HB2  ARG 103           HB3      ARG 103   8.051   4.011   5.038
 1683    HB3  ARG 103           HB2      ARG 103   9.094   5.425   5.003
 1684    HG2  ARG 103           HG3      ARG 103   8.827   5.552   7.499
 1685    HG3  ARG 103           HG2      ARG 103   8.035   3.979   7.411
 1686    HD2  ARG 103           HD3      ARG 103  10.367   3.665   7.936
 1687    HD3  ARG 103           HD2      ARG 103  10.049   3.071   6.307
 1688    HE   ARG 103           HE       ARG 103  11.064   5.794   6.586
 1689   HH11  ARG 103          HH11      ARG 103  11.667   2.447   5.753
 1690   HH12  ARG 103          HH12      ARG 103  13.150   2.794   4.916
 1691   HH21  ARG 103          HH21      ARG 103  13.013   6.252   5.496
 1692   HH22  ARG 103          HH22      ARG 103  13.914   4.961   4.764
 1693    H    ILE 104           H        ILE 104   4.989   4.833   4.464
 1694    HA   ILE 104           HA       ILE 104   4.065   3.726   7.025
 1695    HB   ILE 104           HB       ILE 104   1.710   4.054   6.246
 1696   HG12  ILE 104          HG13      ILE 104   2.962   5.915   4.219
 1697   HG13  ILE 104          HG12      ILE 104   2.261   4.347   3.839
 1698   HG21  ILE 104          HG21      ILE 104   3.346   6.556   6.623
 1699   HG22  ILE 104          HG22      ILE 104   2.663   5.547   7.899
 1700   HG23  ILE 104          HG23      ILE 104   1.596   6.443   6.818
 1701   HD11  ILE 104          HD11      ILE 104   0.774   6.680   5.015
 1702   HD12  ILE 104          HD12      ILE 104   0.082   5.125   4.553
 1703   HD13  ILE 104          HD13      ILE 104   0.753   6.194   3.320
 1704    H    ASP 105           H        ASP 105   3.247   1.661   6.929
 1705    HA   ASP 105           HA       ASP 105   4.017   0.151   4.588
 1706    HB2  ASP 105           HB3      ASP 105   2.720  -0.767   7.172
 1707    HB3  ASP 105           HB2      ASP 105   3.327  -1.834   5.906
 1708    H    THR 106           H        THR 106   2.726  -0.509   2.996
 1709    HA   THR 106           HA       THR 106  -0.052   0.356   3.107
 1710    HB   THR 106           HB       THR 106   0.035  -0.360   0.626
 1711    HG1  THR 106           HG1      THR 106   2.035  -0.693  -0.223
 1712   HG21  THR 106          HG21      THR 106   1.771   1.899   1.630
 1713   HG22  THR 106          HG22      THR 106   0.034   1.972   1.333
 1714   HG23  THR 106          HG23      THR 106   1.152   1.740  -0.012
 1715    H    ALA 107           H        ALA 107   1.832  -2.576   3.014
 1716    HA   ALA 107           HA       ALA 107  -0.397  -4.178   3.753
 1717    HB1  ALA 107           HB1      ALA 107  -0.498  -5.623   1.794
 1718    HB2  ALA 107           HB2      ALA 107   0.688  -4.610   0.971
 1719    HB3  ALA 107           HB3      ALA 107  -0.905  -3.962   1.364
 1720    H    CYS 108           H        CYS 108   0.206  -6.299   4.351
 1721    HA   CYS 108           HA       CYS 108   3.103  -6.738   4.509
 1722    HB2  CYS 108           HB3      CYS 108   1.651  -6.864   6.617
 1723    HB3  CYS 108           HB2      CYS 108   0.946  -8.328   5.927
 1724    H    VAL 109           H        VAL 109   3.874  -7.857   2.826
 1725    HA   VAL 109           HA       VAL 109   1.986  -9.430   1.270
 1726    HB   VAL 109           HB       VAL 109   3.648  -9.453  -0.500
 1727   HG11  VAL 109          HG11      VAL 109   3.336  -6.721   0.738
 1728   HG12  VAL 109          HG12      VAL 109   2.205  -7.515  -0.361
 1729   HG13  VAL 109          HG13      VAL 109   3.805  -7.040  -0.931
 1730   HG21  VAL 109          HG21      VAL 109   5.463  -8.011   1.434
 1731   HG22  VAL 109          HG22      VAL 109   5.792  -8.289  -0.277
 1732   HG23  VAL 109          HG23      VAL 109   5.678  -9.656   0.833
 1733    H    CYS 110           H        CYS 110   2.180 -11.545   0.798
 1734    HA   CYS 110           HA       CYS 110   3.864 -13.152   2.553
 1735    HB2  CYS 110           HB3      CYS 110   1.405 -13.642   2.281
 1736    HB3  CYS 110           HB2      CYS 110   1.723 -14.051   0.604
 1737    H    VAL 111           H        VAL 111   5.886 -13.267   1.736
 1738    HA   VAL 111           HA       VAL 111   6.275 -13.328  -1.139
 1739    HB   VAL 111           HB       VAL 111   8.639 -13.116  -0.691
 1740   HG11  VAL 111          HG11      VAL 111   7.024 -11.331   1.120
 1741   HG12  VAL 111          HG12      VAL 111   7.357 -11.067  -0.590
 1742   HG13  VAL 111          HG13      VAL 111   8.672 -11.016   0.581
 1743   HG21  VAL 111          HG21      VAL 111   8.803 -14.627   1.212
 1744   HG22  VAL 111          HG22      VAL 111   7.969 -13.449   2.225
 1745   HG23  VAL 111          HG23      VAL 111   9.557 -13.072   1.560
 1746    H    LEU 112           H        LEU 112   7.467 -14.964  -2.222
 1747    HA   LEU 112           HA       LEU 112   7.320 -17.569  -0.870
 1748    HB2  LEU 112           HB3      LEU 112   7.238 -16.927  -3.824
 1749    HB3  LEU 112           HB2      LEU 112   7.229 -18.546  -3.152
 1750    HG   LEU 112           HG       LEU 112   5.055 -16.467  -2.827
 1751   HD11  LEU 112          HD11      LEU 112   5.126 -17.474  -5.045
 1752   HD12  LEU 112          HD12      LEU 112   3.716 -18.029  -4.144
 1753   HD13  LEU 112          HD13      LEU 112   5.117 -19.085  -4.326
 1754   HD21  LEU 112          HD21      LEU 112   5.239 -19.280  -1.754
 1755   HD22  LEU 112          HD22      LEU 112   3.794 -18.272  -1.724
 1756   HD23  LEU 112          HD23      LEU 112   5.220 -17.791  -0.809
 1757    H    SER 113           H        SER 113   9.086 -18.785  -0.713
 1758    HA   SER 113           HA       SER 113  11.505 -17.960  -2.172
 1759    HB2  SER 113           HB3      SER 113  11.376 -19.073   0.643
 1760    HB3  SER 113           HB2      SER 113  12.832 -18.570  -0.215
 1761    HG   SER 113           HG       SER 113  11.198 -16.526  -0.308
 1762    H    ARG 114           H        ARG 114  12.998 -19.709  -2.598
 1763    HA   ARG 114           HA       ARG 114  11.579 -22.050  -3.479
 1764    HB2  ARG 114           HB3      ARG 114  14.491 -21.270  -3.696
 1765    HB3  ARG 114           HB2      ARG 114  13.807 -22.724  -4.408
 1766    HG2  ARG 114           HG3      ARG 114  13.029 -19.892  -5.077
 1767    HG3  ARG 114           HG2      ARG 114  14.031 -20.960  -6.063
 1768    HD2  ARG 114           HD3      ARG 114  11.136 -21.398  -5.326
 1769    HD3  ARG 114           HD2      ARG 114  11.745 -20.898  -6.900
 1770    HE   ARG 114           HE       ARG 114  13.038 -23.239  -6.419
 1771   HH11  ARG 114          HH11      ARG 114   9.666 -22.298  -6.454
 1772   HH12  ARG 114          HH12      ARG 114   9.107 -23.858  -6.964
 1773   HH21  ARG 114          HH21      ARG 114  12.296 -25.296  -7.079
 1774   HH22  ARG 114          HH22      ARG 114  10.598 -25.553  -7.324
 1775    H    LYS 115           H        LYS 115  12.416 -21.387  -0.531
 1776    HA   LYS 115           HA       LYS 115  12.779 -22.572   1.366
 1777    HB2  LYS 115           HB3      LYS 115  12.776 -25.012  -0.438
 1778    HB3  LYS 115           HB2      LYS 115  12.728 -25.050   1.318
 1779    HG2  LYS 115           HG3      LYS 115  10.564 -23.885   1.265
 1780    HG3  LYS 115           HG2      LYS 115  10.625 -23.892  -0.501
 1781    HD2  LYS 115           HD3      LYS 115   9.232 -25.707   0.256
 1782    HD3  LYS 115           HD2      LYS 115  10.708 -26.355  -0.460
 1783    HE2  LYS 115           HE3      LYS 115  11.652 -26.710   1.735
 1784    HE3  LYS 115           HE2      LYS 115  10.237 -25.982   2.494
 1785    HZ1  LYS 115           HZ1      LYS 115  10.126 -28.388   2.559
 1786    HZ2  LYS 115           HZ2      LYS 115  10.251 -28.474   0.876
 1787    HZ3  LYS 115           HZ3      LYS 115   8.885 -27.771   1.590
 1788    H    ALA 116           H        ALA 116  14.825 -21.411  -0.179
 1789    HA   ALA 116           HA       ALA 116  17.129 -22.641   1.037
 1790    HB1  ALA 116           HB1      ALA 116  16.989 -23.878  -1.079
 1791    HB2  ALA 116           HB2      ALA 116  18.413 -22.839  -1.032
 1792    HB3  ALA 116           HB3      ALA 116  16.999 -22.356  -1.968
 1793    H    THR 117           H        THR 117  18.807 -21.149   1.291
 1794    HA   THR 117           HA       THR 117  18.061 -18.388   0.632
 1795    HB   THR 117           HB       THR 117  19.685 -17.750   2.413
 1796    HG1  THR 117           HG1      THR 117  20.013 -19.837   3.832
 1797   HG21  THR 117          HG21      THR 117  17.302 -17.969   2.939
 1798   HG22  THR 117          HG22      THR 117  18.298 -18.473   4.304
 1799   HG23  THR 117          HG23      THR 117  17.530 -19.684   3.280
 1800    H    ARG 118           H        ARG 118  20.152 -16.938   0.475
 1801    HA   ARG 118           HA       ARG 118  22.055 -18.309  -1.283
 1802    HB2  ARG 118           HB3      ARG 118  22.151 -15.981  -2.478
 1803    HB3  ARG 118           HB2      ARG 118  20.897 -17.130  -2.881
 1804    HG2  ARG 118           HG3      ARG 118  19.857 -15.029  -2.755
 1805    HG3  ARG 118           HG2      ARG 118  19.388 -15.896  -1.296
 1806    HD2  ARG 118           HD3      ARG 118  21.789 -14.172  -1.112
 1807    HD3  ARG 118           HD2      ARG 118  20.241 -13.353  -1.294
 1808    HE   ARG 118           HE       ARG 118  19.650 -14.949   0.712
 1809   HH11  ARG 118          HH11      ARG 118  22.597 -13.148   0.178
 1810   HH12  ARG 118          HH12      ARG 118  22.911 -12.910   1.866
 1811   HH21  ARG 118          HH21      ARG 118  20.059 -14.634   2.946
 1812   HH22  ARG 118          HH22      ARG 118  21.473 -13.760   3.436
  Start of MODEL   19
    1    H1   SER   1           H1       SER   1  27.182  -5.063  -3.649
    2    H2   SER   1           H2       SER   1  25.663  -4.936  -4.378
    3    H3   SER   1           H3       SER   1  26.652  -6.261  -4.718
    4    HA   SER   1           HA       SER   1  24.864  -6.838  -3.211
    5    HB2  SER   1           HB3      SER   1  27.601  -6.886  -1.920
    6    HB3  SER   1           HB2      SER   1  26.265  -7.984  -1.578
    7    HG   SER   1           HG       SER   1  28.063  -8.543  -3.205
    8    H    SER   2           H        SER   2  23.913  -6.637  -1.175
    9    HA   SER   2           HA       SER   2  23.090  -5.687   0.677
   10    HB2  SER   2           HB3      SER   2  24.508  -4.453   2.206
   11    HB3  SER   2           HB2      SER   2  25.391  -5.820   1.541
   12    HG   SER   2           HG       SER   2  26.155  -4.120  -0.056
   13    H    THR   3           H        THR   3  24.485  -3.331  -1.563
   14    HA   THR   3           HA       THR   3  23.087  -1.072  -0.654
   15    HB   THR   3           HB       THR   3  23.752  -1.592  -3.549
   16    HG1  THR   3           HG1      THR   3  25.819  -0.540  -2.875
   17   HG21  THR   3          HG21      THR   3  24.111   0.828  -3.604
   18   HG22  THR   3          HG22      THR   3  23.705   0.932  -1.891
   19   HG23  THR   3          HG23      THR   3  22.478   0.444  -3.060
   20    H    HIS   4           H        HIS   4  22.230  -3.565  -3.009
   21    HA   HIS   4           HA       HIS   4  19.415  -2.948  -2.592
   22    HB2  HIS   4           HB3      HIS   4  20.179  -1.636  -4.606
   23    HB3  HIS   4           HB2      HIS   4  20.574  -3.163  -5.380
   24    HD1  HIS   4           HD1      HIS   4  17.711  -0.967  -4.477
   25    HD2  HIS   4           HD2      HIS   4  18.348  -4.679  -6.234
   26    HE1  HIS   4           HE1      HIS   4  15.523  -1.592  -5.548
   27    HE2  HIS   4           HE2      HIS   4  16.002  -3.736  -6.779
   28    HA   PRO   5           HA       PRO   5  20.383  -7.460  -2.620
   29    HB2  PRO   5           HB3      PRO   5  18.767  -8.125  -0.565
   30    HB3  PRO   5           HB2      PRO   5  20.379  -7.441  -0.307
   31    HG2  PRO   5           HG3      PRO   5  17.706  -6.083  -0.237
   32    HG3  PRO   5           HG2      PRO   5  19.068  -5.912   0.884
   33    HD2  PRO   5           HD3      PRO   5  18.548  -4.122  -1.092
   34    HD3  PRO   5           HD2      PRO   5  20.189  -4.455  -0.510
   35    H    VAL   6           H        VAL   6  19.001  -6.721  -4.658
   36    HA   VAL   6           HA       VAL   6  17.309  -7.155  -6.108
   37    HB   VAL   6           HB       VAL   6  16.555  -9.458  -4.319
   38   HG11  VAL   6          HG11      VAL   6  15.955 -10.559  -6.416
   39   HG12  VAL   6          HG12      VAL   6  16.442  -9.119  -7.311
   40   HG13  VAL   6          HG13      VAL   6  15.070  -9.048  -6.207
   41   HG21  VAL   6          HG21      VAL   6  18.791  -9.374  -6.333
   42   HG22  VAL   6          HG22      VAL   6  18.217 -10.812  -5.493
   43   HG23  VAL   6          HG23      VAL   6  18.968  -9.503  -4.584
   44    H    PHE   7           H        PHE   7  16.857  -5.509  -3.676
   45    HA   PHE   7           HA       PHE   7  15.216  -4.371  -2.602
   46    HB2  PHE   7           HB3      PHE   7  14.429  -4.078  -4.969
   47    HB3  PHE   7           HB2      PHE   7  13.386  -5.474  -4.746
   48    HD1  PHE   7           HD1      PHE   7  11.211  -5.143  -4.055
   49    HD2  PHE   7           HD2      PHE   7  14.121  -2.148  -3.245
   50    HE1  PHE   7           HE1      PHE   7   9.444  -3.667  -3.195
   51    HE2  PHE   7           HE2      PHE   7  12.358  -0.666  -2.376
   52    HZ   PHE   7           HZ       PHE   7  10.018  -1.422  -2.351
   53    H    HIS   8           H        HIS   8  15.800  -6.344  -1.154
   54    HA   HIS   8           HA       HIS   8  15.150  -7.818   0.458
   55    HB2  HIS   8           HB3      HIS   8  12.365  -6.834  -0.227
   56    HB3  HIS   8           HB2      HIS   8  12.756  -7.852   1.150
   57    HD1  HIS   8           HD1      HIS   8  13.360  -6.681   3.262
   58    HD2  HIS   8           HD2      HIS   8  13.549  -4.164  -0.042
   59    HE1  HIS   8           HE1      HIS   8  13.736  -4.375   4.191
   60    HE2  HIS   8           HE2      HIS   8  13.681  -2.853   2.186
   61    H    MET   9           H        MET   9  15.602  -8.757  -2.139
   62    HA   MET   9           HA       MET   9  15.393 -10.596  -3.451
   63    HB2  MET   9           HB3      MET   9  13.476 -11.542  -1.320
   64    HB3  MET   9           HB2      MET   9  13.916 -12.498  -2.726
   65    HG2  MET   9           HG3      MET   9  16.290 -12.372  -1.992
   66    HG3  MET   9           HG2      MET   9  15.742 -11.568  -0.522
   67    HE1  MET   9           HE1      MET   9  14.520 -15.865  -1.683
   68    HE2  MET   9           HE2      MET   9  15.537 -14.830  -2.686
   69    HE3  MET   9           HE3      MET   9  13.836 -14.431  -2.448
   70    H    GLY  10           H        GLY  10  12.924  -8.485  -2.797
   71    HA2  GLY  10           HA3      GLY  10  11.413  -7.712  -4.456
   72    HA3  GLY  10           HA2      GLY  10  11.467  -9.300  -5.206
   73    H    GLU  11           H        GLU  11   9.586  -7.285  -3.400
   74    HA   GLU  11           HA       GLU  11   8.331  -9.238  -1.735
   75    HB2  GLU  11           HB3      GLU  11   6.560  -7.399  -1.493
   76    HB3  GLU  11           HB2      GLU  11   8.176  -7.068  -0.890
   77    HG2  GLU  11           HG3      GLU  11   8.572  -5.923  -3.159
   78    HG3  GLU  11           HG2      GLU  11   6.813  -5.968  -3.319
   79    H    PHE  12           H        PHE  12   8.119 -10.793  -3.423
   80    HA   PHE  12           HA       PHE  12   6.518 -10.567  -5.682
   81    HB2  PHE  12           HB3      PHE  12   7.046 -13.016  -3.982
   82    HB3  PHE  12           HB2      PHE  12   6.356 -13.044  -5.603
   83    HD1  PHE  12           HD1      PHE  12   9.280 -13.457  -3.792
   84    HD2  PHE  12           HD2      PHE  12   7.831 -11.690  -7.380
   85    HE1  PHE  12           HE1      PHE  12  11.546 -13.543  -4.745
   86    HE2  PHE  12           HE2      PHE  12  10.091 -11.777  -8.340
   87    HZ   PHE  12           HZ       PHE  12  11.951 -12.706  -7.023
   88    H    SER  13           H        SER  13   4.427 -10.545  -6.039
   89    HA   SER  13           HA       SER  13   2.597 -11.033  -3.805
   90    HB2  SER  13           HB3      SER  13   2.096  -9.664  -6.466
   91    HB3  SER  13           HB2      SER  13   0.967  -9.750  -5.118
   92    HG   SER  13           HG       SER  13   3.483  -8.719  -4.558
   93    H    VAL  14           H        VAL  14   1.194 -12.718  -3.865
   94    HA   VAL  14           HA       VAL  14   1.577 -14.851  -5.650
   95    HB   VAL  14           HB       VAL  14  -0.467 -15.846  -4.663
   96   HG11  VAL  14          HG11      VAL  14   0.367 -15.967  -2.353
   97   HG12  VAL  14          HG12      VAL  14   1.439 -14.606  -2.682
   98   HG13  VAL  14          HG13      VAL  14   1.661 -16.130  -3.539
   99   HG21  VAL  14          HG21      VAL  14  -1.786 -13.797  -4.404
  100   HG22  VAL  14          HG22      VAL  14  -0.679 -13.243  -3.148
  101   HG23  VAL  14          HG23      VAL  14  -1.663 -14.681  -2.883
  102    H    CYS  15           H        CYS  15  -0.341 -12.047  -5.884
  103    HA   CYS  15           HA       CYS  15  -1.308 -12.976  -8.497
  104    HB2  CYS  15           HB3      CYS  15  -3.135 -12.578  -6.766
  105    HB3  CYS  15           HB2      CYS  15  -2.666 -10.877  -6.788
  106    H    ASP  16           H        ASP  16  -0.610 -11.756 -10.169
  107    HA   ASP  16           HA       ASP  16   1.635 -10.170  -9.810
  108    HB2  ASP  16           HB3      ASP  16  -0.221 -10.398 -12.184
  109    HB3  ASP  16           HB2      ASP  16   1.280  -9.479 -12.223
  110    H    SER  17           H        SER  17   1.838  -8.280  -8.939
  111    HA   SER  17           HA       SER  17  -0.114  -6.180  -9.580
  112    HB2  SER  17           HB3      SER  17   1.260  -6.613  -6.909
  113    HB3  SER  17           HB2      SER  17   0.161  -5.285  -7.302
  114    HG   SER  17           HG       SER  17  -0.496  -8.056  -7.311
  115    H    VAL  18           H        VAL  18   0.740  -4.119  -9.885
  116    HA   VAL  18           HA       VAL  18   3.675  -4.024 -10.084
  117    HB   VAL  18           HB       VAL  18   2.681  -4.031 -12.295
  118   HG11  VAL  18          HG11      VAL  18   1.119  -1.620 -11.392
  119   HG12  VAL  18          HG12      VAL  18   0.470  -3.210 -11.798
  120   HG13  VAL  18          HG13      VAL  18   1.208  -2.212 -13.051
  121   HG21  VAL  18          HG21      VAL  18   3.609  -1.928 -13.172
  122   HG22  VAL  18          HG22      VAL  18   4.682  -2.711 -12.011
  123   HG23  VAL  18          HG23      VAL  18   3.723  -1.314 -11.524
  124    H    SER  19           H        SER  19   4.605  -2.603  -8.771
  125    HA   SER  19           HA       SER  19   2.972  -0.525  -7.540
  126    HB2  SER  19           HB3      SER  19   5.135  -0.240  -6.137
  127    HB3  SER  19           HB2      SER  19   4.163  -1.698  -5.894
  128    HG   SER  19           HG       SER  19   5.635  -2.885  -6.971
  129    H    VAL  20           H        VAL  20   2.910   1.397  -8.466
  130    HA   VAL  20           HA       VAL  20   5.294   2.326  -9.938
  131    HB   VAL  20           HB       VAL  20   2.404   2.982 -10.525
  132   HG11  VAL  20          HG11      VAL  20   3.875   4.812 -11.103
  133   HG12  VAL  20          HG12      VAL  20   3.279   4.024 -12.564
  134   HG13  VAL  20          HG13      VAL  20   4.920   3.714 -12.006
  135   HG21  VAL  20          HG21      VAL  20   2.904   0.679 -11.096
  136   HG22  VAL  20          HG22      VAL  20   4.322   1.195 -12.009
  137   HG23  VAL  20          HG23      VAL  20   2.707   1.646 -12.558
  138    H    TRP  21           H        TRP  21   6.066   4.313  -9.458
  139    HA   TRP  21           HA       TRP  21   4.617   5.918  -7.485
  140    HB2  TRP  21           HB3      TRP  21   7.457   6.050  -8.521
  141    HB3  TRP  21           HB2      TRP  21   6.756   7.303  -7.504
  142    HD1  TRP  21           HD1      TRP  21   8.251   3.827  -7.357
  143    HE1  TRP  21           HE1      TRP  21   8.469   3.100  -4.896
  144    HE3  TRP  21           HE3      TRP  21   5.573   7.589  -5.156
  145    HZ2  TRP  21           HZ2      TRP  21   7.613   3.999  -2.363
  146    HZ3  TRP  21           HZ3      TRP  21   5.316   7.578  -2.707
  147    HH2  TRP  21           HH2      TRP  21   6.312   5.820  -1.346
  148    H    VAL  22           H        VAL  22   3.047   6.932  -8.605
  149    HA   VAL  22           HA       VAL  22   3.568   8.084 -11.205
  150    HB   VAL  22           HB       VAL  22   1.076   8.296  -9.508
  151   HG11  VAL  22          HG11      VAL  22  -0.050   8.796 -11.610
  152   HG12  VAL  22          HG12      VAL  22   1.490   8.704 -12.463
  153   HG13  VAL  22          HG13      VAL  22   1.217   9.975 -11.270
  154   HG21  VAL  22          HG21      VAL  22   1.760   6.292 -11.654
  155   HG22  VAL  22          HG22      VAL  22   0.192   6.458 -10.864
  156   HG23  VAL  22          HG23      VAL  22   1.603   5.960  -9.929
  157    H    GLY  23           H        GLY  23   4.672   9.939 -11.272
  158    HA2  GLY  23           HA3      GLY  23   4.266  11.906  -9.122
  159    HA3  GLY  23           HA2      GLY  23   5.641  11.861 -10.223
  160    H    ASP  24           H        ASP  24   2.833  11.266 -11.909
  161    HA   ASP  24           HA       ASP  24   2.324  14.098 -12.467
  162    HB2  ASP  24           HB3      ASP  24   3.073  11.993 -14.500
  163    HB3  ASP  24           HB2      ASP  24   2.215  13.464 -14.945
  164    H    LYS  25           H        LYS  25   0.725  12.424 -10.936
  165    HA   LYS  25           HA       LYS  25  -1.383  11.313 -12.535
  166    HB2  LYS  25           HB3      LYS  25  -0.717  10.578 -10.189
  167    HB3  LYS  25           HB2      LYS  25  -1.504  12.037  -9.606
  168    HG2  LYS  25           HG3      LYS  25  -3.624  11.287 -10.514
  169    HG3  LYS  25           HG2      LYS  25  -2.850   9.841 -11.165
  170    HD2  LYS  25           HD3      LYS  25  -2.187   9.246  -8.829
  171    HD3  LYS  25           HD2      LYS  25  -3.164  10.602  -8.268
  172    HE2  LYS  25           HE3      LYS  25  -4.450   8.562  -8.091
  173    HE3  LYS  25           HE2      LYS  25  -5.141   9.583  -9.354
  174    HZ1  LYS  25           HZ1      LYS  25  -3.279   7.317  -9.853
  175    HZ2  LYS  25           HZ2      LYS  25  -4.100   8.236 -11.020
  176    HZ3  LYS  25           HZ3      LYS  25  -4.968   7.223  -9.984
  177    H    THR  26           H        THR  26  -3.203  12.319 -13.255
  178    HA   THR  26           HA       THR  26  -3.496  15.143 -12.497
  179    HB   THR  26           HB       THR  26  -2.735  14.920 -14.802
  180    HG1  THR  26           HG1      THR  26  -5.317  15.899 -14.243
  181   HG21  THR  26          HG21      THR  26  -5.267  13.328 -15.221
  182   HG22  THR  26          HG22      THR  26  -3.614  12.728 -15.354
  183   HG23  THR  26          HG23      THR  26  -4.216  13.916 -16.510
  184    H    THR  27           H        THR  27  -5.126  12.114 -12.620
  185    HA   THR  27           HA       THR  27  -7.569  13.493 -11.770
  186    HB   THR  27           HB       THR  27  -8.872  11.658 -12.992
  187    HG1  THR  27           HG1      THR  27  -7.195  11.433 -15.046
  188   HG21  THR  27          HG21      THR  27  -8.956  13.986 -13.671
  189   HG22  THR  27          HG22      THR  27  -8.907  12.942 -15.092
  190   HG23  THR  27          HG23      THR  27  -7.455  13.799 -14.578
  191    H    ALA  28           H        ALA  28  -8.682  12.549 -10.147
  192    HA   ALA  28           HA       ALA  28  -8.300   9.739  -9.554
  193    HB1  ALA  28           HB1      ALA  28  -6.446  10.823  -8.334
  194    HB2  ALA  28           HB2      ALA  28  -7.608  10.037  -7.266
  195    HB3  ALA  28           HB3      ALA  28  -7.628  11.791  -7.453
  196    H    THR  29           H        THR  29  -9.760   9.035  -7.790
  197    HA   THR  29           HA       THR  29 -12.236  10.599  -7.908
  198    HB   THR  29           HB       THR  29 -11.896   7.699  -7.132
  199    HG1  THR  29           HG1      THR  29 -11.469   8.572  -9.453
  200   HG21  THR  29          HG21      THR  29 -13.932   8.772  -6.264
  201   HG22  THR  29          HG22      THR  29 -14.308   7.565  -7.494
  202   HG23  THR  29          HG23      THR  29 -14.355   9.281  -7.900
  203    H    ASP  30           H        ASP  30 -12.809  11.694  -6.207
  204    HA   ASP  30           HA       ASP  30 -11.474  11.632  -3.719
  205    HB2  ASP  30           HB3      ASP  30 -12.574  13.651  -4.535
  206    HB3  ASP  30           HB2      ASP  30 -14.137  12.835  -4.536
  207    H    ILE  31           H        ILE  31 -12.573  11.246  -1.610
  208    HA   ILE  31           HA       ILE  31 -13.406   8.586  -1.416
  209    HB   ILE  31           HB       ILE  31 -12.298   9.765   0.416
  210   HG12  ILE  31          HG13      ILE  31 -15.055   8.840   1.250
  211   HG13  ILE  31          HG12      ILE  31 -13.706   7.767   0.890
  212   HG21  ILE  31          HG21      ILE  31 -13.501  11.363   1.815
  213   HG22  ILE  31          HG22      ILE  31 -14.882  11.288   0.720
  214   HG23  ILE  31          HG23      ILE  31 -13.347  11.947   0.159
  215   HD11  ILE  31          HD11      ILE  31 -13.968   8.057   3.276
  216   HD12  ILE  31          HD12      ILE  31 -13.813   9.804   3.099
  217   HD13  ILE  31          HD13      ILE  31 -12.443   8.756   2.736
  218    H    LYS  32           H        LYS  32 -15.244  11.514  -1.855
  219    HA   LYS  32           HA       LYS  32 -17.757  10.273  -1.143
  220    HB2  LYS  32           HB3      LYS  32 -17.161  12.926  -2.449
  221    HB3  LYS  32           HB2      LYS  32 -18.738  12.414  -1.858
  222    HG2  LYS  32           HG3      LYS  32 -17.826  12.283   0.417
  223    HG3  LYS  32           HG2      LYS  32 -16.265  12.835  -0.192
  224    HD2  LYS  32           HD3      LYS  32 -17.319  14.896  -0.968
  225    HD3  LYS  32           HD2      LYS  32 -18.862  14.355  -0.310
  226    HE2  LYS  32           HE3      LYS  32 -17.821  14.258   1.928
  227    HE3  LYS  32           HE2      LYS  32 -16.335  14.895   1.231
  228    HZ1  LYS  32           HZ1      LYS  32 -17.578  16.887   0.566
  229    HZ2  LYS  32           HZ2      LYS  32 -17.592  16.658   2.240
  230    HZ3  LYS  32           HZ3      LYS  32 -18.960  16.274   1.326
  231    H    GLY  33           H        GLY  33 -15.770  10.243  -3.841
  232    HA2  GLY  33           HA3      GLY  33 -16.278   8.794  -5.668
  233    HA3  GLY  33           HA2      GLY  33 -17.985   9.155  -5.437
  234    H    LYS  34           H        LYS  34 -15.814  11.813  -5.340
  235    HA   LYS  34           HA       LYS  34 -16.864  12.763  -7.894
  236    HB2  LYS  34           HB3      LYS  34 -15.268  14.179  -5.754
  237    HB3  LYS  34           HB2      LYS  34 -15.922  14.941  -7.194
  238    HG2  LYS  34           HG3      LYS  34 -17.560  13.634  -5.034
  239    HG3  LYS  34           HG2      LYS  34 -17.264  15.363  -5.183
  240    HD2  LYS  34           HD3      LYS  34 -18.323  15.322  -7.409
  241    HD3  LYS  34           HD2      LYS  34 -18.695  13.614  -7.177
  242    HE2  LYS  34           HE3      LYS  34 -20.089  14.148  -5.268
  243    HE3  LYS  34           HE2      LYS  34 -19.644  15.846  -5.392
  244    HZ1  LYS  34           HZ1      LYS  34 -21.110  14.321  -7.477
  245    HZ2  LYS  34           HZ2      LYS  34 -20.751  15.973  -7.512
  246    HZ3  LYS  34           HZ3      LYS  34 -21.826  15.367  -6.360
  247    H    GLU  35           H        GLU  35 -15.668  12.687  -9.699
  248    HA   GLU  35           HA       GLU  35 -12.875  11.964  -9.559
  249    HB2  GLU  35           HB3      GLU  35 -14.286  11.020 -11.329
  250    HB3  GLU  35           HB2      GLU  35 -14.620  12.636 -11.933
  251    HG2  GLU  35           HG3      GLU  35 -12.299  12.932 -12.531
  252    HG3  GLU  35           HG2      GLU  35 -11.898  11.360 -11.845
  253    H    VAL  36           H        VAL  36 -11.346  13.404  -9.258
  254    HA   VAL  36           HA       VAL  36 -11.842  16.173 -10.109
  255    HB   VAL  36           HB       VAL  36 -10.547  16.887  -8.075
  256   HG11  VAL  36          HG11      VAL  36 -12.441  16.629  -6.531
  257   HG12  VAL  36          HG12      VAL  36 -13.139  15.421  -7.610
  258   HG13  VAL  36          HG13      VAL  36 -12.966  17.089  -8.151
  259   HG21  VAL  36          HG21      VAL  36  -9.465  14.750  -7.590
  260   HG22  VAL  36          HG22      VAL  36 -11.036  14.037  -7.219
  261   HG23  VAL  36          HG23      VAL  36 -10.390  15.328  -6.204
  262    H    THR  37           H        THR  37  -9.933  17.467 -10.399
  263    HA   THR  37           HA       THR  37  -7.867  15.970 -11.756
  264    HB   THR  37           HB       THR  37  -8.197  18.959 -11.486
  265    HG1  THR  37           HG1      THR  37  -9.758  17.288 -12.741
  266   HG21  THR  37          HG21      THR  37  -6.779  19.066 -13.479
  267   HG22  THR  37          HG22      THR  37  -6.614  17.310 -13.459
  268   HG23  THR  37          HG23      THR  37  -5.938  18.274 -12.145
  269    H    VAL  38           H        VAL  38  -6.144  15.306 -10.715
  270    HA   VAL  38           HA       VAL  38  -5.435  16.410  -8.139
  271    HB   VAL  38           HB       VAL  38  -4.144  14.170  -9.706
  272   HG11  VAL  38          HG11      VAL  38  -3.844  14.960  -6.814
  273   HG12  VAL  38          HG12      VAL  38  -2.622  15.137  -8.075
  274   HG13  VAL  38          HG13      VAL  38  -3.142  13.528  -7.568
  275   HG21  VAL  38          HG21      VAL  38  -6.144  14.068  -7.457
  276   HG22  VAL  38          HG22      VAL  38  -5.356  12.677  -8.203
  277   HG23  VAL  38          HG23      VAL  38  -6.461  13.677  -9.147
  278    H    LEU  39           H        LEU  39  -3.810  17.780  -7.750
  279    HA   LEU  39           HA       LEU  39  -2.121  18.606  -9.979
  280    HB2  LEU  39           HB3      LEU  39  -2.295  19.737  -7.177
  281    HB3  LEU  39           HB2      LEU  39  -1.463  20.461  -8.543
  282    HG   LEU  39           HG       LEU  39  -4.448  20.058  -8.347
  283   HD11  LEU  39          HD11      LEU  39  -4.536  22.499  -8.109
  284   HD12  LEU  39          HD12      LEU  39  -2.773  22.540  -8.028
  285   HD13  LEU  39          HD13      LEU  39  -3.697  21.724  -6.766
  286   HD21  LEU  39          HD21      LEU  39  -2.775  21.500 -10.398
  287   HD22  LEU  39          HD22      LEU  39  -4.536  21.496 -10.327
  288   HD23  LEU  39          HD23      LEU  39  -3.666  19.997 -10.644
  289    H    ALA  40           H        ALA  40  -0.212  17.660 -10.235
  290    HA   ALA  40           HA       ALA  40   0.844  15.854  -8.285
  291    HB1  ALA  40           HB1      ALA  40   1.060  15.448 -10.696
  292    HB2  ALA  40           HB2      ALA  40   2.630  15.476  -9.895
  293    HB3  ALA  40           HB3      ALA  40   2.095  16.869 -10.835
  294    H    GLU  41           H        GLU  41   1.047  19.147  -8.768
  295    HA   GLU  41           HA       GLU  41   3.224  19.341  -6.815
  296    HB2  GLU  41           HB3      GLU  41   2.768  21.186  -9.170
  297    HB3  GLU  41           HB2      GLU  41   3.979  21.411  -7.917
  298    HG2  GLU  41           HG3      GLU  41   5.089  19.364  -8.611
  299    HG3  GLU  41           HG2      GLU  41   3.861  19.109  -9.846
  300    H    VAL  42           H        VAL  42   2.390  20.184  -5.009
  301    HA   VAL  42           HA       VAL  42  -0.120  21.644  -5.185
  302    HB   VAL  42           HB       VAL  42  -0.311  21.396  -2.792
  303   HG11  VAL  42          HG11      VAL  42  -0.349  18.974  -2.602
  304   HG12  VAL  42          HG12      VAL  42   0.687  18.835  -4.022
  305   HG13  VAL  42          HG13      VAL  42  -0.940  19.488  -4.181
  306   HG21  VAL  42          HG21      VAL  42   2.454  20.195  -2.832
  307   HG22  VAL  42          HG22      VAL  42   1.383  20.287  -1.435
  308   HG23  VAL  42          HG23      VAL  42   2.018  21.765  -2.159
  309    H    ASN  43           H        ASN  43  -0.343  23.750  -4.895
  310    HA   ASN  43           HA       ASN  43   2.094  25.320  -4.460
  311    HB2  ASN  43           HB3      ASN  43  -0.598  26.172  -5.575
  312    HB3  ASN  43           HB2      ASN  43   0.830  27.195  -5.452
  313   HD21  ASN  43          HD21      ASN  43  -0.698  24.605  -7.169
  314   HD22  ASN  43          HD22      ASN  43   0.410  24.547  -8.493
  315    H    ILE  44           H        ILE  44   2.319  25.528  -2.294
  316    HA   ILE  44           HA       ILE  44  -0.015  26.534  -0.802
  317    HB   ILE  44           HB       ILE  44   2.358  25.014   0.293
  318   HG12  ILE  44          HG13      ILE  44   0.906  23.561  -1.036
  319   HG13  ILE  44          HG12      ILE  44   0.752  23.182   0.679
  320   HG21  ILE  44          HG21      ILE  44  -0.166  25.969   1.641
  321   HG22  ILE  44          HG22      ILE  44   1.466  26.575   1.917
  322   HG23  ILE  44          HG23      ILE  44   1.049  24.926   2.377
  323   HD11  ILE  44          HD11      ILE  44  -1.408  23.147  -0.433
  324   HD12  ILE  44          HD12      ILE  44  -1.181  24.815  -0.955
  325   HD13  ILE  44          HD13      ILE  44  -1.340  24.443   0.761
  326    H    ASN  45           H        ASN  45   0.342  28.686  -1.208
  327    HA   ASN  45           HA       ASN  45   1.154  30.779  -0.869
  328    HB2  ASN  45           HB3      ASN  45   2.412  29.344   1.473
  329    HB3  ASN  45           HB2      ASN  45   2.666  31.062   1.202
  330   HD21  ASN  45          HD21      ASN  45  -0.381  29.510   0.433
  331   HD22  ASN  45          HD22      ASN  45  -1.284  30.241   1.714
  332    H    ASN  46           H        ASN  46   2.275  29.776  -2.929
  333    HA   ASN  46           HA       ASN  46   3.975  30.121  -4.384
  334    HB2  ASN  46           HB3      ASN  46   4.453  32.224  -3.207
  335    HB3  ASN  46           HB2      ASN  46   5.473  31.356  -2.064
  336   HD21  ASN  46          HD21      ASN  46   5.165  32.505  -5.335
  337   HD22  ASN  46          HD22      ASN  46   6.828  32.317  -5.769
  338    H    SER  47           H        SER  47   4.422  28.383  -1.467
  339    HA   SER  47           HA       SER  47   6.878  27.121  -2.344
  340    HB2  SER  47           HB3      SER  47   6.452  27.604   0.074
  341    HB3  SER  47           HB2      SER  47   5.124  26.444   0.036
  342    HG   SER  47           HG       SER  47   7.072  25.518   0.814
  343    H    VAL  48           H        VAL  48   6.840  25.563  -3.783
  344    HA   VAL  48           HA       VAL  48   4.358  24.056  -4.173
  345    HB   VAL  48           HB       VAL  48   6.754  24.288  -6.003
  346   HG11  VAL  48          HG11      VAL  48   4.013  23.135  -6.492
  347   HG12  VAL  48          HG12      VAL  48   5.513  22.219  -6.334
  348   HG13  VAL  48          HG13      VAL  48   5.288  23.314  -7.697
  349   HG21  VAL  48          HG21      VAL  48   4.074  25.662  -6.136
  350   HG22  VAL  48          HG22      VAL  48   5.342  25.754  -7.357
  351   HG23  VAL  48          HG23      VAL  48   5.616  26.424  -5.749
  352    H    PHE  49           H        PHE  49   4.230  22.058  -3.457
  353    HA   PHE  49           HA       PHE  49   6.710  20.478  -3.192
  354    HB2  PHE  49           HB3      PHE  49   4.163  20.345  -1.559
  355    HB3  PHE  49           HB2      PHE  49   5.426  19.121  -1.487
  356    HD1  PHE  49           HD1      PHE  49   4.281  22.271  -0.248
  357    HD2  PHE  49           HD2      PHE  49   7.741  19.842  -0.759
  358    HE1  PHE  49           HE1      PHE  49   5.449  23.568   1.489
  359    HE2  PHE  49           HE2      PHE  49   8.912  21.137   0.973
  360    HZ   PHE  49           HZ       PHE  49   7.766  23.001   2.100
  361    H    ARG  50           H        ARG  50   6.843  18.762  -4.514
  362    HA   ARG  50           HA       ARG  50   4.371  17.870  -5.817
  363    HB2  ARG  50           HB3      ARG  50   5.782  16.832  -7.519
  364    HB3  ARG  50           HB2      ARG  50   6.162  18.534  -7.348
  365    HG2  ARG  50           HG3      ARG  50   8.171  18.010  -6.131
  366    HG3  ARG  50           HG2      ARG  50   7.761  16.292  -6.143
  367    HD2  ARG  50           HD3      ARG  50   9.434  16.965  -7.875
  368    HD3  ARG  50           HD2      ARG  50   7.992  16.176  -8.515
  369    HE   ARG  50           HE       ARG  50   7.711  19.009  -8.493
  370   HH11  ARG  50          HH11      ARG  50   9.235  16.401 -10.250
  371   HH12  ARG  50          HH12      ARG  50   9.207  17.234 -11.767
  372   HH21  ARG  50          HH21      ARG  50   7.642  20.112 -10.488
  373   HH22  ARG  50          HH22      ARG  50   8.298  19.348 -11.907
  374    H    GLN  51           H        GLN  51   3.714  15.759  -5.779
  375    HA   GLN  51           HA       GLN  51   5.146  14.053  -3.853
  376    HB2  GLN  51           HB3      GLN  51   2.903  12.979  -3.422
  377    HB3  GLN  51           HB2      GLN  51   3.074  14.630  -2.848
  378    HG2  GLN  51           HG3      GLN  51   1.908  14.223  -5.541
  379    HG3  GLN  51           HG2      GLN  51   0.927  13.792  -4.141
  380   HE21  GLN  51          HE21      GLN  51   0.274  15.397  -2.715
  381   HE22  GLN  51          HE22      GLN  51   0.335  17.076  -3.129
  382    H    TYR  52           H        TYR  52   4.788  11.726  -4.144
  383    HA   TYR  52           HA       TYR  52   4.320  10.976  -6.949
  384    HB2  TYR  52           HB3      TYR  52   6.257   9.610  -5.054
  385    HB3  TYR  52           HB2      TYR  52   6.029   9.262  -6.764
  386    HD1  TYR  52           HD1      TYR  52   6.761  10.993  -8.458
  387    HD2  TYR  52           HD2      TYR  52   7.748  11.278  -4.329
  388    HE1  TYR  52           HE1      TYR  52   8.555  12.583  -9.000
  389    HE2  TYR  52           HE2      TYR  52   9.543  12.869  -4.863
  390    HH   TYR  52           HH       TYR  52   9.877  14.286  -7.986
  391    H    PHE  53           H        PHE  53   2.671   9.595  -7.154
  392    HA   PHE  53           HA       PHE  53   1.473   8.554  -4.719
  393    HB2  PHE  53           HB3      PHE  53   0.460   8.584  -7.572
  394    HB3  PHE  53           HB2      PHE  53  -0.457   8.007  -6.182
  395    HD1  PHE  53           HD1      PHE  53  -1.081   9.613  -4.385
  396    HD2  PHE  53           HD2      PHE  53   0.607  10.882  -8.075
  397    HE1  PHE  53           HE1      PHE  53  -1.883  11.899  -3.956
  398    HE2  PHE  53           HE2      PHE  53  -0.187  13.171  -7.655
  399    HZ   PHE  53           HZ       PHE  53  -1.431  13.682  -5.595
  400    H    PHE  54           H        PHE  54   1.941   6.624  -4.024
  401    HA   PHE  54           HA       PHE  54   3.236   4.685  -5.733
  402    HB2  PHE  54           HB3      PHE  54   4.024   5.056  -3.419
  403    HB3  PHE  54           HB2      PHE  54   2.454   4.564  -2.802
  404    HD1  PHE  54           HD1      PHE  54   5.314   3.312  -4.830
  405    HD2  PHE  54           HD2      PHE  54   2.097   2.360  -2.213
  406    HE1  PHE  54           HE1      PHE  54   6.116   0.993  -4.694
  407    HE2  PHE  54           HE2      PHE  54   2.893   0.038  -2.075
  408    HZ   PHE  54           HZ       PHE  54   4.905  -0.648  -3.313
  409    H    GLU  55           H        GLU  55   1.746   3.946  -7.154
  410    HA   GLU  55           HA       GLU  55  -0.751   2.828  -6.087
  411    HB2  GLU  55           HB3      GLU  55   0.047   3.420  -8.951
  412    HB3  GLU  55           HB2      GLU  55  -1.503   2.760  -8.448
  413    HG2  GLU  55           HG3      GLU  55  -1.831   4.871  -7.099
  414    HG3  GLU  55           HG2      GLU  55  -0.405   5.514  -7.919
  415    H    THR  56           H        THR  56  -0.444   0.790  -5.465
  416    HA   THR  56           HA       THR  56   1.085  -1.025  -7.159
  417    HB   THR  56           HB       THR  56  -0.456  -1.735  -4.656
  418    HG1  THR  56           HG1      THR  56   1.125  -0.902  -3.525
  419   HG21  THR  56          HG21      THR  56   1.105  -3.624  -4.567
  420   HG22  THR  56          HG22      THR  56   1.875  -3.063  -6.052
  421   HG23  THR  56          HG23      THR  56   0.202  -3.620  -6.081
  422    H    LYS  57           H        LYS  57  -0.022  -1.448  -8.960
  423    HA   LYS  57           HA       LYS  57  -2.948  -1.627  -8.799
  424    HB2  LYS  57           HB3      LYS  57  -1.210  -1.228 -11.243
  425    HB3  LYS  57           HB2      LYS  57  -2.953  -1.008 -11.136
  426    HG2  LYS  57           HG3      LYS  57  -2.631   0.871  -9.616
  427    HG3  LYS  57           HG2      LYS  57  -0.884   0.651  -9.702
  428    HD2  LYS  57           HD3      LYS  57  -1.332   2.382 -11.207
  429    HD3  LYS  57           HD2      LYS  57  -1.161   0.949 -12.222
  430    HE2  LYS  57           HE3      LYS  57  -3.061   2.207 -12.965
  431    HE3  LYS  57           HE2      LYS  57  -3.621   0.714 -12.218
  432    HZ1  LYS  57           HZ1      LYS  57  -4.302   1.869 -10.292
  433    HZ2  LYS  57           HZ2      LYS  57  -4.855   2.796 -11.596
  434    HZ3  LYS  57           HZ3      LYS  57  -3.476   3.282 -10.739
  435    H    CYS  58           H        CYS  58  -4.043  -3.233 -10.028
  436    HA   CYS  58           HA       CYS  58  -2.692  -5.774  -9.793
  437    HB2  CYS  58           HB3      CYS  58  -5.132  -5.233  -9.119
  438    HB3  CYS  58           HB2      CYS  58  -5.487  -5.388 -10.834
  439    H    ARG  59           H        ARG  59  -1.555  -6.611 -11.384
  440    HA   ARG  59           HA       ARG  59  -1.709  -5.597 -14.060
  441    HB2  ARG  59           HB3      ARG  59  -0.165  -7.897 -12.860
  442    HB3  ARG  59           HB2      ARG  59  -0.018  -7.399 -14.535
  443    HG2  ARG  59           HG3      ARG  59   0.817  -5.230 -13.842
  444    HG3  ARG  59           HG2      ARG  59   0.612  -5.677 -12.149
  445    HD2  ARG  59           HD3      ARG  59   2.939  -5.931 -12.856
  446    HD3  ARG  59           HD2      ARG  59   2.229  -7.480 -12.417
  447    HE   ARG  59           HE       ARG  59   2.312  -6.684 -15.240
  448   HH11  ARG  59          HH11      ARG  59   3.394  -8.805 -12.671
  449   HH12  ARG  59          HH12      ARG  59   4.076  -9.973 -13.749
  450   HH21  ARG  59          HH21      ARG  59   3.252  -8.209 -16.662
  451   HH22  ARG  59          HH22      ARG  59   4.020  -9.623 -16.014
  452    H    ALA  60           H        ALA  60  -2.503  -8.683 -12.497
  453    HA   ALA  60           HA       ALA  60  -4.626  -9.161 -14.369
  454    HB1  ALA  60           HB1      ALA  60  -2.241 -11.013 -14.410
  455    HB2  ALA  60           HB2      ALA  60  -2.712  -9.914 -15.705
  456    HB3  ALA  60           HB3      ALA  60  -3.761 -11.262 -15.267
  457    H    SER  61           H        SER  61  -6.194 -10.111 -13.264
  458    HA   SER  61           HA       SER  61  -5.697 -11.236 -10.665
  459    HB2  SER  61           HB3      SER  61  -7.725  -9.900 -11.097
  460    HB3  SER  61           HB2      SER  61  -8.258 -11.090 -12.283
  461    HG   SER  61           HG       SER  61  -8.529 -12.583 -10.659
  462    H    ASN  62           H        ASN  62  -5.593 -13.316 -10.111
  463    HA   ASN  62           HA       ASN  62  -5.493 -15.583 -10.232
  464    HB2  ASN  62           HB3      ASN  62  -7.467 -15.175 -12.486
  465    HB3  ASN  62           HB2      ASN  62  -7.024 -16.752 -11.838
  466   HD21  ASN  62          HD21      ASN  62  -7.659 -17.289  -9.737
  467   HD22  ASN  62          HD22      ASN  62  -8.950 -16.468  -8.935
  468    HA   PRO  63           HA       PRO  63  -2.285 -15.128 -13.594
  469    HB2  PRO  63           HB3      PRO  63  -0.331 -16.308 -12.034
  470    HB3  PRO  63           HB2      PRO  63  -0.605 -14.563 -12.149
  471    HG2  PRO  63           HG3      PRO  63  -1.508 -16.504 -10.064
  472    HG3  PRO  63           HG2      PRO  63  -0.902 -14.849  -9.868
  473    HD2  PRO  63           HD3      PRO  63  -3.533 -15.410  -9.711
  474    HD3  PRO  63           HD2      PRO  63  -2.948 -13.895 -10.445
  475    H    VAL  64           H        VAL  64  -3.321 -17.754 -11.522
  476    HA   VAL  64           HA       VAL  64  -2.650 -19.648 -13.674
  477    HB   VAL  64           HB       VAL  64  -2.373 -21.413 -11.968
  478   HG11  VAL  64          HG11      VAL  64  -0.201 -20.686 -11.098
  479   HG12  VAL  64          HG12      VAL  64  -0.580 -19.025 -11.557
  480   HG13  VAL  64          HG13      VAL  64  -0.400 -20.265 -12.799
  481   HG21  VAL  64          HG21      VAL  64  -3.758 -20.449 -10.208
  482   HG22  VAL  64          HG22      VAL  64  -2.579 -19.158  -9.981
  483   HG23  VAL  64          HG23      VAL  64  -2.144 -20.825  -9.611
  484    H    GLU  65           H        GLU  65  -4.075 -21.599 -13.673
  485    HA   GLU  65           HA       GLU  65  -6.820 -20.672 -13.410
  486    HB2  GLU  65           HB3      GLU  65  -5.764 -23.209 -14.664
  487    HB3  GLU  65           HB2      GLU  65  -7.397 -22.578 -14.808
  488    HG2  GLU  65           HG3      GLU  65  -6.475 -20.577 -15.927
  489    HG3  GLU  65           HG2      GLU  65  -4.882 -21.328 -15.878
  490    H    SER  66           H        SER  66  -5.544 -21.216 -10.993
  491    HA   SER  66           HA       SER  66  -7.498 -23.057  -9.897
  492    HB2  SER  66           HB3      SER  66  -4.531 -23.397  -9.352
  493    HB3  SER  66           HB2      SER  66  -5.828 -24.276  -8.541
  494    HG   SER  66           HG       SER  66  -6.039 -24.432 -11.248
  495    H    GLY  67           H        GLY  67  -6.796 -20.160  -9.973
  496    HA2  GLY  67           HA3      GLY  67  -7.504 -18.694  -8.156
  497    HA3  GLY  67           HA2      GLY  67  -6.566 -19.715  -7.067
  498    H    CYS  68           H        CYS  68  -4.488 -19.238  -6.704
  499    HA   CYS  68           HA       CYS  68  -3.147 -17.331  -8.481
  500    HB2  CYS  68           HB3      CYS  68  -3.379 -17.105  -5.469
  501    HB3  CYS  68           HB2      CYS  68  -2.234 -16.167  -6.437
  502    H    ARG  69           H        ARG  69  -0.728 -17.179  -7.801
  503    HA   ARG  69           HA       ARG  69   0.276 -19.817  -8.144
  504    HB2  ARG  69           HB3      ARG  69   1.758 -17.237  -7.569
  505    HB3  ARG  69           HB2      ARG  69   2.522 -18.754  -8.035
  506    HG2  ARG  69           HG3      ARG  69   1.146 -18.641 -10.156
  507    HG3  ARG  69           HG2      ARG  69   0.729 -16.993  -9.680
  508    HD2  ARG  69           HD3      ARG  69   2.600 -16.923 -11.198
  509    HD3  ARG  69           HD2      ARG  69   3.138 -16.446  -9.585
  510    HE   ARG  69           HE       ARG  69   3.499 -19.243 -10.118
  511   HH11  ARG  69          HH11      ARG  69   4.905 -16.066 -10.522
  512   HH12  ARG  69          HH12      ARG  69   6.526 -16.659 -10.690
  513   HH21  ARG  69          HH21      ARG  69   5.635 -20.036 -10.349
  514   HH22  ARG  69          HH22      ARG  69   6.940 -18.917 -10.598
  515    H    GLY  70           H        GLY  70   0.835 -21.265  -6.675
  516    HA2  GLY  70           HA3      GLY  70   1.960 -21.937  -4.679
  517    HA3  GLY  70           HA2      GLY  70   1.612 -20.357  -3.989
  518    H    ILE  71           H        ILE  71  -1.185 -20.444  -4.926
  519    HA   ILE  71           HA       ILE  71  -2.279 -21.766  -2.623
  520    HB   ILE  71           HB       ILE  71  -3.819 -20.526  -4.905
  521   HG12  ILE  71          HG13      ILE  71  -2.217 -18.894  -3.972
  522   HG13  ILE  71          HG12      ILE  71  -3.881 -18.458  -3.605
  523   HG21  ILE  71          HG21      ILE  71  -5.581 -20.250  -3.221
  524   HG22  ILE  71          HG22      ILE  71  -4.561 -21.053  -2.026
  525   HG23  ILE  71          HG23      ILE  71  -5.142 -21.945  -3.432
  526   HD11  ILE  71          HD11      ILE  71  -2.416 -18.079  -1.705
  527   HD12  ILE  71          HD12      ILE  71  -1.947 -19.779  -1.715
  528   HD13  ILE  71          HD13      ILE  71  -3.611 -19.325  -1.343
  529    H    ASP  72           H        ASP  72  -1.729 -23.944  -3.050
  530    HA   ASP  72           HA       ASP  72  -3.215 -25.202  -5.250
  531    HB2  ASP  72           HB3      ASP  72  -0.775 -25.724  -5.059
  532    HB3  ASP  72           HB2      ASP  72  -1.091 -26.449  -3.485
  533    H    SER  73           H        SER  73  -5.214 -24.922  -4.164
  534    HA   SER  73           HA       SER  73  -5.761 -27.064  -2.283
  535    HB2  SER  73           HB3      SER  73  -5.248 -25.137  -0.839
  536    HB3  SER  73           HB2      SER  73  -6.440 -24.167  -1.704
  537    HG   SER  73           HG       SER  73  -6.833 -25.719   0.383
  538    H    LYS  74           H        LYS  74  -7.734 -27.944  -2.602
  539    HA   LYS  74           HA       LYS  74  -9.462 -26.781  -4.643
  540    HB2  LYS  74           HB3      LYS  74  -9.692 -29.383  -3.113
  541    HB3  LYS  74           HB2      LYS  74 -10.703 -28.901  -4.464
  542    HG2  LYS  74           HG3      LYS  74  -8.755 -28.929  -5.939
  543    HG3  LYS  74           HG2      LYS  74  -7.737 -29.404  -4.578
  544    HD2  LYS  74           HD3      LYS  74 -10.060 -30.982  -5.669
  545    HD3  LYS  74           HD2      LYS  74  -8.356 -31.326  -5.965
  546    HE2  LYS  74           HE3      LYS  74  -8.048 -31.618  -3.525
  547    HE3  LYS  74           HE2      LYS  74  -9.780 -31.387  -3.311
  548    HZ1  LYS  74           HZ1      LYS  74  -9.215 -33.724  -3.348
  549    HZ2  LYS  74           HZ2      LYS  74  -8.503 -33.564  -4.872
  550    HZ3  LYS  74           HZ3      LYS  74 -10.169 -33.336  -4.689
  551    H    HIS  75           H        HIS  75  -9.057 -26.895  -1.314
  552    HA   HIS  75           HA       HIS  75 -11.809 -26.551  -0.538
  553    HB2  HIS  75           HB3      HIS  75 -10.159 -27.602   0.979
  554    HB3  HIS  75           HB2      HIS  75  -9.230 -26.109   1.005
  555    HD1  HIS  75           HD1      HIS  75  -9.607 -24.803   3.048
  556    HD2  HIS  75           HD2      HIS  75 -12.967 -27.022   2.012
  557    HE1  HIS  75           HE1      HIS  75 -11.305 -24.333   4.841
  558    HE2  HIS  75           HE2      HIS  75 -13.226 -25.875   4.317
  559    H    TRP  76           H        TRP  76  -9.114 -24.566  -1.439
  560    HA   TRP  76           HA       TRP  76 -10.667 -22.158  -0.768
  561    HB2  TRP  76           HB3      TRP  76  -7.672 -22.489  -1.088
  562    HB3  TRP  76           HB2      TRP  76  -8.489 -20.948  -0.820
  563    HD1  TRP  76           HD1      TRP  76  -6.747 -23.556   1.032
  564    HE1  TRP  76           HE1      TRP  76  -7.258 -23.423   3.551
  565    HE3  TRP  76           HE3      TRP  76 -10.803 -20.445   0.878
  566    HZ2  TRP  76           HZ2      TRP  76  -9.125 -22.166   5.242
  567    HZ3  TRP  76           HZ3      TRP  76 -11.890 -19.829   2.994
  568    HH2  TRP  76           HH2      TRP  76 -11.069 -20.672   5.131
  569    H    ASN  77           H        ASN  77 -11.625 -21.300  -2.455
  570    HA   ASN  77           HA       ASN  77 -10.289 -21.313  -5.064
  571    HB2  ASN  77           HB3      ASN  77 -12.691 -21.848  -5.084
  572    HB3  ASN  77           HB2      ASN  77 -13.047 -20.330  -4.269
  573   HD21  ASN  77          HD21      ASN  77 -13.120 -18.448  -5.438
  574   HD22  ASN  77          HD22      ASN  77 -12.979 -18.393  -7.162
  575    H    SER  78           H        SER  78  -9.490 -19.434  -5.967
  576    HA   SER  78           HA       SER  78  -9.348 -17.177  -4.083
  577    HB2  SER  78           HB3      SER  78  -7.113 -18.039  -5.919
  578    HB3  SER  78           HB2      SER  78  -7.030 -16.929  -4.551
  579    HG   SER  78           HG       SER  78  -7.648 -18.793  -3.240
  580    H    TYR  79           H        TYR  79  -9.302 -15.119  -4.903
  581    HA   TYR  79           HA       TYR  79  -8.907 -14.667  -7.710
  582    HB2  TYR  79           HB3      TYR  79 -10.969 -13.444  -8.132
  583    HB3  TYR  79           HB2      TYR  79 -11.345 -15.094  -7.650
  584    HD1  TYR  79           HD1      TYR  79 -11.421 -11.561  -6.586
  585    HD2  TYR  79           HD2      TYR  79 -12.612 -15.544  -5.670
  586    HE1  TYR  79           HE1      TYR  79 -13.003 -10.698  -4.912
  587    HE2  TYR  79           HE2      TYR  79 -14.191 -14.688  -3.987
  588    HH   TYR  79           HH       TYR  79 -14.496 -12.657  -2.599
  589    H    CYS  80           H        CYS  80  -8.668 -12.343  -8.174
  590    HA   CYS  80           HA       CYS  80  -7.304 -11.177  -5.862
  591    HB2  CYS  80           HB3      CYS  80  -6.997 -10.451  -8.781
  592    HB3  CYS  80           HB2      CYS  80  -5.924 -10.007  -7.451
  593    H    THR  81           H        THR  81  -7.714  -9.187  -5.100
  594    HA   THR  81           HA       THR  81  -9.558  -7.456  -6.580
  595    HB   THR  81           HB       THR  81 -10.960  -8.656  -4.961
  596    HG1  THR  81           HG1      THR  81 -11.208  -6.452  -3.575
  597   HG21  THR  81          HG21      THR  81  -9.082  -7.536  -2.882
  598   HG22  THR  81          HG22      THR  81  -9.306  -9.237  -3.290
  599   HG23  THR  81          HG23      THR  81 -10.618  -8.332  -2.538
  600    H    THR  82           H        THR  82  -9.288  -5.228  -6.120
  601    HA   THR  82           HA       THR  82  -6.584  -4.662  -5.218
  602    HB   THR  82           HB       THR  82  -7.117  -2.341  -6.154
  603    HG1  THR  82           HG1      THR  82  -9.161  -3.665  -7.590
  604   HG21  THR  82          HG21      THR  82  -5.700  -3.923  -7.326
  605   HG22  THR  82          HG22      THR  82  -6.751  -3.093  -8.475
  606   HG23  THR  82          HG23      THR  82  -7.116  -4.745  -7.980
  607    H    THR  83           H        THR  83  -6.160  -3.906  -3.294
  608    HA   THR  83           HA       THR  83  -8.142  -2.729  -1.582
  609    HB   THR  83           HB       THR  83  -5.118  -2.829  -1.354
  610    HG1  THR  83           HG1      THR  83  -6.888  -4.396   0.192
  611   HG21  THR  83          HG21      THR  83  -7.151  -2.268   0.807
  612   HG22  THR  83          HG22      THR  83  -6.150  -1.044   0.028
  613   HG23  THR  83          HG23      THR  83  -5.400  -2.317   0.992
  614    H    HIS  84           H        HIS  84  -8.461  -0.519  -1.211
  615    HA   HIS  84           HA       HIS  84  -6.864   1.281  -2.913
  616    HB2  HIS  84           HB3      HIS  84  -9.864   1.349  -2.501
  617    HB3  HIS  84           HB2      HIS  84  -8.949   2.666  -3.227
  618    HD1  HIS  84           HD1      HIS  84  -8.321   2.437  -5.683
  619    HD2  HIS  84           HD2      HIS  84  -9.946  -1.042  -4.089
  620    HE1  HIS  84           HE1      HIS  84  -8.700   0.911  -7.638
  621    HE2  HIS  84           HE2      HIS  84  -9.438  -1.269  -6.612
  622    H    THR  85           H        THR  85  -6.090   3.063  -1.969
  623    HA   THR  85           HA       THR  85  -6.933   3.551   0.813
  624    HB   THR  85           HB       THR  85  -4.621   2.717   0.674
  625    HG1  THR  85           HG1      THR  85  -3.837   4.212   2.056
  626   HG21  THR  85          HG21      THR  85  -4.039   3.496  -1.560
  627   HG22  THR  85          HG22      THR  85  -2.866   4.072  -0.378
  628   HG23  THR  85          HG23      THR  85  -4.096   5.169  -1.006
  629    H    PHE  86           H        PHE  86  -6.636   5.843   1.520
  630    HA   PHE  86           HA       PHE  86  -7.318   7.666  -0.689
  631    HB2  PHE  86           HB3      PHE  86  -8.576   7.468   2.058
  632    HB3  PHE  86           HB2      PHE  86  -8.770   8.876   1.015
  633    HD1  PHE  86           HD1      PHE  86  -9.774   5.433   1.628
  634    HD2  PHE  86           HD2      PHE  86  -9.994   8.699  -1.092
  635    HE1  PHE  86           HE1      PHE  86 -11.668   4.353   0.495
  636    HE2  PHE  86           HE2      PHE  86 -11.887   7.624  -2.230
  637    HZ   PHE  86           HZ       PHE  86 -12.729   5.454  -1.441
  638    H    VAL  87           H        VAL  87  -5.868   9.213  -0.905
  639    HA   VAL  87           HA       VAL  87  -4.355  10.051   1.487
  640    HB   VAL  87           HB       VAL  87  -2.534  10.732  -0.032
  641   HG11  VAL  87          HG11      VAL  87  -1.800   8.458  -0.686
  642   HG12  VAL  87          HG12      VAL  87  -3.407   7.862  -0.274
  643   HG13  VAL  87          HG13      VAL  87  -2.379   8.561   0.976
  644   HG21  VAL  87          HG21      VAL  87  -4.210   9.455  -2.187
  645   HG22  VAL  87          HG22      VAL  87  -2.548  10.014  -2.371
  646   HG23  VAL  87          HG23      VAL  87  -3.836  11.172  -2.038
  647    H    LYS  88           H        LYS  88  -3.761  12.297   1.632
  648    HA   LYS  88           HA       LYS  88  -5.818  14.055   0.599
  649    HB2  LYS  88           HB3      LYS  88  -3.460  14.610   2.409
  650    HB3  LYS  88           HB2      LYS  88  -4.660  15.805   1.946
  651    HG2  LYS  88           HG3      LYS  88  -5.168  13.302   3.533
  652    HG3  LYS  88           HG2      LYS  88  -5.096  14.943   4.160
  653    HD2  LYS  88           HD3      LYS  88  -7.115  13.906   2.177
  654    HD3  LYS  88           HD2      LYS  88  -7.399  14.191   3.892
  655    HE2  LYS  88           HE3      LYS  88  -6.879  16.575   3.551
  656    HE3  LYS  88           HE2      LYS  88  -6.697  16.266   1.825
  657    HZ1  LYS  88           HZ1      LYS  88  -9.166  16.003   3.449
  658    HZ2  LYS  88           HZ2      LYS  88  -9.034  15.442   1.863
  659    HZ3  LYS  88           HZ3      LYS  88  -8.879  17.093   2.185
  660    H    ALA  89           H        ALA  89  -5.630  14.840  -1.357
  661    HA   ALA  89           HA       ALA  89  -2.985  15.828  -2.202
  662    HB1  ALA  89           HB1      ALA  89  -3.520  13.769  -3.428
  663    HB2  ALA  89           HB2      ALA  89  -3.482  15.172  -4.495
  664    HB3  ALA  89           HB3      ALA  89  -5.029  14.497  -3.983
  665    H    LEU  90           H        LEU  90  -2.983  17.769  -3.318
  666    HA   LEU  90           HA       LEU  90  -5.305  19.425  -2.956
  667    HB2  LEU  90           HB3      LEU  90  -2.906  20.224  -2.754
  668    HB3  LEU  90           HB2      LEU  90  -2.783  20.061  -4.499
  669    HG   LEU  90           HG       LEU  90  -4.688  21.710  -4.686
  670   HD11  LEU  90          HD11      LEU  90  -4.084  22.084  -1.758
  671   HD12  LEU  90          HD12      LEU  90  -5.599  21.510  -2.457
  672   HD13  LEU  90          HD13      LEU  90  -5.068  23.166  -2.743
  673   HD21  LEU  90          HD21      LEU  90  -2.373  22.350  -5.089
  674   HD22  LEU  90          HD22      LEU  90  -2.138  22.637  -3.365
  675   HD23  LEU  90          HD23      LEU  90  -3.250  23.651  -4.286
  676    H    THR  91           H        THR  91  -6.972  19.018  -4.250
  677    HA   THR  91           HA       THR  91  -6.422  18.475  -7.093
  678    HB   THR  91           HB       THR  91  -8.609  17.334  -7.147
  679    HG1  THR  91           HG1      THR  91  -9.036  18.625  -4.925
  680   HG21  THR  91          HG21      THR  91  -6.635  15.983  -6.712
  681   HG22  THR  91          HG22      THR  91  -7.995  15.373  -5.776
  682   HG23  THR  91          HG23      THR  91  -6.744  16.336  -4.990
  683    H    THR  92           H        THR  92  -7.636  19.546  -8.658
  684    HA   THR  92           HA       THR  92  -9.011  21.926  -7.637
  685    HB   THR  92           HB       THR  92  -7.116  22.495  -9.038
  686    HG1  THR  92           HG1      THR  92  -8.190  23.912 -10.332
  687   HG21  THR  92          HG21      THR  92  -8.460  20.902 -11.219
  688   HG22  THR  92          HG22      THR  92  -6.976  20.453 -10.378
  689   HG23  THR  92          HG23      THR  92  -7.011  21.888 -11.402
  690    H    ASP  93           H        ASP  93 -11.089  22.123  -7.853
  691    HA   ASP  93           HA       ASP  93 -12.698  20.097  -9.057
  692    HB2  ASP  93           HB3      ASP  93 -13.538  21.272  -7.114
  693    HB3  ASP  93           HB2      ASP  93 -13.378  22.824  -7.928
  694    H    GLU  94           H        GLU  94 -11.499  23.200 -10.004
  695    HA   GLU  94           HA       GLU  94 -11.869  22.734 -12.758
  696    HB2  GLU  94           HB3      GLU  94 -14.242  23.355 -11.985
  697    HB3  GLU  94           HB2      GLU  94 -13.608  24.966 -11.698
  698    HG2  GLU  94           HG3      GLU  94 -14.659  24.938 -13.829
  699    HG3  GLU  94           HG2      GLU  94 -12.922  25.068 -14.069
  700    H    LYS  95           H        LYS  95 -11.964  25.516 -10.533
  701    HA   LYS  95           HA       LYS  95  -9.299  26.276 -11.521
  702    HB2  LYS  95           HB3      LYS  95 -11.601  28.078 -10.764
  703    HB3  LYS  95           HB2      LYS  95  -9.953  28.651 -10.966
  704    HG2  LYS  95           HG3      LYS  95  -9.998  27.853 -13.301
  705    HG3  LYS  95           HG2      LYS  95 -11.684  27.383 -13.075
  706    HD2  LYS  95           HD3      LYS  95 -12.256  29.701 -12.559
  707    HD3  LYS  95           HD2      LYS  95 -10.573  30.173 -12.798
  708    HE2  LYS  95           HE3      LYS  95 -10.720  29.397 -15.130
  709    HE3  LYS  95           HE2      LYS  95 -12.414  28.991 -14.872
  710    HZ1  LYS  95           HZ1      LYS  95 -12.818  31.348 -14.351
  711    HZ2  LYS  95           HZ2      LYS  95 -12.257  31.119 -15.928
  712    HZ3  LYS  95           HZ3      LYS  95 -11.207  31.698 -14.736
  713    H    GLN  96           H        GLN  96 -11.492  25.997  -8.809
  714    HA   GLN  96           HA       GLN  96  -9.562  27.001  -6.912
  715    HB2  GLN  96           HB3      GLN  96 -12.289  25.743  -6.551
  716    HB3  GLN  96           HB2      GLN  96 -11.299  26.339  -5.227
  717    HG2  GLN  96           HG3      GLN  96 -12.359  27.988  -7.510
  718    HG3  GLN  96           HG2      GLN  96 -13.006  27.947  -5.869
  719   HE21  GLN  96          HE21      GLN  96 -11.860  30.152  -7.456
  720   HE22  GLN  96          HE22      GLN  96 -10.577  30.798  -6.494
  721    H    ALA  97           H        ALA  97  -8.173  25.846  -5.755
  722    HA   ALA  97           HA       ALA  97  -8.199  22.932  -6.091
  723    HB1  ALA  97           HB1      ALA  97  -5.844  22.968  -5.599
  724    HB2  ALA  97           HB2      ALA  97  -5.912  24.681  -5.202
  725    HB3  ALA  97           HB3      ALA  97  -6.183  24.150  -6.861
  726    H    ALA  98           H        ALA  98  -8.298  21.584  -4.372
  727    HA   ALA  98           HA       ALA  98  -8.093  22.673  -1.673
  728    HB1  ALA  98           HB1      ALA  98 -10.548  21.211  -2.651
  729    HB2  ALA  98           HB2      ALA  98 -10.458  22.930  -2.267
  730    HB3  ALA  98           HB3      ALA  98 -10.243  21.729  -0.993
  731    H    TRP  99           H        TRP  99  -7.590  21.140  -0.118
  732    HA   TRP  99           HA       TRP  99  -6.339  18.740  -1.038
  733    HB2  TRP  99           HB3      TRP  99  -6.911  19.782   1.744
  734    HB3  TRP  99           HB2      TRP  99  -6.028  18.298   1.427
  735    HD1  TRP  99           HD1      TRP  99  -5.644  22.071   1.394
  736    HE1  TRP  99           HE1      TRP  99  -3.169  22.659   1.006
  737    HE3  TRP  99           HE3      TRP  99  -3.884  17.416   0.247
  738    HZ2  TRP  99           HZ2      TRP  99  -0.780  21.317   0.309
  739    HZ3  TRP  99           HZ3      TRP  99  -1.488  17.151  -0.269
  740    HH2  TRP  99           HH2      TRP  99   0.026  19.063  -0.239
  741    H    ARG 100           H        ARG 100  -7.540  17.092  -1.722
  742    HA   ARG 100           HA       ARG 100  -9.937  16.355  -0.163
  743    HB2  ARG 100           HB3      ARG 100  -9.312  15.832  -3.082
  744    HB3  ARG 100           HB2      ARG 100 -10.758  15.286  -2.248
  745    HG2  ARG 100           HG3      ARG 100  -9.994  18.177  -2.598
  746    HG3  ARG 100           HG2      ARG 100 -11.081  17.292  -3.668
  747    HD2  ARG 100           HD3      ARG 100 -11.505  17.764  -0.717
  748    HD3  ARG 100           HD2      ARG 100 -12.315  18.618  -2.025
  749    HE   ARG 100           HE       ARG 100 -12.607  15.709  -1.937
  750   HH11  ARG 100          HH11      ARG 100 -13.989  18.871  -1.308
  751   HH12  ARG 100          HH12      ARG 100 -15.621  18.285  -1.237
  752   HH21  ARG 100          HH21      ARG 100 -14.755  14.928  -1.835
  753   HH22  ARG 100          HH22      ARG 100 -16.054  16.053  -1.557
  754    H    PHE 101           H        PHE 101 -10.432  14.039  -0.130
  755    HA   PHE 101           HA       PHE 101  -8.046  12.378   0.138
  756    HB2  PHE 101           HB3      PHE 101 -10.971  11.900   0.769
  757    HB3  PHE 101           HB2      PHE 101  -9.774  10.623   0.849
  758    HD1  PHE 101           HD1      PHE 101  -8.143  10.555   2.630
  759    HD2  PHE 101           HD2      PHE 101 -11.039  13.667   2.415
  760    HE1  PHE 101           HE1      PHE 101  -7.680  11.144   4.972
  761    HE2  PHE 101           HE2      PHE 101 -10.572  14.266   4.753
  762    HZ   PHE 101           HZ       PHE 101  -8.896  13.002   6.034
  763    H    ILE 102           H        ILE 102  -7.320  11.408  -1.689
  764    HA   ILE 102           HA       ILE 102  -9.370  10.542  -3.624
  765    HB   ILE 102           HB       ILE 102  -7.613  10.592  -5.361
  766   HG12  ILE 102          HG13      ILE 102  -5.928  12.075  -3.346
  767   HG13  ILE 102          HG12      ILE 102  -5.694  10.376  -3.734
  768   HG21  ILE 102          HG21      ILE 102  -7.543  13.024  -5.607
  769   HG22  ILE 102          HG22      ILE 102  -8.047  13.204  -3.925
  770   HG23  ILE 102          HG23      ILE 102  -9.139  12.464  -5.100
  771   HD11  ILE 102          HD11      ILE 102  -4.130  11.761  -4.950
  772   HD12  ILE 102          HD12      ILE 102  -5.461  12.683  -5.651
  773   HD13  ILE 102          HD13      ILE 102  -5.254  10.982  -6.064
  774    H    ARG 103           H        ARG 103  -9.231   8.528  -4.550
  775    HA   ARG 103           HA       ARG 103  -7.902   6.603  -2.809
  776    HB2  ARG 103           HB3      ARG 103  -9.437   4.955  -3.725
  777    HB3  ARG 103           HB2      ARG 103 -10.330   6.375  -3.195
  778    HG2  ARG 103           HG3      ARG 103 -10.318   7.130  -5.601
  779    HG3  ARG 103           HG2      ARG 103  -9.698   5.531  -6.007
  780    HD2  ARG 103           HD3      ARG 103 -12.041   5.407  -6.299
  781    HD3  ARG 103           HD2      ARG 103 -11.706   4.593  -4.769
  782    HE   ARG 103           HE       ARG 103 -12.399   7.405  -4.583
  783   HH11  ARG 103          HH11      ARG 103 -13.500   4.086  -4.386
  784   HH12  ARG 103          HH12      ARG 103 -14.974   4.491  -3.570
  785   HH21  ARG 103          HH21      ARG 103 -14.353   7.939  -3.520
  786   HH22  ARG 103          HH22      ARG 103 -15.459   6.671  -3.075
  787    H    ILE 104           H        ILE 104  -6.226   5.424  -3.398
  788    HA   ILE 104           HA       ILE 104  -5.747   4.997  -6.265
  789    HB   ILE 104           HB       ILE 104  -3.287   5.017  -5.828
  790   HG12  ILE 104          HG13      ILE 104  -3.600   4.849  -3.283
  791   HG13  ILE 104          HG12      ILE 104  -2.329   5.901  -3.884
  792   HG21  ILE 104          HG21      ILE 104  -4.750   7.610  -5.405
  793   HG22  ILE 104          HG22      ILE 104  -4.349   6.863  -6.951
  794   HG23  ILE 104          HG23      ILE 104  -3.064   7.458  -5.900
  795   HD11  ILE 104          HD11      ILE 104  -3.472   6.969  -2.073
  796   HD12  ILE 104          HD12      ILE 104  -5.028   6.739  -2.866
  797   HD13  ILE 104          HD13      ILE 104  -3.834   7.830  -3.567
  798    H    ASP 105           H        ASP 105  -4.386   3.124  -6.717
  799    HA   ASP 105           HA       ASP 105  -5.364   0.844  -5.336
  800    HB2  ASP 105           HB3      ASP 105  -3.239   1.118  -7.477
  801    HB3  ASP 105           HB2      ASP 105  -3.832  -0.430  -6.868
  802    H    THR 106           H        THR 106  -4.591  -0.125  -3.639
  803    HA   THR 106           HA       THR 106  -2.008   0.712  -2.562
  804    HB   THR 106           HB       THR 106  -4.027  -1.020  -1.148
  805    HG1  THR 106           HG1      THR 106  -4.357   1.522  -2.061
  806   HG21  THR 106          HG21      THR 106  -2.073   1.077  -0.193
  807   HG22  THR 106          HG22      THR 106  -1.877  -0.670  -0.041
  808   HG23  THR 106          HG23      THR 106  -3.169   0.152   0.833
  809    H    ALA 107           H        ALA 107  -3.768  -2.121  -3.655
  810    HA   ALA 107           HA       ALA 107  -1.514  -3.611  -4.364
  811    HB1  ALA 107           HB1      ALA 107  -1.528  -5.374  -2.671
  812    HB2  ALA 107           HB2      ALA 107  -2.759  -4.501  -1.759
  813    HB3  ALA 107           HB3      ALA 107  -1.145  -3.814  -1.942
  814    H    CYS 108           H        CYS 108  -2.113  -5.749  -5.187
  815    HA   CYS 108           HA       CYS 108  -5.027  -6.136  -5.390
  816    HB2  CYS 108           HB3      CYS 108  -3.860  -5.774  -7.593
  817    HB3  CYS 108           HB2      CYS 108  -2.925  -7.237  -7.279
  818    H    VAL 109           H        VAL 109  -5.553  -7.493  -3.805
  819    HA   VAL 109           HA       VAL 109  -3.591  -9.505  -2.999
  820    HB   VAL 109           HB       VAL 109  -4.871  -9.752  -0.952
  821   HG11  VAL 109          HG11      VAL 109  -4.419  -6.858  -1.672
  822   HG12  VAL 109          HG12      VAL 109  -3.221  -7.976  -1.021
  823   HG13  VAL 109          HG13      VAL 109  -4.599  -7.489  -0.035
  824   HG21  VAL 109          HG21      VAL 109  -6.782  -7.721  -2.105
  825   HG22  VAL 109          HG22      VAL 109  -6.843  -8.409  -0.482
  826   HG23  VAL 109          HG23      VAL 109  -7.117  -9.440  -1.888
  827    H    CYS 110           H        CYS 110  -4.188 -11.673  -2.649
  828    HA   CYS 110           HA       CYS 110  -6.374 -12.562  -4.394
  829    HB2  CYS 110           HB3      CYS 110  -4.033 -13.361  -4.880
  830    HB3  CYS 110           HB2      CYS 110  -4.058 -14.199  -3.334
  831    H    VAL 111           H        VAL 111  -8.178 -12.959  -3.303
  832    HA   VAL 111           HA       VAL 111  -8.037 -13.544  -0.459
  833    HB   VAL 111           HB       VAL 111 -10.419 -13.220  -0.406
  834   HG11  VAL 111          HG11      VAL 111  -9.093 -11.193  -0.465
  835   HG12  VAL 111          HG12      VAL 111 -10.623 -10.952  -1.310
  836   HG13  VAL 111          HG13      VAL 111  -9.137 -11.194  -2.228
  837   HG21  VAL 111          HG21      VAL 111 -10.333 -13.128  -3.416
  838   HG22  VAL 111          HG22      VAL 111 -11.751 -12.830  -2.412
  839   HG23  VAL 111          HG23      VAL 111 -11.011 -14.429  -2.436
  840    H    LEU 112           H        LEU 112  -9.067 -15.364   0.511
  841    HA   LEU 112           HA       LEU 112  -9.275 -17.672  -1.303
  842    HB2  LEU 112           HB3      LEU 112  -8.782 -17.644   1.684
  843    HB3  LEU 112           HB2      LEU 112  -8.830 -19.070   0.666
  844    HG   LEU 112           HG       LEU 112  -6.749 -16.879   0.545
  845   HD11  LEU 112          HD11      LEU 112  -5.232 -18.623   1.351
  846   HD12  LEU 112          HD12      LEU 112  -6.593 -19.734   1.503
  847   HD13  LEU 112          HD13      LEU 112  -6.518 -18.286   2.508
  848   HD21  LEU 112          HD21      LEU 112  -5.591 -18.341  -1.041
  849   HD22  LEU 112          HD22      LEU 112  -7.151 -17.810  -1.666
  850   HD23  LEU 112          HD23      LEU 112  -6.968 -19.443  -1.029
  851    H    SER 113           H        SER 113 -11.127 -18.819  -1.379
  852    HA   SER 113           HA       SER 113 -13.229 -18.179   0.572
  853    HB2  SER 113           HB3      SER 113 -13.724 -16.951  -1.483
  854    HB3  SER 113           HB2      SER 113 -13.559 -18.430  -2.431
  855    HG   SER 113           HG       SER 113 -15.758 -17.845  -1.909
  856    H    ARG 114           H        ARG 114 -14.539 -19.861   1.157
  857    HA   ARG 114           HA       ARG 114 -13.519 -22.513   0.666
  858    HB2  ARG 114           HB3      ARG 114 -14.374 -21.678   2.888
  859    HB3  ARG 114           HB2      ARG 114 -15.993 -21.711   2.209
  860    HG2  ARG 114           HG3      ARG 114 -15.808 -24.120   1.865
  861    HG3  ARG 114           HG2      ARG 114 -14.171 -24.089   2.527
  862    HD2  ARG 114           HD3      ARG 114 -15.783 -24.816   4.206
  863    HD3  ARG 114           HD2      ARG 114 -15.040 -23.283   4.656
  864    HE   ARG 114           HE       ARG 114 -17.674 -23.325   3.353
  865   HH11  ARG 114          HH11      ARG 114 -15.654 -22.543   6.106
  866   HH12  ARG 114          HH12      ARG 114 -16.879 -21.606   6.900
  867   HH21  ARG 114          HH21      ARG 114 -19.289 -22.097   4.406
  868   HH22  ARG 114          HH22      ARG 114 -18.943 -21.357   5.936
  869    H    LYS 115           H        LYS 115 -15.158 -20.631  -1.253
  870    HA   LYS 115           HA       LYS 115 -16.436 -20.913  -3.104
  871    HB2  LYS 115           HB3      LYS 115 -16.441 -23.867  -2.428
  872    HB3  LYS 115           HB2      LYS 115 -16.910 -23.163  -3.966
  873    HG2  LYS 115           HG3      LYS 115 -14.547 -22.294  -4.150
  874    HG3  LYS 115           HG2      LYS 115 -14.164 -23.299  -2.747
  875    HD2  LYS 115           HD3      LYS 115 -15.238 -24.248  -5.398
  876    HD3  LYS 115           HD2      LYS 115 -13.604 -24.481  -4.784
  877    HE2  LYS 115           HE3      LYS 115 -16.108 -25.570  -3.516
  878    HE3  LYS 115           HE2      LYS 115 -15.019 -26.488  -4.551
  879    HZ1  LYS 115           HZ1      LYS 115 -13.248 -26.128  -2.939
  880    HZ2  LYS 115           HZ2      LYS 115 -14.571 -26.906  -2.226
  881    HZ3  LYS 115           HZ3      LYS 115 -14.310 -25.264  -1.940
  882    H    ALA 116           H        ALA 116 -17.553 -20.251  -0.623
  883    HA   ALA 116           HA       ALA 116 -19.990 -21.729  -0.241
  884    HB1  ALA 116           HB1      ALA 116 -20.506 -20.062   1.454
  885    HB2  ALA 116           HB2      ALA 116 -19.150 -19.072   0.914
  886    HB3  ALA 116           HB3      ALA 116 -18.854 -20.651   1.644
  887    H    THR 117           H        THR 117 -19.554 -18.254  -0.853
  888    HA   THR 117           HA       THR 117 -21.390 -18.286  -3.060
  889    HB   THR 117           HB       THR 117 -23.008 -18.329  -1.255
  890    HG1  THR 117           HG1      THR 117 -23.342 -15.678  -1.708
  891   HG21  THR 117          HG21      THR 117 -21.595 -15.889  -0.172
  892   HG22  THR 117          HG22      THR 117 -21.596 -17.496   0.555
  893   HG23  THR 117          HG23      THR 117 -23.096 -16.573   0.453
  894    H    ARG 118           H        ARG 118 -21.531 -16.167  -4.084
  895    HA   ARG 118           HA       ARG 118 -19.603 -14.197  -3.090
  896    HB2  ARG 118           HB3      ARG 118 -18.966 -15.795  -5.193
  897    HB3  ARG 118           HB2      ARG 118 -19.780 -14.493  -6.036
  898    HG2  ARG 118           HG3      ARG 118 -17.411 -14.206  -4.202
  899    HG3  ARG 118           HG2      ARG 118 -17.384 -14.133  -5.963
  900    HD2  ARG 118           HD3      ARG 118 -18.597 -12.106  -5.994
  901    HD3  ARG 118           HD2      ARG 118 -19.039 -12.255  -4.295
  902    HE   ARG 118           HE       ARG 118 -16.368 -12.133  -4.153
  903   HH11  ARG 118          HH11      ARG 118 -18.665 -10.167  -5.917
  904   HH12  ARG 118          HH12      ARG 118 -17.718  -8.720  -5.781
  905   HH21  ARG 118          HH21      ARG 118 -15.136 -10.242  -3.954
  906   HH22  ARG 118          HH22      ARG 118 -15.705  -8.761  -4.664
  907    H1   SER   1           H1       SER   1 -28.960  -5.674   2.891
  908    H2   SER   1           H2       SER   1 -27.440  -5.689   3.628
  909    H3   SER   1           H3       SER   1 -28.437  -7.052   3.713
  910    HA   SER   1           HA       SER   1 -26.652  -7.338   2.116
  911    HB2  SER   1           HB3      SER   1 -29.399  -7.141   0.853
  912    HB3  SER   1           HB2      SER   1 -28.066  -8.158   0.305
  913    HG   SER   1           HG       SER   1 -29.857  -9.019   1.800
  914    H    SER   2           H        SER   2 -25.713  -6.756   0.149
  915    HA   SER   2           HA       SER   2 -24.895  -5.479  -1.489
  916    HB2  SER   2           HB3      SER   2 -26.312  -3.982  -2.758
  917    HB3  SER   2           HB2      SER   2 -27.197  -5.449  -2.357
  918    HG   SER   2           HG       SER   2 -27.967  -4.093  -0.479
  919    H    THR   3           H        THR   3 -26.275  -3.586   1.156
  920    HA   THR   3           HA       THR   3 -24.876  -1.196   0.673
  921    HB   THR   3           HB       THR   3 -25.559  -2.238   3.421
  922    HG1  THR   3           HG1      THR   3 -27.617  -1.105   2.974
  923   HG21  THR   3          HG21      THR   3 -25.898   0.129   3.923
  924   HG22  THR   3          HG22      THR   3 -25.496   0.548   2.259
  925   HG23  THR   3          HG23      THR   3 -24.268  -0.154   3.313
  926    H    HIS   4           H        HIS   4 -24.024  -4.079   2.526
  927    HA   HIS   4           HA       HIS   4 -21.209  -3.401   2.229
  928    HB2  HIS   4           HB3      HIS   4 -21.969  -2.485   4.454
  929    HB3  HIS   4           HB2      HIS   4 -22.363  -4.127   4.932
  930    HD1  HIS   4           HD1      HIS   4 -19.507  -1.797   4.473
  931    HD2  HIS   4           HD2      HIS   4 -20.133  -5.777   5.480
  932    HE1  HIS   4           HE1      HIS   4 -17.318  -2.610   5.399
  933    HE2  HIS   4           HE2      HIS   4 -17.800  -4.939   6.217
  934    HA   PRO   5           HA       PRO   5 -22.174  -7.834   1.429
  935    HB2  PRO   5           HB3      PRO   5 -20.563  -8.111  -0.716
  936    HB3  PRO   5           HB2      PRO   5 -22.172  -7.385  -0.841
  937    HG2  PRO   5           HG3      PRO   5 -19.498  -6.045  -0.659
  938    HG3  PRO   5           HG2      PRO   5 -20.859  -5.668  -1.729
  939    HD2  PRO   5           HD3      PRO   5 -20.338  -4.274   0.545
  940    HD3  PRO   5           HD2      PRO   5 -21.981  -4.493  -0.091
  941    H    VAL   6           H        VAL   6 -20.795  -7.483   3.564
  942    HA   VAL   6           HA       VAL   6 -19.101  -8.176   4.905
  943    HB   VAL   6           HB       VAL   6 -18.344 -10.111   2.724
  944   HG11  VAL   6          HG11      VAL   6 -17.745 -11.579   4.582
  945   HG12  VAL   6          HG12      VAL   6 -18.233 -10.328   5.726
  946   HG13  VAL   6          HG13      VAL   6 -16.860 -10.055   4.654
  947   HG21  VAL   6          HG21      VAL   6 -20.575 -10.407   4.722
  948   HG22  VAL   6          HG22      VAL   6 -19.999 -11.664   3.627
  949   HG23  VAL   6          HG23      VAL   6 -20.756 -10.209   2.979
  950    H    PHE   7           H        PHE   7 -18.654  -6.110   2.812
  951    HA   PHE   7           HA       PHE   7 -17.012  -4.791   1.974
  952    HB2  PHE   7           HB3      PHE   7 -16.224  -4.943   4.356
  953    HB3  PHE   7           HB2      PHE   7 -15.183  -6.275   3.878
  954    HD1  PHE   7           HD1      PHE   7 -13.008  -5.821   3.263
  955    HD2  PHE   7           HD2      PHE   7 -15.919  -2.728   3.014
  956    HE1  PHE   7           HE1      PHE   7 -11.241  -4.210   2.693
  957    HE2  PHE   7           HE2      PHE   7 -14.158  -1.110   2.437
  958    HZ   PHE   7           HZ       PHE   7 -11.816  -1.848   2.276
  959    H    HIS   8           H        HIS   8 -17.596  -6.472   0.190
  960    HA   HIS   8           HA       HIS   8 -16.948  -7.623  -1.663
  961    HB2  HIS   8           HB3      HIS   8 -14.164  -6.783  -0.818
  962    HB3  HIS   8           HB2      HIS   8 -14.557  -7.531  -2.358
  963    HD1  HIS   8           HD1      HIS   8 -15.186  -5.990  -4.219
  964    HD2  HIS   8           HD2      HIS   8 -15.326  -4.122  -0.508
  965    HE1  HIS   8           HE1      HIS   8 -15.539  -3.548  -4.705
  966    HE2  HIS   8           HE2      HIS   8 -15.512  -2.423  -2.450
  967    H    MET   9           H        MET   9 -17.401  -9.030   0.710
  968    HA   MET   9           HA       MET   9 -17.184 -11.076   1.663
  969    HB2  MET   9           HB3      MET   9 -15.266 -11.611  -0.605
  970    HB3  MET   9           HB2      MET   9 -15.708 -12.808   0.598
  971    HG2  MET   9           HG3      MET   9 -18.080 -12.551  -0.103
  972    HG3  MET   9           HG2      MET   9 -17.532 -11.488  -1.395
  973    HE1  MET   9           HE1      MET   9 -16.318 -15.926  -1.050
  974    HE2  MET   9           HE2      MET   9 -17.336 -15.091   0.121
  975    HE3  MET   9           HE3      MET   9 -15.634 -14.658  -0.035
  976    H    GLY  10           H        GLY  10 -14.719  -8.874   1.413
  977    HA2  GLY  10           HA3      GLY  10 -13.206  -8.426   3.184
  978    HA3  GLY  10           HA2      GLY  10 -13.262 -10.127   3.626
  979    H    GLU  11           H        GLU  11 -11.382  -7.811   2.223
  980    HA   GLU  11           HA       GLU  11 -10.127  -9.419   0.223
  981    HB2  GLU  11           HB3      GLU  11  -8.356  -7.570   0.329
  982    HB3  GLU  11           HB2      GLU  11  -9.972  -7.130  -0.201
  983    HG2  GLU  11           HG3      GLU  11 -10.366  -6.434   2.243
  984    HG3  GLU  11           HG2      GLU  11  -8.607  -6.504   2.389
  985    H    PHE  12           H        PHE  12  -9.913 -11.261   1.593
  986    HA   PHE  12           HA       PHE  12  -8.315 -11.454   3.859
  987    HB2  PHE  12           HB3      PHE  12  -8.841 -13.547   1.737
  988    HB3  PHE  12           HB2      PHE  12  -8.151 -13.874   3.324
  989    HD1  PHE  12           HD1      PHE  12 -11.074 -13.949   1.468
  990    HD2  PHE  12           HD2      PHE  12  -9.625 -12.873   5.320
  991    HE1  PHE  12           HE1      PHE  12 -13.341 -14.211   2.390
  992    HE2  PHE  12           HE2      PHE  12 -11.885 -13.139   6.250
  993    HZ   PHE  12           HZ       PHE  12 -13.747 -13.808   4.785
  994    H    SER  13           H        SER  13  -6.224 -11.509   4.216
  995    HA   SER  13           HA       SER  13  -4.397 -11.566   1.926
  996    HB2  SER  13           HB3      SER  13  -3.887 -10.718   4.794
  997    HB3  SER  13           HB2      SER  13  -2.766 -10.545   3.449
  998    HG   SER  13           HG       SER  13  -5.276  -9.431   3.079
  999    H    VAL  14           H        VAL  14  -2.987 -13.229   1.671
 1000    HA   VAL  14           HA       VAL  14  -3.370 -15.658   3.029
 1001    HB   VAL  14           HB       VAL  14  -1.327 -16.453   1.874
 1002   HG11  VAL  14          HG11      VAL  14  -2.162 -16.149  -0.417
 1003   HG12  VAL  14          HG12      VAL  14  -3.229 -14.867   0.156
 1004   HG13  VAL  14          HG13      VAL  14  -3.459 -16.522   0.719
 1005   HG21  VAL  14          HG21      VAL  14  -0.009 -14.394   1.999
 1006   HG22  VAL  14          HG22      VAL  14  -1.117 -13.615   0.868
 1007   HG23  VAL  14          HG23      VAL  14  -0.133 -14.979   0.339
 1008    H    CYS  15           H        CYS  15  -1.449 -12.943   3.775
 1009    HA   CYS  15           HA       CYS  15  -0.483 -14.341   6.173
 1010    HB2  CYS  15           HB3      CYS  15   1.342 -13.630   4.545
 1011    HB3  CYS  15           HB2      CYS  15   0.875 -11.962   4.882
 1012    H    ASP  16           H        ASP  16  -1.182 -13.450   8.044
 1013    HA   ASP  16           HA       ASP  16  -3.425 -11.825   7.987
 1014    HB2  ASP  16           HB3      ASP  16  -1.560 -12.470  10.276
 1015    HB3  ASP  16           HB2      ASP  16  -3.067 -11.585  10.483
 1016    H    SER  17           H        SER  17  -3.637  -9.804   7.490
 1017    HA   SER  17           HA       SER  17  -1.679  -7.858   8.489
 1018    HB2  SER  17           HB3      SER  17  -3.052  -7.795   5.785
 1019    HB3  SER  17           HB2      SER  17  -1.954  -6.563   6.413
 1020    HG   SER  17           HG       SER  17  -1.295  -9.288   5.923
 1021    H    VAL  18           H        VAL  18  -2.533  -5.894   9.172
 1022    HA   VAL  18           HA       VAL  18  -5.467  -5.832   9.386
 1023    HB   VAL  18           HB       VAL  18  -4.470  -6.247  11.556
 1024   HG11  VAL  18          HG11      VAL  18  -2.905  -3.713  11.106
 1025   HG12  VAL  18          HG12      VAL  18  -2.259  -5.351  11.214
 1026   HG13  VAL  18          HG13      VAL  18  -2.994  -4.599  12.630
 1027   HG21  VAL  18          HG21      VAL  18  -5.397  -4.337  12.799
 1028   HG22  VAL  18          HG22      VAL  18  -6.467  -4.895  11.515
 1029   HG23  VAL  18          HG23      VAL  18  -5.506  -3.433  11.290
 1030    H    SER  19           H        SER  19  -6.397  -4.198   8.351
 1031    HA   SER  19           HA       SER  19  -4.762  -1.925   7.532
 1032    HB2  SER  19           HB3      SER  19  -6.915  -1.387   6.193
 1033    HB3  SER  19           HB2      SER  19  -5.946  -2.773   5.692
 1034    HG   SER  19           HG       SER  19  -7.415  -4.140   6.575
 1035    H    VAL  20           H        VAL  20  -4.703  -0.215   8.801
 1036    HA   VAL  20           HA       VAL  20  -7.088   0.434  10.415
 1037    HB   VAL  20           HB       VAL  20  -4.195   0.967  11.110
 1038   HG11  VAL  20          HG11      VAL  20  -5.664   2.658  12.020
 1039   HG12  VAL  20          HG12      VAL  20  -5.065   1.614  13.308
 1040   HG13  VAL  20          HG13      VAL  20  -6.710   1.413  12.704
 1041   HG21  VAL  20          HG21      VAL  20  -4.699  -1.402  11.246
 1042   HG22  VAL  20          HG22      VAL  20  -6.113  -1.061  12.243
 1043   HG23  VAL  20          HG23      VAL  20  -4.497  -0.720  12.861
 1044    H    TRP  21           H        TRP  21  -7.854   2.478  10.313
 1045    HA   TRP  21           HA       TRP  21  -6.408   4.416   8.666
 1046    HB2  TRP  21           HB3      TRP  21  -9.247   4.355   9.712
 1047    HB3  TRP  21           HB2      TRP  21  -8.548   5.774   8.941
 1048    HD1  TRP  21           HD1      TRP  21 -10.045   2.382   8.156
 1049    HE1  TRP  21           HE1      TRP  21 -10.263   2.123   5.602
 1050    HE3  TRP  21           HE3      TRP  21  -7.365   6.487   6.686
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.408   3.476   3.279
 1052    HZ3  TRP  21           HZ3      TRP  21  -7.111   6.930   4.279
 1053    HH2  TRP  21           HH2      TRP  21  -8.108   5.455   2.615
 1054    H    VAL  22           H        VAL  22  -4.837   5.208   9.950
 1055    HA   VAL  22           HA       VAL  22  -5.357   5.857  12.720
 1056    HB   VAL  22           HB       VAL  22  -2.864   6.379  11.094
 1057   HG11  VAL  22          HG11      VAL  22  -1.742   6.482  13.258
 1058   HG12  VAL  22          HG12      VAL  22  -3.285   6.237  14.074
 1059   HG13  VAL  22          HG13      VAL  22  -3.008   7.704  13.135
 1060   HG21  VAL  22          HG21      VAL  22  -3.550   4.012  12.832
 1061   HG22  VAL  22          HG22      VAL  22  -1.981   4.319  12.083
 1062   HG23  VAL  22          HG23      VAL  22  -3.394   4.005  11.076
 1063    H    GLY  23           H        GLY  23  -6.468   7.660  13.123
 1064    HA2  GLY  23           HA3      GLY  23  -6.055   9.995  11.382
 1065    HA3  GLY  23           HA2      GLY  23  -7.428   9.746  12.459
 1066    H    ASP  24           H        ASP  24  -4.621   8.850  14.006
 1067    HA   ASP  24           HA       ASP  24  -4.107  11.531  15.073
 1068    HB2  ASP  24           HB3      ASP  24  -4.861   9.093  16.688
 1069    HB3  ASP  24           HB2      ASP  24  -4.004  10.458  17.397
 1070    H    LYS  25           H        LYS  25  -2.511  10.173  13.262
 1071    HA   LYS  25           HA       LYS  25  -0.402   8.781  14.622
 1072    HB2  LYS  25           HB3      LYS  25  -1.073   8.496  12.184
 1073    HB3  LYS  25           HB2      LYS  25  -0.287  10.036  11.878
 1074    HG2  LYS  25           HG3      LYS  25   1.833   9.133  12.625
 1075    HG3  LYS  25           HG2      LYS  25   1.060   7.591  13.002
 1076    HD2  LYS  25           HD3      LYS  25   0.395   7.435  10.597
 1077    HD3  LYS  25           HD2      LYS  25   1.370   8.873  10.294
 1078    HE2  LYS  25           HE3      LYS  25   2.662   6.907   9.743
 1079    HE3  LYS  25           HE2      LYS  25   3.348   7.676  11.176
 1080    HZ1  LYS  25           HZ1      LYS  25   1.499   5.346  11.239
 1081    HZ2  LYS  25           HZ2      LYS  25   2.310   6.035  12.560
 1082    HZ3  LYS  25           HZ3      LYS  25   3.188   5.242  11.353
 1083    H    THR  26           H        THR  26   1.424   9.636  15.510
 1084    HA   THR  26           HA       THR  26   1.711  12.554  15.292
 1085    HB   THR  26           HB       THR  26   0.953  11.907  17.518
 1086    HG1  THR  26           HG1      THR  26   3.519  12.993  17.132
 1087   HG21  THR  26          HG21      THR  26   3.486  10.267  17.631
 1088   HG22  THR  26          HG22      THR  26   1.833   9.652  17.652
 1089   HG23  THR  26          HG23      THR  26   2.436  10.607  19.006
 1090    H    THR  27           H        THR  27   3.342   9.558  14.846
 1091    HA   THR  27           HA       THR  27   5.785  11.067  14.269
 1092    HB   THR  27           HB       THR  27   7.091   9.043  15.130
 1093    HG1  THR  27           HG1      THR  27   5.391   8.448  17.103
 1094   HG21  THR  27          HG21      THR  27   7.170  11.202  16.229
 1095   HG22  THR  27          HG22      THR  27   7.122   9.912  17.431
 1096   HG23  THR  27          HG23      THR  27   5.668  10.849  17.083
 1097    H    ALA  28           H        ALA  28   6.892  10.443  12.495
 1098    HA   ALA  28           HA       ALA  28   6.510   7.787  11.397
 1099    HB1  ALA  28           HB1      ALA  28   4.656   9.081  10.401
 1100    HB2  ALA  28           HB2      ALA  28   5.815   8.501   9.205
 1101    HB3  ALA  28           HB3      ALA  28   5.840  10.192   9.711
 1102    H    THR  29           H        THR  29   7.975   7.414   9.540
 1103    HA   THR  29           HA       THR  29  10.445   8.939   9.937
 1104    HB   THR  29           HB       THR  29  10.105   6.229   8.640
 1105    HG1  THR  29           HG1      THR  29   9.679   6.650  11.084
 1106   HG21  THR  29          HG21      THR  29  12.138   7.448   7.978
 1107   HG22  THR  29          HG22      THR  29  12.518   6.035   8.965
 1108   HG23  THR  29          HG23      THR  29  12.565   7.647   9.679
 1109    H    ASP  30           H        ASP  30  11.020  10.329   8.465
 1110    HA   ASP  30           HA       ASP  30   9.683  10.727   6.011
 1111    HB2  ASP  30           HB3      ASP  30  10.782  12.563   7.182
 1112    HB3  ASP  30           HB2      ASP  30  12.344  11.760   7.038
 1113    H    ILE  31           H        ILE  31  10.779  10.733   3.866
 1114    HA   ILE  31           HA       ILE  31  11.618   8.152   3.183
 1115    HB   ILE  31           HB       ILE  31  10.502   9.649   1.602
 1116   HG12  ILE  31          HG13      ILE  31  13.260   8.894   0.608
 1117   HG13  ILE  31          HG12      ILE  31  11.909   7.774   0.763
 1118   HG21  ILE  31          HG21      ILE  31  11.703  11.481   0.522
 1119   HG22  ILE  31          HG22      ILE  31  13.083  11.205   1.584
 1120   HG23  ILE  31          HG23      ILE  31  11.548  11.746   2.259
 1121   HD11  ILE  31          HD11      ILE  31  12.168   8.501  -1.528
 1122   HD12  ILE  31          HD12      ILE  31  12.018  10.186  -1.031
 1123   HD13  ILE  31          HD13      ILE  31  10.645   9.093  -0.865
 1124    H    LYS  32           H        LYS  32  13.450  10.956   4.151
 1125    HA   LYS  32           HA       LYS  32  15.963   9.869   3.219
 1126    HB2  LYS  32           HB3      LYS  32  15.370  12.236   4.995
 1127    HB3  LYS  32           HB2      LYS  32  16.946  11.841   4.318
 1128    HG2  LYS  32           HG3      LYS  32  16.029  12.132   2.059
 1129    HG3  LYS  32           HG2      LYS  32  14.470  12.560   2.763
 1130    HD2  LYS  32           HD3      LYS  32  15.522  14.448   3.902
 1131    HD3  LYS  32           HD2      LYS  32  17.065  14.043   3.152
 1132    HE2  LYS  32           HE3      LYS  32  16.014  14.350   0.934
 1133    HE3  LYS  32           HE2      LYS  32  14.529  14.848   1.742
 1134    HZ1  LYS  32           HZ1      LYS  32  15.778  16.684   2.753
 1135    HZ2  LYS  32           HZ2      LYS  32  15.770  16.769   1.067
 1136    HZ3  LYS  32           HZ3      LYS  32  17.152  16.229   1.877
 1137    H    GLY  33           H        GLY  33  13.979   9.342   5.866
 1138    HA2  GLY  33           HA3      GLY  33  14.486   7.583   7.396
 1139    HA3  GLY  33           HA2      GLY  33  16.194   7.978   7.237
 1140    H    LYS  34           H        LYS  34  14.016  10.602   7.637
 1141    HA   LYS  34           HA       LYS  34  15.080  11.069  10.317
 1142    HB2  LYS  34           HB3      LYS  34  13.479  12.856   8.478
 1143    HB3  LYS  34           HB2      LYS  34  14.134  13.339  10.033
 1144    HG2  LYS  34           HG3      LYS  34  15.772  12.456   7.669
 1145    HG3  LYS  34           HG2      LYS  34  15.474  14.126   8.132
 1146    HD2  LYS  34           HD3      LYS  34  16.533  13.677  10.313
 1147    HD3  LYS  34           HD2      LYS  34  16.907  12.040   9.770
 1148    HE2  LYS  34           HE3      LYS  34  18.299  12.922   7.993
 1149    HE3  LYS  34           HE2      LYS  34  17.851  14.567   8.429
 1150    HZ1  LYS  34           HZ1      LYS  34  19.314  12.685  10.197
 1151    HZ2  LYS  34           HZ2      LYS  34  18.961  14.302  10.535
 1152    HZ3  LYS  34           HZ3      LYS  34  20.037  13.914   9.290
 1153    H    GLU  35           H        GLU  35  13.884  10.665  12.087
 1154    HA   GLU  35           HA       GLU  35  11.091   9.979  11.804
 1155    HB2  GLU  35           HB3      GLU  35  12.487   8.715  13.372
 1156    HB3  GLU  35           HB2      GLU  35  12.824  10.189  14.268
 1157    HG2  GLU  35           HG3      GLU  35  10.505  10.384  14.901
 1158    HG3  GLU  35           HG2      GLU  35  10.096   8.971  13.931
 1159    H    VAL  36           H        VAL  36   9.562  11.445  11.776
 1160    HA   VAL  36           HA       VAL  36  10.052  14.010  13.129
 1161    HB   VAL  36           HB       VAL  36   8.758  15.088  11.265
 1162   HG11  VAL  36          HG11      VAL  36  10.649  15.121   9.695
 1163   HG12  VAL  36          HG12      VAL  36  11.351  13.735  10.532
 1164   HG13  VAL  36          HG13      VAL  36  11.175  15.276  11.372
 1165   HG21  VAL  36          HG21      VAL  36   7.674  13.077  10.394
 1166   HG22  VAL  36          HG22      VAL  36   9.244  12.445   9.893
 1167   HG23  VAL  36          HG23      VAL  36   8.597  13.902   9.136
 1168    H    THR  37           H        THR  37   8.139  15.230  13.639
 1169    HA   THR  37           HA       THR  37   6.079  13.506  14.711
 1170    HB   THR  37           HB       THR  37   6.406  16.493  14.987
 1171    HG1  THR  37           HG1      THR  37   7.969  14.601  15.911
 1172   HG21  THR  37          HG21      THR  37   5.001  16.227  16.979
 1173   HG22  THR  37          HG22      THR  37   4.837  14.506  16.634
 1174   HG23  THR  37          HG23      THR  37   4.154  15.697  15.526
 1175    H    VAL  38           H        VAL  38   4.361  13.045  13.559
 1176    HA   VAL  38           HA       VAL  38   3.643  14.608  11.238
 1177    HB   VAL  38           HB       VAL  38   2.354  12.116  12.368
 1178   HG11  VAL  38          HG11      VAL  38   2.052  13.427   9.670
 1179   HG12  VAL  38          HG12      VAL  38   0.832  13.369  10.941
 1180   HG13  VAL  38          HG13      VAL  38   1.351  11.881  10.147
 1181   HG21  VAL  38          HG21      VAL  38   4.353  12.429  10.136
 1182   HG22  VAL  38          HG22      VAL  38   3.565  10.926  10.614
 1183   HG23  VAL  38          HG23      VAL  38   4.671  11.734  11.725
 1184    H    LEU  39           H        LEU  39   2.015  16.019  11.105
 1185    HA   LEU  39           HA       LEU  39   0.332  16.426  13.454
 1186    HB2  LEU  39           HB3      LEU  39   0.507  18.051  10.906
 1187    HB3  LEU  39           HB2      LEU  39  -0.322  18.512  12.383
 1188    HG   LEU  39           HG       LEU  39   2.661  18.149  12.116
 1189   HD11  LEU  39          HD11      LEU  39   2.753  20.590  12.332
 1190   HD12  LEU  39          HD12      LEU  39   0.990  20.647  12.261
 1191   HD13  LEU  39          HD13      LEU  39   1.912  20.079  10.870
 1192   HD21  LEU  39          HD21      LEU  39   0.987  19.189  14.395
 1193   HD22  LEU  39          HD22      LEU  39   2.750  19.201  14.325
 1194   HD23  LEU  39          HD23      LEU  39   1.880  17.668  14.362
 1195    H    ALA  40           H        ALA  40  -1.569  15.444  13.534
 1196    HA   ALA  40           HA       ALA  40  -2.636  14.034  11.289
 1197    HB1  ALA  40           HB1      ALA  40  -2.843  13.193  13.586
 1198    HB2  ALA  40           HB2      ALA  40  -4.414  13.363  12.804
 1199    HB3  ALA  40           HB3      ALA  40  -3.884  14.560  13.983
 1200    H    GLU  41           H        GLU  41  -2.833  17.185  12.369
 1201    HA   GLU  41           HA       GLU  41  -5.013  17.732  10.485
 1202    HB2  GLU  41           HB3      GLU  41  -4.556  19.115  13.135
 1203    HB3  GLU  41           HB2      GLU  41  -5.766  19.568  11.946
 1204    HG2  GLU  41           HG3      GLU  41  -6.874  17.423  12.253
 1205    HG3  GLU  41           HG2      GLU  41  -5.649  16.956  13.427
 1206    H    VAL  42           H        VAL  42  -4.186  18.899   8.863
 1207    HA   VAL  42           HA       VAL  42  -1.671  20.295   9.304
 1208    HB   VAL  42           HB       VAL  42  -1.481  20.492   6.906
 1209   HG11  VAL  42          HG11      VAL  42  -1.441  18.148   6.272
 1210   HG12  VAL  42          HG12      VAL  42  -2.479  17.746   7.640
 1211   HG13  VAL  42          HG13      VAL  42  -0.851  18.360   7.919
 1212   HG21  VAL  42          HG21      VAL  42  -4.248  19.307   6.726
 1213   HG22  VAL  42          HG22      VAL  42  -3.178  19.655   5.368
 1214   HG23  VAL  42          HG23      VAL  42  -3.810  20.974   6.355
 1215    H    ASN  43           H        ASN  43  -1.450  22.420   9.408
 1216    HA   ASN  43           HA       ASN  43  -3.889  24.041   9.268
 1217    HB2  ASN  43           HB3      ASN  43  -1.201  24.675  10.523
 1218    HB3  ASN  43           HB2      ASN  43  -2.631  25.697  10.598
 1219   HD21  ASN  43          HD21      ASN  43  -1.084  22.838  11.790
 1220   HD22  ASN  43          HD22      ASN  43  -2.187  22.524  13.082
 1221    H    ILE  44           H        ILE  44  -4.116  24.651   7.182
 1222    HA   ILE  44           HA       ILE  44  -1.779  25.912   5.900
 1223    HB   ILE  44           HB       ILE  44  -4.154  24.617   4.546
 1224   HG12  ILE  44          HG13      ILE  44  -2.700  22.944   5.579
 1225   HG13  ILE  44          HG12      ILE  44  -2.544  22.891   3.825
 1226   HG21  ILE  44          HG21      ILE  44  -1.636  25.809   3.388
 1227   HG22  ILE  44          HG22      ILE  44  -3.269  26.454   3.236
 1228   HG23  ILE  44          HG23      ILE  44  -2.854  24.918   2.477
 1229   HD11  ILE  44          HD11      ILE  44  -0.386  22.650   4.912
 1230   HD12  ILE  44          HD12      ILE  44  -0.612  24.193   5.733
 1231   HD13  ILE  44          HD13      ILE  44  -0.452  24.144   3.978
 1232    H    ASN  45           H        ASN  45  -2.142  27.950   6.705
 1233    HA   ASN  45           HA       ASN  45  -2.948  30.070   6.750
 1234    HB2  ASN  45           HB3      ASN  45  -4.204  29.095   4.182
 1235    HB3  ASN  45           HB2      ASN  45  -4.460  30.733   4.767
 1236   HD21  ASN  45          HD21      ASN  45  -1.416  29.062   5.232
 1237   HD22  ASN  45          HD22      ASN  45  -0.512  30.020   4.109
 1238    H    ASN  46           H        ASN  46  -4.074  28.694   8.585
 1239    HA   ASN  46           HA       ASN  46  -5.772  28.769  10.082
 1240    HB2  ASN  46           HB3      ASN  46  -6.243  31.058   9.314
 1241    HB3  ASN  46           HB2      ASN  46  -7.266  30.419   8.033
 1242   HD21  ASN  46          HD21      ASN  46  -6.950  30.943  11.462
 1243   HD22  ASN  46          HD22      ASN  46  -8.618  30.694  11.852
 1244    H    SER  47           H        SER  47  -6.208  27.591   6.903
 1245    HA   SER  47           HA       SER  47  -8.676  26.201   7.530
 1246    HB2  SER  47           HB3      SER  47  -8.243  27.124   5.243
 1247    HB3  SER  47           HB2      SER  47  -6.922  25.970   5.067
 1248    HG   SER  47           HG       SER  47  -8.870  25.213   4.134
 1249    H    VAL  48           H        VAL  48  -8.639  24.393   8.642
 1250    HA   VAL  48           HA       VAL  48  -6.153  22.851   8.758
 1251    HB   VAL  48           HB       VAL  48  -8.544  22.744  10.603
 1252   HG11  VAL  48          HG11      VAL  48  -5.800  21.525  10.866
 1253   HG12  VAL  48          HG12      VAL  48  -7.300  20.654  10.545
 1254   HG13  VAL  48          HG13      VAL  48  -7.073  21.478  12.087
 1255   HG21  VAL  48          HG21      VAL  48  -5.865  24.074  10.981
 1256   HG22  VAL  48          HG22      VAL  48  -7.130  23.939  12.202
 1257   HG23  VAL  48          HG23      VAL  48  -7.408  24.893  10.746
 1258    H    PHE  49           H        PHE  49  -6.022  21.031   7.676
 1259    HA   PHE  49           HA       PHE  49  -8.495  19.518   7.135
 1260    HB2  PHE  49           HB3      PHE  49  -5.952  19.690   5.500
 1261    HB3  PHE  49           HB2      PHE  49  -7.216  18.501   5.207
 1262    HD1  PHE  49           HD1      PHE  49  -6.073  21.825   4.567
 1263    HD2  PHE  49           HD2      PHE  49  -9.533  19.345   4.630
 1264    HE1  PHE  49           HE1      PHE  49  -7.247  23.423   3.103
 1265    HE2  PHE  49           HE2      PHE  49 -10.706  20.936   3.172
 1266    HZ   PHE  49           HZ       PHE  49  -9.565  22.977   2.406
 1267    H    ARG  50           H        ARG  50  -8.631  17.599   8.131
 1268    HA   ARG  50           HA       ARG  50  -6.161  16.468   9.235
 1269    HB2  ARG  50           HB3      ARG  50  -7.573  15.140  10.714
 1270    HB3  ARG  50           HB2      ARG  50  -7.953  16.844  10.857
 1271    HG2  ARG  50           HG3      ARG  50  -9.961  16.550   9.564
 1272    HG3  ARG  50           HG2      ARG  50  -9.551  14.859   9.262
 1273    HD2  ARG  50           HD3      ARG  50 -11.226  15.203  11.087
 1274    HD3  ARG  50           HD2      ARG  50  -9.782  14.314  11.574
 1275    HE   ARG  50           HE       ARG  50  -9.509  17.106  12.067
 1276   HH11  ARG  50          HH11      ARG  50 -11.028  14.212  13.320
 1277   HH12  ARG  50          HH12      ARG  50 -10.992  14.752  14.967
 1278   HH21  ARG  50          HH21      ARG  50  -9.438  17.817  14.244
 1279   HH22  ARG  50          HH22      ARG  50 -10.097  16.803  15.490
 1280    H    GLN  51           H        GLN  51  -5.500  14.407   8.799
 1281    HA   GLN  51           HA       GLN  51  -6.937  13.082   6.598
 1282    HB2  GLN  51           HB3      GLN  51  -4.694  12.103   5.977
 1283    HB3  GLN  51           HB2      GLN  51  -4.864  13.829   5.714
 1284    HG2  GLN  51           HG3      GLN  51  -3.697  12.935   8.287
 1285    HG3  GLN  51           HG2      GLN  51  -2.716  12.772   6.830
 1286   HE21  GLN  51          HE21      GLN  51  -2.067  14.614   5.726
 1287   HE22  GLN  51          HE22      GLN  51  -2.128  16.186   6.444
 1288    H    TYR  52           H        TYR  52  -6.575  10.741   6.454
 1289    HA   TYR  52           HA       TYR  52  -6.113   9.484   9.074
 1290    HB2  TYR  52           HB3      TYR  52  -8.049   8.494   6.955
 1291    HB3  TYR  52           HB2      TYR  52  -7.822   7.835   8.572
 1292    HD1  TYR  52           HD1      TYR  52  -8.548   9.221  10.558
 1293    HD2  TYR  52           HD2      TYR  52  -9.543  10.270   6.557
 1294    HE1  TYR  52           HE1      TYR  52 -10.335  10.684  11.389
 1295    HE2  TYR  52           HE2      TYR  52 -11.335  11.737   7.380
 1296    HH   TYR  52           HH       TYR  52 -11.649  12.545  10.722
 1297    H    PHE  53           H        PHE  53  -4.461   8.093   9.019
 1298    HA   PHE  53           HA       PHE  53  -3.266   7.520   6.431
 1299    HB2  PHE  53           HB3      PHE  53  -2.251   7.018   9.241
 1300    HB3  PHE  53           HB2      PHE  53  -1.334   6.709   7.767
 1301    HD1  PHE  53           HD1      PHE  53  -0.711   8.618   6.297
 1302    HD2  PHE  53           HD2      PHE  53  -2.395   9.183  10.161
 1303    HE1  PHE  53           HE1      PHE  53   0.091  10.945   6.299
 1304    HE2  PHE  53           HE2      PHE  53  -1.604  11.510  10.171
 1305    HZ   PHE  53           HZ       PHE  53  -0.360  12.394   8.241
 1306    H    PHE  54           H        PHE  54  -3.735   5.750   5.392
 1307    HA   PHE  54           HA       PHE  54  -5.024   3.526   6.715
 1308    HB2  PHE  54           HB3      PHE  54  -5.816   4.319   4.511
 1309    HB3  PHE  54           HB2      PHE  54  -4.247   3.945   3.812
 1310    HD1  PHE  54           HD1      PHE  54  -7.105   2.343   5.578
 1311    HD2  PHE  54           HD2      PHE  54  -3.892   1.890   2.827
 1312    HE1  PHE  54           HE1      PHE  54  -7.911   0.092   5.015
 1313    HE2  PHE  54           HE2      PHE  54  -4.689  -0.366   2.263
 1314    HZ   PHE  54           HZ       PHE  54  -6.703  -1.268   3.356
 1315    H    GLU  55           H        GLU  55  -3.536   2.542   7.974
 1316    HA   GLU  55           HA       GLU  55  -1.039   1.636   6.719
 1317    HB2  GLU  55           HB3      GLU  55  -1.839   1.690   9.643
 1318    HB3  GLU  55           HB2      GLU  55  -0.289   1.137   9.026
 1319    HG2  GLU  55           HG3      GLU  55   0.039   3.457   8.089
 1320    HG3  GLU  55           HG2      GLU  55  -1.389   3.939   9.010
 1321    H    THR  56           H        THR  56  -1.347  -0.251   5.733
 1322    HA   THR  56           HA       THR  56  -2.878  -2.347   7.064
 1323    HB   THR  56           HB       THR  56  -1.339  -2.583   4.471
 1324    HG1  THR  56           HG1      THR  56  -2.926  -1.562   3.512
 1325   HG21  THR  56          HG21      THR  56  -2.899  -4.425   4.038
 1326   HG22  THR  56          HG22      THR  56  -3.669  -4.148   5.600
 1327   HG23  THR  56          HG23      THR  56  -1.994  -4.699   5.528
 1328    H    LYS  57           H        LYS  57  -1.769  -3.092   8.754
 1329    HA   LYS  57           HA       LYS  57   1.154  -3.246   8.564
 1330    HB2  LYS  57           HB3      LYS  57  -0.585  -3.301  11.038
 1331    HB3  LYS  57           HB2      LYS  57   1.159  -3.068  10.974
 1332    HG2  LYS  57           HG3      LYS  57   0.841  -0.939   9.828
 1333    HG3  LYS  57           HG2      LYS  57  -0.905  -1.168   9.869
 1334    HD2  LYS  57           HD3      LYS  57  -0.458   0.255  11.667
 1335    HD3  LYS  57           HD2      LYS  57  -0.630  -1.337  12.403
 1336    HE2  LYS  57           HE3      LYS  57   1.270  -0.239  13.364
 1337    HE3  LYS  57           HE2      LYS  57   1.831  -1.568  12.354
 1338    HZ1  LYS  57           HZ1      LYS  57   2.510  -0.077  10.676
 1339    HZ2  LYS  57           HZ2      LYS  57   3.059   0.599  12.128
 1340    HZ3  LYS  57           HZ3      LYS  57   1.680   1.228  11.374
 1341    H    CYS  58           H        CYS  58   2.244  -5.045   9.468
 1342    HA   CYS  58           HA       CYS  58   0.898  -7.503   8.774
 1343    HB2  CYS  58           HB3      CYS  58   3.335  -6.845   8.209
 1344    HB3  CYS  58           HB2      CYS  58   3.693  -7.309   9.866
 1345    H    ARG  59           H        ARG  59  -0.235  -8.619  10.185
 1346    HA   ARG  59           HA       ARG  59  -0.079  -8.112  13.002
 1347    HB2  ARG  59           HB3      ARG  59  -1.622 -10.153  11.397
 1348    HB3  ARG  59           HB2      ARG  59  -1.768  -9.974  13.138
 1349    HG2  ARG  59           HG3      ARG  59  -2.603  -7.713  12.857
 1350    HG3  ARG  59           HG2      ARG  59  -2.400  -7.841  11.110
 1351    HD2  ARG  59           HD3      ARG  59  -4.726  -8.216  11.764
 1352    HD3  ARG  59           HD2      ARG  59  -4.018  -9.657  11.042
 1353    HE   ARG  59           HE       ARG  59  -4.095  -9.407  13.964
 1354   HH11  ARG  59          HH11      ARG  59  -5.174 -10.993  11.039
 1355   HH12  ARG  59          HH12      ARG  59  -5.874 -12.340  11.873
 1356   HH21  ARG  59          HH21      ARG  59  -5.036 -11.170  15.072
 1357   HH22  ARG  59          HH22      ARG  59  -5.804 -12.437  14.168
 1358    H    ALA  60           H        ALA  60   0.711 -10.858  10.897
 1359    HA   ALA  60           HA       ALA  60   2.836 -11.674  12.646
 1360    HB1  ALA  60           HB1      ALA  60   0.450 -13.501  12.346
 1361    HB2  ALA  60           HB2      ALA  60   0.923 -12.661  13.821
 1362    HB3  ALA  60           HB3      ALA  60   1.970 -13.906  13.140
 1363    H    SER  61           H        SER  61   4.407 -12.419  11.389
 1364    HA   SER  61           HA       SER  61   3.907 -13.030   8.622
 1365    HB2  SER  61           HB3      SER  61   5.936 -11.797   9.293
 1366    HB3  SER  61           HB2      SER  61   6.470 -13.188  10.234
 1367    HG   SER  61           HG       SER  61   6.739 -14.349   8.363
 1368    H    ASN  62           H        ASN  62   3.801 -14.971   7.691
 1369    HA   ASN  62           HA       ASN  62   3.700 -17.222   7.391
 1370    HB2  ASN  62           HB3      ASN  62   5.679 -17.239   9.678
 1371    HB3  ASN  62           HB2      ASN  62   5.234 -18.669   8.750
 1372   HD21  ASN  62          HD21      ASN  62   5.864 -18.810   6.589
 1373   HD22  ASN  62          HD22      ASN  62   7.150 -17.849   5.947
 1374    HA   PRO  63           HA       PRO  63   0.499 -17.396  10.785
 1375    HB2  PRO  63           HB3      PRO  63  -1.460 -18.269   9.039
 1376    HB3  PRO  63           HB2      PRO  63  -1.183 -16.575   9.470
 1377    HG2  PRO  63           HG3      PRO  63  -0.282 -18.097   7.059
 1378    HG3  PRO  63           HG2      PRO  63  -0.887 -16.436   7.173
 1379    HD2  PRO  63           HD3      PRO  63   1.741 -16.959   6.915
 1380    HD3  PRO  63           HD2      PRO  63   1.157 -15.606   7.916
 1381    H    VAL  64           H        VAL  64   1.526 -19.597   8.260
 1382    HA   VAL  64           HA       VAL  64   0.860 -21.853  10.029
 1383    HB   VAL  64           HB       VAL  64   0.582 -23.274   8.028
 1384   HG11  VAL  64          HG11      VAL  64  -1.593 -22.400   7.310
 1385   HG12  VAL  64          HG12      VAL  64  -1.213 -20.853   8.070
 1386   HG13  VAL  64          HG13      VAL  64  -1.390 -22.304   9.059
 1387   HG21  VAL  64          HG21      VAL  64   1.965 -22.002   6.472
 1388   HG22  VAL  64          HG22      VAL  64   0.786 -20.690   6.490
 1389   HG23  VAL  64          HG23      VAL  64   0.347 -22.260   5.819
 1390    H    GLU  65           H        GLU  65   2.289 -23.769   9.676
 1391    HA   GLU  65           HA       GLU  65   5.033 -22.808   9.578
 1392    HB2  GLU  65           HB3      GLU  65   3.983 -25.534  10.340
 1393    HB3  GLU  65           HB2      GLU  65   5.615 -24.937  10.598
 1394    HG2  GLU  65           HG3      GLU  65   4.699 -23.188  12.078
 1395    HG3  GLU  65           HG2      GLU  65   3.099 -23.903  11.879
 1396    H    SER  66           H        SER  66   3.752 -22.899   7.104
 1397    HA   SER  66           HA       SER  66   5.703 -24.509   5.683
 1398    HB2  SER  66           HB3      SER  66   2.735 -24.731   5.077
 1399    HB3  SER  66           HB2      SER  66   4.034 -25.453   4.126
 1400    HG   SER  66           HG       SER  66   4.254 -26.119   6.745
 1401    H    GLY  67           H        GLY  67   5.009 -21.672   6.298
 1402    HA2  GLY  67           HA3      GLY  67   5.710 -19.896   4.779
 1403    HA3  GLY  67           HA2      GLY  67   4.773 -20.699   3.521
 1404    H    CYS  68           H        CYS  68   2.697 -20.157   3.251
 1405    HA   CYS  68           HA       CYS  68   1.354 -18.615   5.349
 1406    HB2  CYS  68           HB3      CYS  68   1.586 -17.838   2.432
 1407    HB3  CYS  68           HB2      CYS  68   0.441 -17.096   3.555
 1408    H    ARG  69           H        ARG  69  -1.061 -18.340   4.712
 1409    HA   ARG  69           HA       ARG  69  -2.069 -20.996   4.564
 1410    HB2  ARG  69           HB3      ARG  69  -3.545 -18.352   4.474
 1411    HB3  ARG  69           HB2      ARG  69  -4.312 -19.926   4.650
 1412    HG2  ARG  69           HG3      ARG  69  -2.932 -20.213   6.754
 1413    HG3  ARG  69           HG2      ARG  69  -2.521 -18.503   6.596
 1414    HD2  ARG  69           HD3      ARG  69  -4.390 -18.729   8.101
 1415    HD3  ARG  69           HD2      ARG  69  -4.930 -17.957   6.607
 1416    HE   ARG  69           HE       ARG  69  -5.287 -20.805   6.602
 1417   HH11  ARG  69          HH11      ARG  69  -6.693 -17.752   7.584
 1418   HH12  ARG  69          HH12      ARG  69  -8.314 -18.364   7.637
 1419   HH21  ARG  69          HH21      ARG  69  -7.422 -21.624   6.677
 1420   HH22  ARG  69          HH22      ARG  69  -8.732 -20.574   7.121
 1421    H    GLY  70           H        GLY  70  -2.639 -22.153   2.860
 1422    HA2  GLY  70           HA3      GLY  70  -3.754 -22.447   0.771
 1423    HA3  GLY  70           HA2      GLY  70  -3.409 -20.766   0.385
 1424    H    ILE  71           H        ILE  71  -0.608 -21.024   1.285
 1425    HA   ILE  71           HA       ILE  71   0.482 -21.892  -1.226
 1426    HB   ILE  71           HB       ILE  71   2.023 -21.097   1.246
 1427   HG12  ILE  71          HG13      ILE  71   0.422 -19.322   0.632
 1428   HG13  ILE  71          HG12      ILE  71   2.086 -18.826   0.349
 1429   HG21  ILE  71          HG21      ILE  71   3.786 -20.514  -0.358
 1430   HG22  ILE  71          HG22      ILE  71   2.765 -21.083  -1.679
 1431   HG23  ILE  71          HG23      ILE  71   3.346 -22.220  -0.462
 1432   HD11  ILE  71          HD11      ILE  71   0.620 -18.103  -1.446
 1433   HD12  ILE  71          HD12      ILE  71   0.152 -19.775  -1.751
 1434   HD13  ILE  71          HD13      ILE  71   1.815 -19.261  -2.033
 1435    H    ASP  72           H        ASP  72  -0.061 -24.112  -1.213
 1436    HA   ASP  72           HA       ASP  72   1.415 -25.759   0.721
 1437    HB2  ASP  72           HB3      ASP  72  -1.025 -26.221   0.429
 1438    HB3  ASP  72           HB2      ASP  72  -0.707 -26.649  -1.250
 1439    H    SER  73           H        SER  73   3.418 -25.280  -0.298
 1440    HA   SER  73           HA       SER  73   3.962 -27.043  -2.539
 1441    HB2  SER  73           HB3      SER  73   3.451 -24.881  -3.602
 1442    HB3  SER  73           HB2      SER  73   4.648 -24.089  -2.575
 1443    HG   SER  73           HG       SER  73   5.042 -25.214  -4.914
 1444    H    LYS  74           H        LYS  74   5.937 -27.966  -2.386
 1445    HA   LYS  74           HA       LYS  74   7.668 -27.196  -0.171
 1446    HB2  LYS  74           HB3      LYS  74   7.904 -29.473  -2.151
 1447    HB3  LYS  74           HB2      LYS  74   8.912 -29.247  -0.731
 1448    HG2  LYS  74           HG3      LYS  74   6.963 -29.552   0.708
 1449    HG3  LYS  74           HG2      LYS  74   5.945 -29.764  -0.717
 1450    HD2  LYS  74           HD3      LYS  74   8.266 -31.519   0.060
 1451    HD3  LYS  74           HD2      LYS  74   6.566 -31.912   0.287
 1452    HE2  LYS  74           HE3      LYS  74   6.251 -31.746  -2.166
 1453    HE3  LYS  74           HE2      LYS  74   7.984 -31.480  -2.335
 1454    HZ1  LYS  74           HZ1      LYS  74   7.427 -33.780  -2.733
 1455    HZ2  LYS  74           HZ2      LYS  74   6.704 -33.908  -1.210
 1456    HZ3  LYS  74           HZ3      LYS  74   8.371 -33.650  -1.334
 1457    H    HIS  75           H        HIS  75   7.266 -26.703  -3.462
 1458    HA   HIS  75           HA       HIS  75  10.011 -26.210  -4.165
 1459    HB2  HIS  75           HB3      HIS  75   8.360 -26.966  -5.845
 1460    HB3  HIS  75           HB2      HIS  75   7.431 -25.495  -5.594
 1461    HD1  HIS  75           HD1      HIS  75   7.805 -23.832  -7.364
 1462    HD2  HIS  75           HD2      HIS  75  11.160 -26.205  -6.756
 1463    HE1  HIS  75           HE1      HIS  75   9.505 -23.035  -9.036
 1464    HE2  HIS  75           HE2      HIS  75  11.403 -24.678  -8.824
 1465    H    TRP  76           H        TRP  76   7.320 -24.430  -2.901
 1466    HA   TRP  76           HA       TRP  76   8.869 -21.938  -3.120
 1467    HB2  TRP  76           HB3      TRP  76   5.875 -22.322  -2.873
 1468    HB3  TRP  76           HB2      TRP  76   6.690 -20.759  -2.852
 1469    HD1  TRP  76           HD1      TRP  76   4.950 -22.977  -5.144
 1470    HE1  TRP  76           HE1      TRP  76   5.455 -22.381  -7.596
 1471    HE3  TRP  76           HE3      TRP  76   9.011 -19.953  -4.426
 1472    HZ2  TRP  76           HZ2      TRP  76   7.322 -20.836  -9.029
 1473    HZ3  TRP  76           HZ3      TRP  76  10.097 -18.955  -6.395
 1474    HH2  TRP  76           HH2      TRP  76   9.268 -19.391  -8.649
 1475    H    ASN  77           H        ASN  77   9.828 -21.412  -1.306
 1476    HA   ASN  77           HA       ASN  77   8.498 -21.900   1.259
 1477    HB2  ASN  77           HB3      ASN  77  10.903 -22.425   1.160
 1478    HB3  ASN  77           HB2      ASN  77  11.253 -20.779   0.649
 1479   HD21  ASN  77          HD21      ASN  77  11.305 -19.144   2.164
 1480   HD22  ASN  77          HD22      ASN  77  11.186 -19.434   3.868
 1481    H    SER  78           H        SER  78   7.699 -20.219   2.491
 1482    HA   SER  78           HA       SER  78   7.553 -17.657   1.054
 1483    HB2  SER  78           HB3      SER  78   5.321 -18.845   2.699
 1484    HB3  SER  78           HB2      SER  78   5.236 -17.498   1.563
 1485    HG   SER  78           HG       SER  78   5.848 -19.081  -0.076
 1486    H    TYR  79           H        TYR  79   7.508 -15.784   2.237
 1487    HA   TYR  79           HA       TYR  79   7.116 -15.858   5.079
 1488    HB2  TYR  79           HB3      TYR  79   9.177 -14.733   5.715
 1489    HB3  TYR  79           HB2      TYR  79   9.554 -16.266   4.941
 1490    HD1  TYR  79           HD1      TYR  79   9.626 -12.598   4.547
 1491    HD2  TYR  79           HD2      TYR  79  10.822 -16.340   2.908
 1492    HE1  TYR  79           HE1      TYR  79  11.207 -11.438   3.060
 1493    HE2  TYR  79           HE2      TYR  79  12.398 -15.186   1.413
 1494    HH   TYR  79           HH       TYR  79  12.699 -12.942   0.424
 1495    H    CYS  80           H        CYS  80   6.875 -13.662   5.967
 1496    HA   CYS  80           HA       CYS  80   5.512 -12.087   3.912
 1497    HB2  CYS  80           HB3      CYS  80   5.204 -11.907   6.913
 1498    HB3  CYS  80           HB2      CYS  80   4.130 -11.229   5.686
 1499    H    THR  81           H        THR  81   5.919  -9.989   3.533
 1500    HA   THR  81           HA       THR  81   7.770  -8.560   5.299
 1501    HB   THR  81           HB       THR  81   9.165  -9.445   3.480
 1502    HG1  THR  81           HG1      THR  81   9.423  -7.030   2.517
 1503   HG21  THR  81          HG21      THR  81   7.290  -7.949   1.649
 1504   HG22  THR  81          HG22      THR  81   7.502  -9.698   1.737
 1505   HG23  THR  81          HG23      THR  81   8.821  -8.677   1.162
 1506    H    THR  82           H        THR  82   7.495  -6.292   5.267
 1507    HA   THR  82           HA       THR  82   4.796  -5.566   4.474
 1508    HB   THR  82           HB       THR  82   5.325  -3.453   5.817
 1509    HG1  THR  82           HG1      THR  82   7.380  -5.034   6.965
 1510   HG21  THR  82          HG21      THR  82   3.904  -5.214   6.682
 1511   HG22  THR  82          HG22      THR  82   4.958  -4.616   7.964
 1512   HG23  THR  82          HG23      THR  82   5.315  -6.150   7.171
 1513    H    THR  83           H        THR  83   4.372  -4.466   2.724
 1514    HA   THR  83           HA       THR  83   6.346  -2.992   1.253
 1515    HB   THR  83           HB       THR  83   3.322  -3.039   1.024
 1516    HG1  THR  83           HG1      THR  83   5.095  -4.315  -0.771
 1517   HG21  THR  83          HG21      THR  83   5.357  -2.099  -0.998
 1518   HG22  THR  83          HG22      THR  83   4.352  -1.039  -0.012
 1519   HG23  THR  83          HG23      THR  83   3.607  -2.114  -1.194
 1520    H    HIS  84           H        HIS  84   6.667  -0.751   1.303
 1521    HA   HIS  84           HA       HIS  84   5.072   0.703   3.310
 1522    HB2  HIS  84           HB3      HIS  84   8.070   0.849   2.904
 1523    HB3  HIS  84           HB2      HIS  84   7.157   2.005   3.868
 1524    HD1  HIS  84           HD1      HIS  84   6.556   1.336   6.233
 1525    HD2  HIS  84           HD2      HIS  84   8.156  -1.800   4.027
 1526    HE1  HIS  84           HE1      HIS  84   6.918  -0.527   7.871
 1527    HE2  HIS  84           HE2      HIS  84   7.636  -2.487   6.462
 1528    H    THR  85           H        THR  85   4.299   2.626   2.712
 1529    HA   THR  85           HA       THR  85   5.137   3.619   0.066
 1530    HB   THR  85           HB       THR  85   2.823   2.773   0.051
 1531    HG1  THR  85           HG1      THR  85   2.035   4.499  -1.029
 1532   HG21  THR  85          HG21      THR  85   2.243   3.128   2.392
 1533   HG22  THR  85          HG22      THR  85   1.070   3.913   1.335
 1534   HG23  THR  85          HG23      THR  85   2.302   4.875   2.153
 1535    H    PHE  86           H        PHE  86   4.840   6.005  -0.206
 1536    HA   PHE  86           HA       PHE  86   5.521   7.385   2.302
 1537    HB2  PHE  86           HB3      PHE  86   6.778   7.701  -0.434
 1538    HB3  PHE  86           HB2      PHE  86   6.971   8.892   0.851
 1539    HD1  PHE  86           HD1      PHE  86   7.979   5.624  -0.390
 1540    HD2  PHE  86           HD2      PHE  86   8.197   8.328   2.888
 1541    HE1  PHE  86           HE1      PHE  86   9.876   4.355   0.522
 1542    HE2  PHE  86           HE2      PHE  86  10.094   7.065   3.806
 1543    HZ   PHE  86           HZ       PHE  86  10.938   5.079   2.628
 1544    H    VAL  87           H        VAL  87   4.072   8.871   2.801
 1545    HA   VAL  87           HA       VAL  87   2.556  10.134   0.603
 1546    HB   VAL  87           HB       VAL  87   0.739  10.523   2.225
 1547   HG11  VAL  87          HG11      VAL  87   0.002   8.168   2.448
 1548   HG12  VAL  87          HG12      VAL  87   1.612   7.656   1.933
 1549   HG13  VAL  87          HG13      VAL  87   0.585   8.576   0.832
 1550   HG21  VAL  87          HG21      VAL  87   2.419   8.872   4.106
 1551   HG22  VAL  87          HG22      VAL  87   0.756   9.384   4.392
 1552   HG23  VAL  87          HG23      VAL  87   2.040  10.586   4.277
 1553    H    LYS  88           H        LYS  88   1.963  12.368   0.878
 1554    HA   LYS  88           HA       LYS  88   4.023  13.902   2.215
 1555    HB2  LYS  88           HB3      LYS  88   1.664  14.777   0.538
 1556    HB3  LYS  88           HB2      LYS  88   2.858  15.873   1.212
 1557    HG2  LYS  88           HG3      LYS  88   3.376  13.705  -0.806
 1558    HG3  LYS  88           HG2      LYS  88   3.300  15.432  -1.122
 1559    HD2  LYS  88           HD3      LYS  88   5.318  14.051   0.640
 1560    HD3  LYS  88           HD2      LYS  88   5.603  14.643  -0.995
 1561    HE2  LYS  88           HE3      LYS  88   5.081  16.928  -0.222
 1562    HE3  LYS  88           HE2      LYS  88   4.904  16.306   1.419
 1563    HZ1  LYS  88           HZ1      LYS  88   7.370  16.352  -0.230
 1564    HZ2  LYS  88           HZ2      LYS  88   7.243  15.503   1.222
 1565    HZ3  LYS  88           HZ3      LYS  88   7.085  17.185   1.216
 1566    H    ALA  89           H        ALA  89   3.838  14.317   4.282
 1567    HA   ALA  89           HA       ALA  89   1.192  15.132   5.299
 1568    HB1  ALA  89           HB1      ALA  89   1.729  12.882   6.121
 1569    HB2  ALA  89           HB2      ALA  89   1.691  14.062   7.430
 1570    HB3  ALA  89           HB3      ALA  89   3.236  13.495   6.799
 1571    H    LEU  90           H        LEU  90   1.193  16.833   6.753
 1572    HA   LEU  90           HA       LEU  90   3.513  18.527   6.699
 1573    HB2  LEU  90           HB3      LEU  90   1.112  19.347   6.652
 1574    HB3  LEU  90           HB2      LEU  90   0.993  18.867   8.339
 1575    HG   LEU  90           HG       LEU  90   2.893  20.456   8.822
 1576   HD11  LEU  90          HD11      LEU  90   2.291  21.363   6.014
 1577   HD12  LEU  90          HD12      LEU  90   3.805  20.669   6.593
 1578   HD13  LEU  90          HD13      LEU  90   3.275  22.242   7.182
 1579   HD21  LEU  90          HD21      LEU  90   0.581  21.009   9.338
 1580   HD22  LEU  90          HD22      LEU  90   0.344  21.608   7.696
 1581   HD23  LEU  90          HD23      LEU  90   1.456  22.436   8.786
 1582    H    THR  91           H        THR  91   5.183  17.890   7.899
 1583    HA   THR  91           HA       THR  91   4.632  16.829  10.591
 1584    HB   THR  91           HB       THR  91   6.818  15.696  10.434
 1585    HG1  THR  91           HG1      THR  91   7.246  17.375   8.482
 1586   HG21  THR  91          HG21      THR  91   4.844  14.452   9.759
 1587   HG22  THR  91          HG22      THR  91   6.204  14.023   8.724
 1588   HG23  THR  91          HG23      THR  91   4.952  15.115   8.130
 1589    H    THR  92           H        THR  92   5.843  17.598  12.328
 1590    HA   THR  92           HA       THR  92   7.220  20.124  11.762
 1591    HB   THR  92           HB       THR  92   5.329  20.428  13.242
 1592    HG1  THR  92           HG1      THR  92   6.403  21.574  14.780
 1593   HG21  THR  92          HG21      THR  92   6.666  18.451  15.085
 1594   HG22  THR  92          HG22      THR  92   5.183  18.170  14.174
 1595   HG23  THR  92          HG23      THR  92   5.219  19.389  15.449
 1596    H    ASP  93           H        ASP  93   9.296  20.276  12.008
 1597    HA   ASP  93           HA       ASP  93  10.905  18.062  12.814
 1598    HB2  ASP  93           HB3      ASP  93  11.740  19.579  11.126
 1599    HB3  ASP  93           HB2      ASP  93  11.582  20.952  12.216
 1600    H    GLU  94           H        GLU  94   9.720  20.945  14.320
 1601    HA   GLU  94           HA       GLU  94  10.085  19.971  16.942
 1602    HB2  GLU  94           HB3      GLU  94  12.457  20.719  16.303
 1603    HB3  GLU  94           HB2      GLU  94  11.824  22.355  16.307
 1604    HG2  GLU  94           HG3      GLU  94  12.872  21.951  18.398
 1605    HG3  GLU  94           HG2      GLU  94  11.132  22.031  18.659
 1606    H    LYS  95           H        LYS  95  10.179  23.111  15.263
 1607    HA   LYS  95           HA       LYS  95   7.517  23.679  16.381
 1608    HB2  LYS  95           HB3      LYS  95   9.816  25.594  15.966
 1609    HB3  LYS  95           HB2      LYS  95   8.166  26.116  16.273
 1610    HG2  LYS  95           HG3      LYS  95   8.218  24.904  18.418
 1611    HG3  LYS  95           HG2      LYS  95   9.902  24.484  18.109
 1612    HD2  LYS  95           HD3      LYS  95  10.476  26.856  18.026
 1613    HD3  LYS  95           HD2      LYS  95   8.794  27.276  18.349
 1614    HE2  LYS  95           HE3      LYS  95   8.941  26.079  20.497
 1615    HE3  LYS  95           HE2      LYS  95  10.636  25.732  20.164
 1616    HZ1  LYS  95           HZ1      LYS  95  11.027  28.147  20.083
 1617    HZ2  LYS  95           HZ2      LYS  95  10.484  27.625  21.595
 1618    HZ3  LYS  95           HZ3      LYS  95   9.421  28.412  20.544
 1619    H    GLN  96           H        GLN  96   9.713  23.895  13.665
 1620    HA   GLN  96           HA       GLN  96   7.779  25.239  11.991
 1621    HB2  GLN  96           HB3      GLN  96  10.503  24.071  11.391
 1622    HB3  GLN  96           HB2      GLN  96   9.508  24.906  10.205
 1623    HG2  GLN  96           HG3      GLN  96  10.570  26.097  12.757
 1624    HG3  GLN  96           HG2      GLN  96  11.224  26.361  11.139
 1625   HE21  GLN  96          HE21      GLN  96  10.069  28.235  13.116
 1626   HE22  GLN  96          HE22      GLN  96   8.792  29.046  12.284
 1627    H    ALA  97           H        ALA  97   6.395  24.321  10.636
 1628    HA   ALA  97           HA       ALA  97   6.409  21.395  10.426
 1629    HB1  ALA  97           HB1      ALA  97   4.054  21.523   9.957
 1630    HB2  ALA  97           HB2      ALA  97   4.124  23.281   9.882
 1631    HB3  ALA  97           HB3      ALA  97   4.395  22.453  11.414
 1632    H    ALA  98           H        ALA  98   6.517  20.389   8.493
 1633    HA   ALA  98           HA       ALA  98   6.300  21.954   6.042
 1634    HB1  ALA  98           HB1      ALA  98   8.753  20.339   6.730
 1635    HB2  ALA  98           HB2      ALA  98   8.662  22.099   6.669
 1636    HB3  ALA  98           HB3      ALA  98   8.448  21.154   5.196
 1637    H    TRP  99           H        TRP  99   5.792  20.744   4.232
 1638    HA   TRP  99           HA       TRP  99   4.548  18.210   4.691
 1639    HB2  TRP  99           HB3      TRP  99   5.117  19.738   2.141
 1640    HB3  TRP  99           HB2      TRP  99   4.227  18.224   2.187
 1641    HD1  TRP  99           HD1      TRP  99   3.846  21.933   2.911
 1642    HE1  TRP  99           HE1      TRP  99   1.371  22.438   3.403
 1643    HE3  TRP  99           HE3      TRP  99   2.088  17.146   3.183
 1644    HZ2  TRP  99           HZ2      TRP  99  -1.017  20.987   3.843
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.305  16.789   3.641
 1646    HH2  TRP  99           HH2      TRP  99  -1.821  18.671   3.963
 1647    H    ARG 100           H        ARG 100   5.746  16.461   5.057
 1648    HA   ARG 100           HA       ARG 100   8.145  16.026   3.390
 1649    HB2  ARG 100           HB3      ARG 100   7.518  14.973   6.160
 1650    HB3  ARG 100           HB2      ARG 100   8.964  14.589   5.238
 1651    HG2  ARG 100           HG3      ARG 100   8.202  17.365   6.117
 1652    HG3  ARG 100           HG2      ARG 100   9.289  16.299   7.006
 1653    HD2  ARG 100           HD3      ARG 100   9.710  17.305   4.193
 1654    HD3  ARG 100           HD2      ARG 100  10.521  17.905   5.636
 1655    HE   ARG 100           HE       ARG 100  10.813  15.061   5.007
 1656   HH11  ARG 100          HH11      ARG 100  12.194  18.287   4.977
 1657   HH12  ARG 100          HH12      ARG 100  13.822  17.729   4.791
 1658   HH21  ARG 100          HH21      ARG 100  12.961  14.317   4.765
 1659   HH22  ARG 100          HH22      ARG 100  14.261  15.473   4.701
 1660    H    PHE 101           H        PHE 101   8.644  13.756   2.928
 1661    HA   PHE 101           HA       PHE 101   6.253  12.175   2.358
 1662    HB2  PHE 101           HB3      PHE 101   9.176  11.819   1.648
 1663    HB3  PHE 101           HB2      PHE 101   7.978  10.580   1.335
 1664    HD1  PHE 101           HD1      PHE 101   6.348  10.842  -0.427
 1665    HD2  PHE 101           HD2      PHE 101   9.245  13.859   0.356
 1666    HE1  PHE 101           HE1      PHE 101   5.884  11.851  -2.620
 1667    HE2  PHE 101           HE2      PHE 101   8.780  14.879  -1.832
 1668    HZ   PHE 101           HZ       PHE 101   7.102  13.872  -3.323
 1669    H    ILE 102           H        ILE 102   5.526  10.879   3.972
 1670    HA   ILE 102           HA       ILE 102   7.576   9.674   5.714
 1671    HB   ILE 102           HB       ILE 102   5.822   9.402   7.432
 1672   HG12  ILE 102          HG13      ILE 102   4.133  11.229   5.727
 1673   HG13  ILE 102          HG12      ILE 102   3.900   9.489   5.796
 1674   HG21  ILE 102          HG21      ILE 102   5.752  11.745   8.123
 1675   HG22  ILE 102          HG22      ILE 102   6.255  12.235   6.506
 1676   HG23  ILE 102          HG23      ILE 102   7.347  11.291   7.521
 1677   HD11  ILE 102          HD11      ILE 102   2.338  10.631   7.247
 1678   HD12  ILE 102          HD12      ILE 102   3.671  11.403   8.107
 1679   HD13  ILE 102          HD13      ILE 102   3.459   9.654   8.196
 1680    H    ARG 103           H        ARG 103   7.439   7.524   6.253
 1681    HA   ARG 103           HA       ARG 103   6.105   5.954   4.187
 1682    HB2  ARG 103           HB3      ARG 103   7.643   4.165   4.783
 1683    HB3  ARG 103           HB2      ARG 103   8.535   5.656   4.522
 1684    HG2  ARG 103           HG3      ARG 103   8.525   5.960   7.025
 1685    HG3  ARG 103           HG2      ARG 103   7.904   4.315   7.133
 1686    HD2  ARG 103           HD3      ARG 103  10.242   4.132   7.398
 1687    HD3  ARG 103           HD2      ARG 103   9.909   3.615   5.743
 1688    HE   ARG 103           HE       ARG 103  10.607   6.413   6.083
 1689   HH11  ARG 103          HH11      ARG 103  11.682   3.186   5.250
 1690   HH12  ARG 103          HH12      ARG 103  13.173   3.730   4.548
 1691   HH21  ARG 103          HH21      ARG 103  12.565   7.126   5.148
 1692   HH22  ARG 103          HH22      ARG 103  13.660   5.964   4.461
 1693    H    ILE 104           H        ILE 104   4.435   4.683   4.551
 1694    HA   ILE 104           HA       ILE 104   3.957   3.737   7.288
 1695    HB   ILE 104           HB       ILE 104   1.495   3.836   6.867
 1696   HG12  ILE 104          HG13      ILE 104   1.806   4.141   4.335
 1697   HG13  ILE 104          HG12      ILE 104   0.534   5.064   5.119
 1698   HG21  ILE 104          HG21      ILE 104   2.958   6.464   6.930
 1699   HG22  ILE 104          HG22      ILE 104   2.552   5.444   8.311
 1700   HG23  ILE 104          HG23      ILE 104   1.270   6.224   7.386
 1701   HD11  ILE 104          HD11      ILE 104   1.679   6.448   3.535
 1702   HD12  ILE 104          HD12      ILE 104   3.235   6.076   4.274
 1703   HD13  ILE 104          HD13      ILE 104   2.039   7.017   5.164
 1704    H    ASP 105           H        ASP 105   2.599   1.813   7.391
 1705    HA   ASP 105           HA       ASP 105   3.574  -0.178   5.615
 1706    HB2  ASP 105           HB3      ASP 105   1.443  -0.301   7.767
 1707    HB3  ASP 105           HB2      ASP 105   2.039  -1.710   6.887
 1708    H    THR 106           H        THR 106   2.798  -0.812   3.764
 1709    HA   THR 106           HA       THR 106   0.214   0.208   2.863
 1710    HB   THR 106           HB       THR 106   2.230  -1.236   1.153
 1711    HG1  THR 106           HG1      THR 106   2.565   1.095   2.518
 1712   HG21  THR 106          HG21      THR 106   0.279   1.004   0.601
 1713   HG22  THR 106          HG22      THR 106   0.079  -0.687   0.134
 1714   HG23  THR 106          HG23      THR 106   1.370   0.280  -0.578
 1715    H    ALA 107           H        ALA 107   1.973  -2.779   3.414
 1716    HA   ALA 107           HA       ALA 107  -0.280  -4.373   3.838
 1717    HB1  ALA 107           HB1      ALA 107  -0.265  -5.794   1.849
 1718    HB2  ALA 107           HB2      ALA 107   0.966  -4.767   1.115
 1719    HB3  ALA 107           HB3      ALA 107  -0.648  -4.126   1.420
 1720    H    CYS 108           H        CYS 108   0.321  -6.627   4.251
 1721    HA   CYS 108           HA       CYS 108   3.236  -7.045   4.379
 1722    HB2  CYS 108           HB3      CYS 108   2.071  -7.094   6.610
 1723    HB3  CYS 108           HB2      CYS 108   1.131  -8.472   6.035
 1724    H    VAL 109           H        VAL 109   3.760  -8.086   2.570
 1725    HA   VAL 109           HA       VAL 109   1.796  -9.914   1.407
 1726    HB   VAL 109           HB       VAL 109   3.075  -9.779  -0.652
 1727   HG11  VAL 109          HG11      VAL 109   2.624  -7.069   0.589
 1728   HG12  VAL 109          HG12      VAL 109   1.425  -8.048  -0.259
 1729   HG13  VAL 109          HG13      VAL 109   2.804  -7.386  -1.137
 1730   HG21  VAL 109          HG21      VAL 109   4.987  -7.998   0.856
 1731   HG22  VAL 109          HG22      VAL 109   5.045  -8.371  -0.866
 1732   HG23  VAL 109          HG23      VAL 109   5.322  -9.646   0.322
 1733    H    CYS 110           H        CYS 110   2.394 -11.979   0.659
 1734    HA   CYS 110           HA       CYS 110   4.577 -13.176   2.212
 1735    HB2  CYS 110           HB3      CYS 110   2.237 -14.053   2.543
 1736    HB3  CYS 110           HB2      CYS 110   2.263 -14.591   0.868
 1737    H    VAL 111           H        VAL 111   6.382 -13.364   1.066
 1738    HA   VAL 111           HA       VAL 111   6.237 -13.417  -1.837
 1739    HB   VAL 111           HB       VAL 111   8.620 -13.089  -1.832
 1740   HG11  VAL 111          HG11      VAL 111   7.297 -11.107  -1.398
 1741   HG12  VAL 111          HG12      VAL 111   8.826 -11.029  -0.522
 1742   HG13  VAL 111          HG13      VAL 111   7.340 -11.435   0.334
 1743   HG21  VAL 111          HG21      VAL 111   8.541 -13.553   1.144
 1744   HG22  VAL 111          HG22      VAL 111   9.956 -13.074   0.210
 1745   HG23  VAL 111          HG23      VAL 111   9.214 -14.650  -0.061
 1746    H    LEU 112           H        LEU 112   7.265 -15.025  -3.129
 1747    HA   LEU 112           HA       LEU 112   7.479 -17.625  -1.772
 1748    HB2  LEU 112           HB3      LEU 112   6.981 -17.051  -4.701
 1749    HB3  LEU 112           HB2      LEU 112   7.032 -18.639  -3.959
 1750    HG   LEU 112           HG       LEU 112   4.949 -16.508  -3.435
 1751   HD11  LEU 112          HD11      LEU 112   3.433 -18.075  -4.549
 1752   HD12  LEU 112          HD12      LEU 112   4.797 -19.137  -4.903
 1753   HD13  LEU 112          HD13      LEU 112   4.719 -17.528  -5.625
 1754   HD21  LEU 112          HD21      LEU 112   3.794 -18.238  -2.147
 1755   HD22  LEU 112          HD22      LEU 112   5.356 -17.834  -1.435
 1756   HD23  LEU 112          HD23      LEU 112   5.170 -19.320  -2.367
 1757    H    SER 113           H        SER 113   9.330 -18.769  -1.910
 1758    HA   SER 113           HA       SER 113  11.434 -17.783  -3.711
 1759    HB2  SER 113           HB3      SER 113  11.936 -16.956  -1.465
 1760    HB3  SER 113           HB2      SER 113  11.757 -18.582  -0.804
 1761    HG   SER 113           HG       SER 113  13.962 -17.907  -1.217
 1762    H    ARG 114           H        ARG 114  12.754 -19.335  -4.584
 1763    HA   ARG 114           HA       ARG 114  11.720 -22.030  -4.598
 1764    HB2  ARG 114           HB3      ARG 114  12.571 -20.795  -6.629
 1765    HB3  ARG 114           HB2      ARG 114  14.193 -20.952  -5.971
 1766    HG2  ARG 114           HG3      ARG 114  14.007 -23.384  -6.080
 1767    HG3  ARG 114           HG2      ARG 114  12.371 -23.230  -6.724
 1768    HD2  ARG 114           HD3      ARG 114  13.985 -23.629  -8.510
 1769    HD3  ARG 114           HD2      ARG 114  13.236 -22.044  -8.668
 1770    HE   ARG 114           HE       ARG 114  15.866 -22.312  -7.384
 1771   HH11  ARG 114          HH11      ARG 114  13.845 -21.040  -9.951
 1772   HH12  ARG 114          HH12      ARG 114  15.077 -19.985 -10.565
 1773   HH21  ARG 114          HH21      ARG 114  17.483 -20.914  -8.190
 1774   HH22  ARG 114          HH22      ARG 114  17.142 -19.912  -9.562
 1775    H    LYS 115           H        LYS 115  13.369 -20.525  -2.379
 1776    HA   LYS 115           HA       LYS 115  14.636 -21.145  -0.604
 1777    HB2  LYS 115           HB3      LYS 115  14.645 -23.924  -1.812
 1778    HB3  LYS 115           HB2      LYS 115  15.112 -23.514  -0.171
 1779    HG2  LYS 115           HG3      LYS 115  12.750 -22.693   0.167
 1780    HG3  LYS 115           HG2      LYS 115  12.369 -23.423  -1.396
 1781    HD2  LYS 115           HD3      LYS 115  13.437 -24.846   1.034
 1782    HD3  LYS 115           HD2      LYS 115  11.803 -24.958   0.387
 1783    HE2  LYS 115           HE3      LYS 115  14.309 -25.803  -1.054
 1784    HE3  LYS 115           HE2      LYS 115  13.214 -26.893  -0.207
 1785    HZ1  LYS 115           HZ1      LYS 115  11.451 -26.242  -1.733
 1786    HZ2  LYS 115           HZ2      LYS 115  12.776 -26.881  -2.569
 1787    HZ3  LYS 115           HZ3      LYS 115  12.515 -25.211  -2.555
 1788    H    ALA 116           H        ALA 116  15.753 -20.040  -2.925
 1789    HA   ALA 116           HA       ALA 116  18.190 -21.422  -3.573
 1790    HB1  ALA 116           HB1      ALA 116  18.702 -19.471  -4.932
 1791    HB2  ALA 116           HB2      ALA 116  17.349 -18.599  -4.216
 1792    HB3  ALA 116           HB3      ALA 116  17.051 -20.016  -5.224
 1793    H    THR 117           H        THR 117  17.750 -18.120  -2.333
 1794    HA   THR 117           HA       THR 117  19.591 -18.552  -0.171
 1795    HB   THR 117           HB       THR 117  21.207 -18.266  -1.953
 1796    HG1  THR 117           HG1      THR 117  21.559 -15.750  -1.020
 1797   HG21  THR 117          HG21      THR 117  19.801 -15.666  -2.565
 1798   HG22  THR 117          HG22      THR 117  19.798 -17.108  -3.577
 1799   HG23  THR 117          HG23      THR 117  21.299 -16.224  -3.308
 1800    H    ARG 118           H        ARG 118  19.715 -16.690   1.242
 1801    HA   ARG 118           HA       ARG 118  17.808 -14.550   0.632
 1802    HB2  ARG 118           HB3      ARG 118  17.160 -16.507   2.402
 1803    HB3  ARG 118           HB2      ARG 118  17.978 -15.384   3.470
 1804    HG2  ARG 118           HG3      ARG 118  15.615 -14.755   1.713
 1805    HG3  ARG 118           HG2      ARG 118  15.584 -15.006   3.457
 1806    HD2  ARG 118           HD3      ARG 118  16.805 -13.019   3.860
 1807    HD3  ARG 118           HD2      ARG 118  17.245 -12.854   2.162
 1808    HE   ARG 118           HE       ARG 118  14.573 -12.710   2.051
 1809   HH11  ARG 118          HH11      ARG 118  16.866 -11.102   4.148
 1810   HH12  ARG 118          HH12      ARG 118  15.922  -9.653   4.274
 1811   HH21  ARG 118          HH21      ARG 118  13.339 -10.813   2.206
 1812   HH22  ARG 118          HH22      ARG 118  13.910  -9.488   3.175
  Start of MODEL   20
    1    H1   SER   1           H1       SER   1  28.061  -9.129   5.383
    2    H2   SER   1           H2       SER   1  28.323  -8.950   3.724
    3    H3   SER   1           H3       SER   1  27.461 -10.283   4.304
    4    HA   SER   1           HA       SER   1  25.970  -8.680   3.348
    5    HB2  SER   1           HB3      SER   1  24.536  -8.343   5.400
    6    HB3  SER   1           HB2      SER   1  25.081  -9.999   5.150
    7    HG   SER   1           HG       SER   1  25.700  -8.204   7.156
    8    H    SER   2           H        SER   2  25.308  -6.587   3.075
    9    HA   SER   2           HA       SER   2  26.525  -4.528   4.780
   10    HB2  SER   2           HB3      SER   2  26.309  -4.417   1.756
   11    HB3  SER   2           HB2      SER   2  26.858  -3.094   2.787
   12    HG   SER   2           HG       SER   2  28.152  -5.513   3.155
   13    H    THR   3           H        THR   3  24.206  -5.327   5.477
   14    HA   THR   3           HA       THR   3  22.034  -4.914   5.853
   15    HB   THR   3           HB       THR   3  21.217  -2.556   5.618
   16    HG1  THR   3           HG1      THR   3  23.447  -2.336   4.102
   17   HG21  THR   3          HG21      THR   3  23.827  -2.962   7.077
   18   HG22  THR   3          HG22      THR   3  22.224  -3.385   7.678
   19   HG23  THR   3          HG23      THR   3  22.646  -1.695   7.405
   20    H    HIS   4           H        HIS   4  19.912  -4.142   4.945
   21    HA   HIS   4           HA       HIS   4  18.269  -4.477   3.416
   22    HB2  HIS   4           HB3      HIS   4  19.468  -2.451   2.453
   23    HB3  HIS   4           HB2      HIS   4  20.274  -3.557   1.352
   24    HD1  HIS   4           HD1      HIS   4  17.061  -1.811   1.950
   25    HD2  HIS   4           HD2      HIS   4  18.584  -4.668  -0.656
   26    HE1  HIS   4           HE1      HIS   4  15.404  -1.961   0.069
   27    HE2  HIS   4           HE2      HIS   4  16.258  -3.812  -1.401
   28    HA   PRO   5           HA       PRO   5  20.229  -8.433   1.904
   29    HB2  PRO   5           HB3      PRO   5  19.218 -10.177   3.645
   30    HB3  PRO   5           HB2      PRO   5  20.583  -9.144   4.097
   31    HG2  PRO   5           HG3      PRO   5  17.678  -8.851   4.766
   32    HG3  PRO   5           HG2      PRO   5  19.091  -8.593   5.802
   33    HD2  PRO   5           HD3      PRO   5  17.692  -6.582   4.499
   34    HD3  PRO   5           HD2      PRO   5  19.365  -6.443   5.075
   35    H    VAL   6           H        VAL   6  17.919  -7.055   0.909
   36    HA   VAL   6           HA       VAL   6  16.040  -7.374  -0.336
   37    HB   VAL   6           HB       VAL   6  16.701 -10.321  -0.347
   38   HG11  VAL   6          HG11      VAL   6  15.409  -8.534  -2.405
   39   HG12  VAL   6          HG12      VAL   6  14.585  -9.718  -1.389
   40   HG13  VAL   6          HG13      VAL   6  15.745 -10.253  -2.604
   41   HG21  VAL   6          HG21      VAL   6  18.754  -9.107  -0.830
   42   HG22  VAL   6          HG22      VAL   6  17.922  -8.172  -2.072
   43   HG23  VAL   6          HG23      VAL   6  18.147  -9.907  -2.281
   44    H    PHE   7           H        PHE   7  15.819  -7.370   2.472
   45    HA   PHE   7           HA       PHE   7  14.447  -7.844   4.221
   46    HB2  PHE   7           HB3      PHE   7  12.819  -7.184   2.281
   47    HB3  PHE   7           HB2      PHE   7  12.403  -8.892   2.282
   48    HD1  PHE   7           HD1      PHE   7  10.931  -9.776   3.908
   49    HD2  PHE   7           HD2      PHE   7  12.493  -5.843   4.357
   50    HE1  PHE   7           HE1      PHE   7   9.349  -9.358   5.743
   51    HE2  PHE   7           HE2      PHE   7  10.917  -5.420   6.194
   52    HZ   PHE   7           HZ       PHE   7   9.340  -7.177   6.890
   53    H    HIS   8           H        HIS   8  16.315  -9.753   3.654
   54    HA   HIS   8           HA       HIS   8  16.955 -11.900   3.987
   55    HB2  HIS   8           HB3      HIS   8  14.264 -12.097   5.366
   56    HB3  HIS   8           HB2      HIS   8  15.487 -13.361   5.405
   57    HD1  HIS   8           HD1      HIS   8  14.322 -10.523   7.263
   58    HD2  HIS   8           HD2      HIS   8  18.021 -12.315   6.627
   59    HE1  HIS   8           HE1      HIS   8  15.796  -9.719   9.133
   60    HE2  HIS   8           HE2      HIS   8  17.976 -10.939   8.818
   61    H    MET   9           H        MET   9  16.425 -11.584   1.543
   62    HA   MET   9           HA       MET   9  15.495 -12.228  -0.424
   63    HB2  MET   9           HB3      MET   9  15.614 -14.627  -0.874
   64    HB3  MET   9           HB2      MET   9  17.029 -14.070  -0.002
   65    HG2  MET   9           HG3      MET   9  16.189 -15.034   2.047
   66    HG3  MET   9           HG2      MET   9  14.698 -15.511   1.240
   67    HE1  MET   9           HE1      MET   9  18.321 -15.679  -0.310
   68    HE2  MET   9           HE2      MET   9  18.835 -17.280   0.220
   69    HE3  MET   9           HE3      MET   9  18.574 -16.000   1.405
   70    H    GLY  10           H        GLY  10  13.532 -11.136   0.787
   71    HA2  GLY  10           HA3      GLY  10  11.258 -12.970   0.380
   72    HA3  GLY  10           HA2      GLY  10  11.305 -11.870   1.749
   73    H    GLU  11           H        GLU  11   9.317 -11.013   0.972
   74    HA   GLU  11           HA       GLU  11   7.993  -9.510  -0.069
   75    HB2  GLU  11           HB3      GLU  11  10.645  -8.294  -0.861
   76    HB3  GLU  11           HB2      GLU  11   9.084  -7.526  -1.146
   77    HG2  GLU  11           HG3      GLU  11   8.691  -7.590   1.318
   78    HG3  GLU  11           HG2      GLU  11  10.344  -8.175   1.514
   79    H    PHE  12           H        PHE  12   9.228 -11.903  -1.583
   80    HA   PHE  12           HA       PHE  12   9.064 -11.124  -4.325
   81    HB2  PHE  12           HB3      PHE  12   9.029 -13.811  -2.955
   82    HB3  PHE  12           HB2      PHE  12   8.784 -13.655  -4.693
   83    HD1  PHE  12           HD1      PHE  12  11.199 -13.658  -2.006
   84    HD2  PHE  12           HD2      PHE  12  10.576 -12.684  -6.100
   85    HE1  PHE  12           HE1      PHE  12  13.634 -13.601  -2.361
   86    HE2  PHE  12           HE2      PHE  12  13.006 -12.631  -6.463
   87    HZ   PHE  12           HZ       PHE  12  14.539 -13.088  -4.590
   88    H    SER  13           H        SER  13   7.364 -11.073  -5.651
   89    HA   SER  13           HA       SER  13   4.817 -10.790  -4.360
   90    HB2  SER  13           HB3      SER  13   5.606 -10.415  -7.259
   91    HB3  SER  13           HB2      SER  13   4.102  -9.875  -6.524
   92    HG   SER  13           HG       SER  13   6.272  -9.009  -5.135
   93    H    VAL  14           H        VAL  14   3.291 -12.281  -4.227
   94    HA   VAL  14           HA       VAL  14   3.351 -14.811  -5.471
   95    HB   VAL  14           HB       VAL  14   0.951 -14.990  -4.768
   96   HG11  VAL  14          HG11      VAL  14   1.387 -14.843  -2.348
   97   HG12  VAL  14          HG12      VAL  14   2.879 -13.968  -2.689
   98   HG13  VAL  14          HG13      VAL  14   2.693 -15.638  -3.225
   99   HG21  VAL  14          HG21      VAL  14   1.372 -12.183  -3.744
  100   HG22  VAL  14          HG22      VAL  14  -0.035 -13.198  -3.437
  101   HG23  VAL  14          HG23      VAL  14   0.316 -12.649  -5.075
  102    H    CYS  15           H        CYS  15   2.053 -11.746  -6.394
  103    HA   CYS  15           HA       CYS  15   1.570 -12.789  -9.088
  104    HB2  CYS  15           HB3      CYS  15  -0.628 -12.459  -7.974
  105    HB3  CYS  15           HB2      CYS  15  -0.192 -10.783  -7.640
  106    H    ASP  16           H        ASP  16   2.608 -11.605 -10.595
  107    HA   ASP  16           HA       ASP  16   4.539  -9.735  -9.856
  108    HB2  ASP  16           HB3      ASP  16   3.342 -10.460 -12.523
  109    HB3  ASP  16           HB2      ASP  16   4.528  -9.165 -12.390
  110    H    SER  17           H        SER  17   4.660  -7.546  -9.829
  111    HA   SER  17           HA       SER  17   2.233  -6.030 -10.426
  112    HB2  SER  17           HB3      SER  17   2.435  -4.910  -8.163
  113    HB3  SER  17           HB2      SER  17   1.903  -6.594  -8.118
  114    HG   SER  17           HG       SER  17   4.015  -7.193  -7.571
  115    H    VAL  18           H        VAL  18   2.560  -3.863 -10.850
  116    HA   VAL  18           HA       VAL  18   5.382  -3.043 -11.035
  117    HB   VAL  18           HB       VAL  18   4.588  -3.470 -13.252
  118   HG11  VAL  18          HG11      VAL  18   2.265  -1.661 -12.615
  119   HG12  VAL  18          HG12      VAL  18   2.208  -3.401 -12.900
  120   HG13  VAL  18          HG13      VAL  18   2.645  -2.308 -14.213
  121   HG21  VAL  18          HG21      VAL  18   4.818  -1.254 -14.295
  122   HG22  VAL  18          HG22      VAL  18   6.018  -1.532 -13.035
  123   HG23  VAL  18          HG23      VAL  18   4.623  -0.505 -12.709
  124    H    SER  19           H        SER  19   5.812  -1.447  -9.667
  125    HA   SER  19           HA       SER  19   3.708   0.344  -8.773
  126    HB2  SER  19           HB3      SER  19   6.637   0.193  -7.994
  127    HB3  SER  19           HB2      SER  19   5.431   1.238  -7.232
  128    HG   SER  19           HG       SER  19   4.309  -0.615  -6.564
  129    H    VAL  20           H        VAL  20   3.291   2.221  -9.694
  130    HA   VAL  20           HA       VAL  20   5.339   3.435 -11.436
  131    HB   VAL  20           HB       VAL  20   2.334   3.559 -11.760
  132   HG11  VAL  20          HG11      VAL  20   4.542   4.565 -13.542
  133   HG12  VAL  20          HG12      VAL  20   3.411   5.547 -12.610
  134   HG13  VAL  20          HG13      VAL  20   2.826   4.556 -13.945
  135   HG21  VAL  20          HG21      VAL  20   4.362   1.992 -13.345
  136   HG22  VAL  20          HG22      VAL  20   2.643   2.123 -13.712
  137   HG23  VAL  20          HG23      VAL  20   3.171   1.322 -12.232
  138    H    TRP  21           H        TRP  21   5.706   5.599 -11.220
  139    HA   TRP  21           HA       TRP  21   4.138   7.018  -9.184
  140    HB2  TRP  21           HB3      TRP  21   6.905   7.520 -10.292
  141    HB3  TRP  21           HB2      TRP  21   6.045   8.706  -9.315
  142    HD1  TRP  21           HD1      TRP  21   7.895   5.388  -9.060
  143    HE1  TRP  21           HE1      TRP  21   8.275   4.828  -6.577
  144    HE3  TRP  21           HE3      TRP  21   5.022   9.058  -6.943
  145    HZ2  TRP  21           HZ2      TRP  21   7.466   5.806  -4.059
  146    HZ3  TRP  21           HZ3      TRP  21   4.883   9.176  -4.487
  147    HH2  TRP  21           HH2      TRP  21   6.077   7.583  -3.077
  148    H    VAL  22           H        VAL  22   2.418   7.743 -10.250
  149    HA   VAL  22           HA       VAL  22   2.483   8.697 -12.937
  150    HB   VAL  22           HB       VAL  22   0.336   9.044 -10.835
  151   HG11  VAL  22          HG11      VAL  22   0.197   9.257 -13.837
  152   HG12  VAL  22          HG12      VAL  22   0.046  10.585 -12.687
  153   HG13  VAL  22          HG13      VAL  22  -1.182   9.320 -12.740
  154   HG21  VAL  22          HG21      VAL  22   0.873   6.697 -11.190
  155   HG22  VAL  22          HG22      VAL  22   0.674   6.904 -12.930
  156   HG23  VAL  22          HG23      VAL  22  -0.713   7.086 -11.855
  157    H    GLY  23           H        GLY  23   3.174  10.616 -13.593
  158    HA2  GLY  23           HA3      GLY  23   3.702  12.691 -11.625
  159    HA3  GLY  23           HA2      GLY  23   4.233  12.680 -13.303
  160    H    ASP  24           H        ASP  24   1.147  11.904 -13.621
  161    HA   ASP  24           HA       ASP  24  -0.133  14.415 -13.069
  162    HB2  ASP  24           HB3      ASP  24   1.036  14.999 -15.151
  163    HB3  ASP  24           HB2      ASP  24   0.321  13.600 -15.951
  164    H    LYS  25           H        LYS  25  -1.445  12.940 -11.878
  165    HA   LYS  25           HA       LYS  25  -3.029  11.014 -13.314
  166    HB2  LYS  25           HB3      LYS  25  -2.347  10.760 -10.903
  167    HB3  LYS  25           HB2      LYS  25  -3.453  12.070 -10.513
  168    HG2  LYS  25           HG3      LYS  25  -5.332  10.772 -11.284
  169    HG3  LYS  25           HG2      LYS  25  -4.258   9.478 -11.812
  170    HD2  LYS  25           HD3      LYS  25  -3.523   9.185  -9.470
  171    HD3  LYS  25           HD2      LYS  25  -4.685  10.419  -8.981
  172    HE2  LYS  25           HE3      LYS  25  -5.616   8.203  -8.610
  173    HE3  LYS  25           HE2      LYS  25  -6.510   9.038  -9.881
  174    HZ1  LYS  25           HZ1      LYS  25  -4.408   6.973 -10.293
  175    HZ2  LYS  25           HZ2      LYS  25  -5.240   7.788 -11.528
  176    HZ3  LYS  25           HZ3      LYS  25  -6.077   6.752 -10.489
  177    H    THR  26           H        THR  26  -5.143  11.240 -13.959
  178    HA   THR  26           HA       THR  26  -5.940  13.979 -14.432
  179    HB   THR  26           HB       THR  26  -7.748  12.793 -15.833
  180    HG1  THR  26           HG1      THR  26  -7.631  10.660 -15.999
  181   HG21  THR  26          HG21      THR  26  -5.811  13.872 -16.834
  182   HG22  THR  26          HG22      THR  26  -6.150  12.352 -17.658
  183   HG23  THR  26          HG23      THR  26  -4.823  12.448 -16.501
  184    H    THR  27           H        THR  27  -7.742  11.068 -13.404
  185    HA   THR  27           HA       THR  27  -9.350  12.794 -11.668
  186    HB   THR  27           HB       THR  27 -11.329  11.269 -12.422
  187    HG1  THR  27           HG1      THR  27 -10.861  11.053 -14.891
  188   HG21  THR  27          HG21      THR  27 -11.275  13.682 -12.732
  189   HG22  THR  27          HG22      THR  27 -11.917  12.895 -14.176
  190   HG23  THR  27          HG23      THR  27 -10.256  13.493 -14.160
  191    H    ALA  28           H        ALA  28 -10.272  11.812  -9.870
  192    HA   ALA  28           HA       ALA  28  -9.873   8.950  -9.487
  193    HB1  ALA  28           HB1      ALA  28  -8.756  10.930  -7.508
  194    HB2  ALA  28           HB2      ALA  28  -7.791  10.019  -8.668
  195    HB3  ALA  28           HB3      ALA  28  -8.688   9.170  -7.408
  196    H    THR  29           H        THR  29 -10.873   8.245  -7.388
  197    HA   THR  29           HA       THR  29 -13.368   9.729  -7.025
  198    HB   THR  29           HB       THR  29 -12.790   6.922  -6.085
  199    HG1  THR  29           HG1      THR  29 -14.304   7.261  -8.379
  200   HG21  THR  29          HG21      THR  29 -14.745   8.035  -5.096
  201   HG22  THR  29          HG22      THR  29 -15.227   6.703  -6.146
  202   HG23  THR  29          HG23      THR  29 -15.368   8.368  -6.713
  203    H    ASP  30           H        ASP  30 -13.514  10.969  -5.319
  204    HA   ASP  30           HA       ASP  30 -11.795  10.801  -3.042
  205    HB2  ASP  30           HB3      ASP  30 -12.705  12.957  -3.729
  206    HB3  ASP  30           HB2      ASP  30 -14.354  12.354  -3.550
  207    H    ILE  31           H        ILE  31 -12.578  10.487  -0.846
  208    HA   ILE  31           HA       ILE  31 -13.725   7.951  -0.545
  209    HB   ILE  31           HB       ILE  31 -12.110   8.940   1.037
  210   HG12  ILE  31          HG13      ILE  31 -14.729   8.211   2.371
  211   HG13  ILE  31          HG12      ILE  31 -13.557   7.054   1.747
  212   HG21  ILE  31          HG21      ILE  31 -12.840  10.572   2.702
  213   HG22  ILE  31          HG22      ILE  31 -14.416  10.673   1.916
  214   HG23  ILE  31          HG23      ILE  31 -12.970  11.219   1.067
  215   HD11  ILE  31          HD11      ILE  31 -11.909   7.876   3.353
  216   HD12  ILE  31          HD12      ILE  31 -13.365   7.283   4.150
  217   HD13  ILE  31          HD13      ILE  31 -13.097   9.017   3.980
  218    H    LYS  32           H        LYS  32 -15.195  11.042  -0.807
  219    HA   LYS  32           HA       LYS  32 -17.680  10.194   0.448
  220    HB2  LYS  32           HB3      LYS  32 -16.980  12.755  -0.993
  221    HB3  LYS  32           HB2      LYS  32 -18.431  12.469  -0.037
  222    HG2  LYS  32           HG3      LYS  32 -17.144  12.291   1.975
  223    HG3  LYS  32           HG2      LYS  32 -15.636  12.344   1.066
  224    HD2  LYS  32           HD3      LYS  32 -16.216  14.612   0.306
  225    HD3  LYS  32           HD2      LYS  32 -17.658  14.563   1.321
  226    HE2  LYS  32           HE3      LYS  32 -16.231  14.238   3.295
  227    HE3  LYS  32           HE2      LYS  32 -14.805  14.326   2.263
  228    HZ1  LYS  32           HZ1      LYS  32 -15.445  16.591   1.664
  229    HZ2  LYS  32           HZ2      LYS  32 -15.213  16.436   3.330
  230    HZ3  LYS  32           HZ3      LYS  32 -16.780  16.500   2.696
  231    H    GLY  33           H        GLY  33 -16.312   9.413  -2.338
  232    HA2  GLY  33           HA3      GLY  33 -17.321   8.144  -4.011
  233    HA3  GLY  33           HA2      GLY  33 -18.894   8.724  -3.474
  234    H    LYS  34           H        LYS  34 -16.399  11.037  -4.095
  235    HA   LYS  34           HA       LYS  34 -17.917  11.933  -6.443
  236    HB2  LYS  34           HB3      LYS  34 -15.973  13.457  -4.707
  237    HB3  LYS  34           HB2      LYS  34 -16.897  14.130  -6.040
  238    HG2  LYS  34           HG3      LYS  34 -18.032  13.006  -3.491
  239    HG3  LYS  34           HG2      LYS  34 -17.877  14.711  -3.897
  240    HD2  LYS  34           HD3      LYS  34 -19.379  14.372  -5.814
  241    HD3  LYS  34           HD2      LYS  34 -19.556  12.678  -5.352
  242    HE2  LYS  34           HE3      LYS  34 -20.310  15.043  -3.649
  243    HE3  LYS  34           HE2      LYS  34 -21.435  14.060  -4.574
  244    HZ1  LYS  34           HZ1      LYS  34 -20.717  12.133  -3.239
  245    HZ2  LYS  34           HZ2      LYS  34 -21.436  13.346  -2.307
  246    HZ3  LYS  34           HZ3      LYS  34 -19.757  13.164  -2.300
  247    H    GLU  35           H        GLU  35 -16.979  12.156  -8.404
  248    HA   GLU  35           HA       GLU  35 -14.230  11.257  -8.708
  249    HB2  GLU  35           HB3      GLU  35 -15.858  10.344 -10.269
  250    HB3  GLU  35           HB2      GLU  35 -16.346  11.963 -10.749
  251    HG2  GLU  35           HG3      GLU  35 -14.221  12.366 -11.774
  252    HG3  GLU  35           HG2      GLU  35 -13.586  10.845 -11.158
  253    H    VAL  36           H        VAL  36 -12.653  12.674  -8.596
  254    HA   VAL  36           HA       VAL  36 -13.222  15.460  -9.351
  255    HB   VAL  36           HB       VAL  36 -11.616  16.152  -7.568
  256   HG11  VAL  36          HG11      VAL  36 -13.185  15.854  -5.709
  257   HG12  VAL  36          HG12      VAL  36 -14.045  14.628  -6.642
  258   HG13  VAL  36          HG13      VAL  36 -14.013  16.302  -7.199
  259   HG21  VAL  36          HG21      VAL  36 -10.425  14.033  -7.320
  260   HG22  VAL  36          HG22      VAL  36 -11.887  13.283  -6.677
  261   HG23  VAL  36          HG23      VAL  36 -11.089  14.576  -5.780
  262    H    THR  37           H        THR  37 -11.392  16.711 -10.018
  263    HA   THR  37           HA       THR  37  -9.584  15.174 -11.672
  264    HB   THR  37           HB       THR  37  -9.758  18.170 -11.342
  265    HG1  THR  37           HG1      THR  37 -11.750  17.094 -12.068
  266   HG21  THR  37          HG21      THR  37  -8.717  18.222 -13.562
  267   HG22  THR  37          HG22      THR  37  -8.628  16.461 -13.561
  268   HG23  THR  37          HG23      THR  37  -7.691  17.393 -12.391
  269    H    VAL  38           H        VAL  38  -7.541  14.716 -11.168
  270    HA   VAL  38           HA       VAL  38  -6.651  15.465  -8.504
  271    HB   VAL  38           HB       VAL  38  -5.437  13.491 -10.442
  272   HG11  VAL  38          HG11      VAL  38  -5.024  13.872  -7.479
  273   HG12  VAL  38          HG12      VAL  38  -3.861  14.253  -8.751
  274   HG13  VAL  38          HG13      VAL  38  -4.329  12.580  -8.456
  275   HG21  VAL  38          HG21      VAL  38  -7.323  13.018  -8.139
  276   HG22  VAL  38          HG22      VAL  38  -6.552  11.771  -9.119
  277   HG23  VAL  38          HG23      VAL  38  -7.721  12.871  -9.851
  278    H    LEU  39           H        LEU  39  -4.904  16.684  -8.042
  279    HA   LEU  39           HA       LEU  39  -3.355  17.744 -10.306
  280    HB2  LEU  39           HB3      LEU  39  -3.714  18.939  -7.551
  281    HB3  LEU  39           HB2      LEU  39  -2.872  19.676  -8.904
  282    HG   LEU  39           HG       LEU  39  -5.833  19.100  -8.800
  283   HD11  LEU  39          HD11      LEU  39  -5.211  20.875  -7.269
  284   HD12  LEU  39          HD12      LEU  39  -6.069  21.533  -8.663
  285   HD13  LEU  39          HD13      LEU  39  -4.315  21.690  -8.552
  286   HD21  LEU  39          HD21      LEU  39  -5.929  20.446 -10.840
  287   HD22  LEU  39          HD22      LEU  39  -4.960  18.991 -11.061
  288   HD23  LEU  39          HD23      LEU  39  -4.169  20.553 -10.847
  289    H    ALA  40           H        ALA  40  -1.425  16.839 -10.487
  290    HA   ALA  40           HA       ALA  40  -0.177  15.316  -8.441
  291    HB1  ALA  40           HB1      ALA  40   1.706  15.154  -9.980
  292    HB2  ALA  40           HB2      ALA  40   1.003  16.422 -10.985
  293    HB3  ALA  40           HB3      ALA  40   0.181  14.869 -10.821
  294    H    GLU  41           H        GLU  41  -0.153  18.609  -9.330
  295    HA   GLU  41           HA       GLU  41   2.051  19.185  -7.489
  296    HB2  GLU  41           HB3      GLU  41   1.888  21.504  -8.542
  297    HB3  GLU  41           HB2      GLU  41   2.485  20.216  -9.580
  298    HG2  GLU  41           HG3      GLU  41   0.372  20.039 -10.680
  299    HG3  GLU  41           HG2      GLU  41  -0.365  21.173  -9.551
  300    H    VAL  42           H        VAL  42   1.573  20.040  -5.561
  301    HA   VAL  42           HA       VAL  42  -1.219  20.661  -5.050
  302    HB   VAL  42           HB       VAL  42  -0.539  20.757  -2.642
  303   HG11  VAL  42          HG11      VAL  42   0.126  18.236  -4.158
  304   HG12  VAL  42          HG12      VAL  42  -1.468  18.731  -3.587
  305   HG13  VAL  42          HG13      VAL  42  -0.204  18.326  -2.427
  306   HG21  VAL  42          HG21      VAL  42   2.115  19.752  -3.673
  307   HG22  VAL  42          HG22      VAL  42   1.633  19.880  -1.982
  308   HG23  VAL  42          HG23      VAL  42   1.824  21.338  -2.958
  309    H    ASN  43           H        ASN  43  -1.649  22.605  -5.824
  310    HA   ASN  43           HA       ASN  43   0.088  24.859  -5.294
  311    HB2  ASN  43           HB3      ASN  43  -2.582  24.627  -6.708
  312    HB3  ASN  43           HB2      ASN  43  -1.738  26.155  -6.480
  313   HD21  ASN  43          HD21      ASN  43  -1.748  23.107  -8.168
  314   HD22  ASN  43          HD22      ASN  43  -0.543  23.527  -9.341
  315    H    ILE  44           H        ILE  44   0.091  25.252  -3.149
  316    HA   ILE  44           HA       ILE  44  -2.464  25.528  -1.754
  317    HB   ILE  44           HB       ILE  44   0.335  25.818  -0.633
  318   HG12  ILE  44          HG13      ILE  44  -1.492  23.407  -0.482
  319   HG13  ILE  44          HG12      ILE  44  -0.134  23.547  -1.597
  320   HG21  ILE  44          HG21      ILE  44  -0.733  25.529   1.527
  321   HG22  ILE  44          HG22      ILE  44  -2.305  25.355   0.750
  322   HG23  ILE  44          HG23      ILE  44  -1.450  26.895   0.674
  323   HD11  ILE  44          HD11      ILE  44   1.397  23.725   0.305
  324   HD12  ILE  44          HD12      ILE  44   0.472  22.224   0.338
  325   HD13  ILE  44          HD13      ILE  44   0.033  23.554   1.410
  326    H    ASN  45           H        ASN  45   0.541  27.395  -1.619
  327    HA   ASN  45           HA       ASN  45  -0.627  29.744  -2.741
  328    HB2  ASN  45           HB3      ASN  45  -1.553  29.880  -0.441
  329    HB3  ASN  45           HB2      ASN  45   0.081  29.797   0.210
  330   HD21  ASN  45          HD21      ASN  45  -0.896  31.605  -2.660
  331   HD22  ASN  45          HD22      ASN  45  -0.584  33.166  -1.994
  332    H    ASN  46           H        ASN  46   1.073  29.772  -4.114
  333    HA   ASN  46           HA       ASN  46   3.112  30.374  -4.904
  334    HB2  ASN  46           HB3      ASN  46   3.232  32.122  -3.182
  335    HB3  ASN  46           HB2      ASN  46   3.851  30.948  -2.023
  336   HD21  ASN  46          HD21      ASN  46   5.985  30.329  -2.117
  337   HD22  ASN  46          HD22      ASN  46   7.139  31.086  -3.161
  338    H    SER  47           H        SER  47   3.313  28.437  -1.934
  339    HA   SER  47           HA       SER  47   5.592  26.967  -2.856
  340    HB2  SER  47           HB3      SER  47   3.665  26.261  -0.627
  341    HB3  SER  47           HB2      SER  47   5.315  25.672  -0.828
  342    HG   SER  47           HG       SER  47   6.043  27.821  -0.511
  343    H    VAL  48           H        VAL  48   5.471  25.530  -4.442
  344    HA   VAL  48           HA       VAL  48   3.181  23.686  -4.552
  345    HB   VAL  48           HB       VAL  48   4.442  24.875  -7.026
  346   HG11  VAL  48          HG11      VAL  48   2.476  23.960  -8.156
  347   HG12  VAL  48          HG12      VAL  48   1.907  23.299  -6.623
  348   HG13  VAL  48          HG13      VAL  48   3.406  22.706  -7.336
  349   HG21  VAL  48          HG21      VAL  48   3.359  26.699  -5.903
  350   HG22  VAL  48          HG22      VAL  48   1.907  25.735  -5.647
  351   HG23  VAL  48          HG23      VAL  48   2.372  26.211  -7.278
  352    H    PHE  49           H        PHE  49   3.777  21.576  -4.963
  353    HA   PHE  49           HA       PHE  49   6.301  21.022  -6.240
  354    HB2  PHE  49           HB3      PHE  49   7.214  19.635  -4.444
  355    HB3  PHE  49           HB2      PHE  49   6.993  21.289  -3.890
  356    HD1  PHE  49           HD1      PHE  49   5.289  21.827  -2.232
  357    HD2  PHE  49           HD2      PHE  49   5.932  17.824  -3.533
  358    HE1  PHE  49           HE1      PHE  49   4.026  20.993  -0.288
  359    HE2  PHE  49           HE2      PHE  49   4.672  16.986  -1.596
  360    HZ   PHE  49           HZ       PHE  49   3.719  18.570   0.030
  361    H    ARG  50           H        ARG  50   6.544  18.863  -6.916
  362    HA   ARG  50           HA       ARG  50   4.082  17.242  -6.769
  363    HB2  ARG  50           HB3      ARG  50   6.134  17.337  -8.997
  364    HB3  ARG  50           HB2      ARG  50   4.759  16.248  -8.936
  365    HG2  ARG  50           HG3      ARG  50   3.271  18.242  -8.971
  366    HG3  ARG  50           HG2      ARG  50   4.703  19.240  -9.222
  367    HD2  ARG  50           HD3      ARG  50   5.216  17.952 -11.256
  368    HD3  ARG  50           HD2      ARG  50   3.742  17.015 -11.016
  369    HE   ARG  50           HE       ARG  50   3.268  19.838 -11.141
  370   HH11  ARG  50          HH11      ARG  50   3.739  16.950 -13.073
  371   HH12  ARG  50          HH12      ARG  50   2.890  17.584 -14.445
  372   HH21  ARG  50          HH21      ARG  50   2.158  20.668 -12.938
  373   HH22  ARG  50          HH22      ARG  50   2.000  19.696 -14.375
  374    H    GLN  51           H        GLN  51   4.276  15.222  -5.996
  375    HA   GLN  51           HA       GLN  51   6.983  14.076  -5.787
  376    HB2  GLN  51           HB3      GLN  51   5.999  14.644  -3.574
  377    HB3  GLN  51           HB2      GLN  51   4.637  13.590  -3.928
  378    HG2  GLN  51           HG3      GLN  51   6.256  12.530  -2.443
  379    HG3  GLN  51           HG2      GLN  51   6.100  11.660  -3.969
  380   HE21  GLN  51          HE21      GLN  51   8.111  10.687  -3.734
  381   HE22  GLN  51          HE22      GLN  51   9.593  11.559  -3.939
  382    H    TYR  52           H        TYR  52   4.159  13.967  -7.364
  383    HA   TYR  52           HA       TYR  52   3.197  12.547  -8.837
  384    HB2  TYR  52           HB3      TYR  52   5.451  10.637  -8.162
  385    HB3  TYR  52           HB2      TYR  52   4.347  10.490  -9.523
  386    HD1  TYR  52           HD1      TYR  52   4.582  13.736  -9.804
  387    HD2  TYR  52           HD2      TYR  52   7.274  10.443  -9.853
  388    HE1  TYR  52           HE1      TYR  52   6.141  15.035 -11.181
  389    HE2  TYR  52           HE2      TYR  52   8.841  11.738 -11.234
  390    HH   TYR  52           HH       TYR  52   8.512  15.102 -11.722
  391    H    PHE  53           H        PHE  53   2.279  10.174  -8.918
  392    HA   PHE  53           HA       PHE  53   1.367   9.537  -6.187
  393    HB2  PHE  53           HB3      PHE  53  -0.168   9.266  -8.783
  394    HB3  PHE  53           HB2      PHE  53  -0.762   8.783  -7.194
  395    HD1  PHE  53           HD1      PHE  53  -1.041  10.549  -5.428
  396    HD2  PHE  53           HD2      PHE  53  -0.355  11.473  -9.521
  397    HE1  PHE  53           HE1      PHE  53  -1.873  12.831  -5.044
  398    HE2  PHE  53           HE2      PHE  53  -1.188  13.755  -9.150
  399    HZ   PHE  53           HZ       PHE  53  -1.943  14.440  -6.910
  400    H    PHE  54           H        PHE  54   1.715   7.576  -5.458
  401    HA   PHE  54           HA       PHE  54   3.088   5.677  -7.144
  402    HB2  PHE  54           HB3      PHE  54   3.236   4.380  -4.935
  403    HB3  PHE  54           HB2      PHE  54   4.078   5.923  -5.011
  404    HD1  PHE  54           HD1      PHE  54   3.155   7.895  -3.831
  405    HD2  PHE  54           HD2      PHE  54   1.429   4.023  -3.425
  406    HE1  PHE  54           HE1      PHE  54   1.966   8.640  -1.813
  407    HE2  PHE  54           HE2      PHE  54   0.235   4.767  -1.406
  408    HZ   PHE  54           HZ       PHE  54   0.502   7.076  -0.600
  409    H    GLU  55           H        GLU  55   1.913   4.393  -8.390
  410    HA   GLU  55           HA       GLU  55  -0.423   3.058  -7.181
  411    HB2  GLU  55           HB3      GLU  55  -0.154   3.708 -10.126
  412    HB3  GLU  55           HB2      GLU  55  -1.572   3.088  -9.291
  413    HG2  GLU  55           HG3      GLU  55  -1.616   5.257  -7.996
  414    HG3  GLU  55           HG2      GLU  55  -0.382   5.847  -9.113
  415    H    THR  56           H        THR  56  -0.015   0.980  -6.915
  416    HA   THR  56           HA       THR  56   1.934  -0.330  -8.677
  417    HB   THR  56           HB       THR  56   0.798  -1.325  -6.058
  418    HG1  THR  56           HG1      THR  56   2.189   0.064  -5.274
  419   HG21  THR  56          HG21      THR  56   3.101  -2.342  -7.731
  420   HG22  THR  56          HG22      THR  56   1.534  -3.130  -7.536
  421   HG23  THR  56          HG23      THR  56   2.617  -2.967  -6.153
  422    H    LYS  57           H        LYS  57   1.100  -1.340 -10.337
  423    HA   LYS  57           HA       LYS  57  -1.698  -2.217 -10.184
  424    HB2  LYS  57           HB3      LYS  57  -0.009  -1.739 -12.647
  425    HB3  LYS  57           HB2      LYS  57  -1.752  -1.982 -12.586
  426    HG2  LYS  57           HG3      LYS  57  -1.863   0.122 -11.189
  427    HG3  LYS  57           HG2      LYS  57  -0.180   0.395 -11.634
  428    HD2  LYS  57           HD3      LYS  57  -1.510   1.626 -13.162
  429    HD3  LYS  57           HD2      LYS  57  -0.907   0.215 -14.033
  430    HE2  LYS  57           HE3      LYS  57  -3.253   0.584 -14.527
  431    HE3  LYS  57           HE2      LYS  57  -3.032  -0.924 -13.643
  432    HZ1  LYS  57           HZ1      LYS  57  -4.077   1.646 -12.620
  433    HZ2  LYS  57           HZ2      LYS  57  -3.593   0.398 -11.587
  434    HZ3  LYS  57           HZ3      LYS  57  -4.866   0.152 -12.677
  435    H    CYS  58           H        CYS  58  -2.301  -4.190 -11.206
  436    HA   CYS  58           HA       CYS  58  -0.427  -6.298 -10.652
  437    HB2  CYS  58           HB3      CYS  58  -3.243  -6.398 -11.757
  438    HB3  CYS  58           HB2      CYS  58  -2.306  -7.801 -11.263
  439    H    ARG  59           H        ARG  59   0.957  -7.134 -12.036
  440    HA   ARG  59           HA       ARG  59   0.723  -6.668 -14.889
  441    HB2  ARG  59           HB3      ARG  59   2.739  -8.166 -13.205
  442    HB3  ARG  59           HB2      ARG  59   2.816  -8.102 -14.956
  443    HG2  ARG  59           HG3      ARG  59   3.118  -5.703 -14.887
  444    HG3  ARG  59           HG2      ARG  59   2.942  -5.711 -13.133
  445    HD2  ARG  59           HD3      ARG  59   4.943  -7.014 -12.882
  446    HD3  ARG  59           HD2      ARG  59   5.082  -7.220 -14.625
  447    HE   ARG  59           HE       ARG  59   5.281  -4.636 -14.553
  448   HH11  ARG  59          HH11      ARG  59   6.588  -6.876 -12.197
  449   HH12  ARG  59          HH12      ARG  59   7.930  -5.862 -11.791
  450   HH21  ARG  59          HH21      ARG  59   7.064  -3.308 -14.029
  451   HH22  ARG  59          HH22      ARG  59   8.201  -3.830 -12.827
  452    H    ALA  60           H        ALA  60  -0.939  -7.809 -15.725
  453    HA   ALA  60           HA       ALA  60  -2.202  -9.563 -16.439
  454    HB1  ALA  60           HB1      ALA  60  -0.057 -10.504 -17.179
  455    HB2  ALA  60           HB2      ALA  60  -1.173 -11.762 -16.648
  456    HB3  ALA  60           HB3      ALA  60   0.151 -11.258 -15.597
  457    H    SER  61           H        SER  61  -2.586 -12.137 -15.419
  458    HA   SER  61           HA       SER  61  -2.939 -11.967 -12.569
  459    HB2  SER  61           HB3      SER  61  -5.468 -12.337 -12.812
  460    HB3  SER  61           HB2      SER  61  -4.867 -10.701 -13.083
  461    HG   SER  61           HG       SER  61  -4.833 -12.162 -15.370
  462    H    ASN  62           H        ASN  62  -3.101 -13.919 -11.641
  463    HA   ASN  62           HA       ASN  62  -3.201 -16.165 -11.336
  464    HB2  ASN  62           HB3      ASN  62  -4.909 -15.990 -13.814
  465    HB3  ASN  62           HB2      ASN  62  -4.615 -17.505 -12.967
  466   HD21  ASN  62          HD21      ASN  62  -4.611 -16.322 -10.333
  467   HD22  ASN  62          HD22      ASN  62  -6.258 -15.930  -9.972
  468    HA   PRO  63           HA       PRO  63   0.331 -16.815 -14.309
  469    HB2  PRO  63           HB3      PRO  63   2.071 -17.560 -12.320
  470    HB3  PRO  63           HB2      PRO  63   1.900 -15.898 -12.906
  471    HG2  PRO  63           HG3      PRO  63   0.724 -17.191 -10.476
  472    HG3  PRO  63           HG2      PRO  63   1.419 -15.570 -10.656
  473    HD2  PRO  63           HD3      PRO  63  -1.252 -15.984 -10.616
  474    HD3  PRO  63           HD2      PRO  63  -0.512 -14.708 -11.615
  475    H    VAL  64           H        VAL  64  -1.231 -18.583 -11.771
  476    HA   VAL  64           HA       VAL  64  -0.570 -21.102 -13.135
  477    HB   VAL  64           HB       VAL  64  -0.597 -22.269 -10.967
  478   HG11  VAL  64          HG11      VAL  64   1.556 -21.457 -10.108
  479   HG12  VAL  64          HG12      VAL  64   1.385 -20.000 -11.088
  480   HG13  VAL  64          HG13      VAL  64   1.545 -21.574 -11.868
  481   HG21  VAL  64          HG21      VAL  64  -0.518 -21.020  -8.873
  482   HG22  VAL  64          HG22      VAL  64  -2.026 -20.721  -9.736
  483   HG23  VAL  64          HG23      VAL  64  -0.743 -19.512  -9.758
  484    H    GLU  65           H        GLU  65  -2.220 -22.794 -12.799
  485    HA   GLU  65           HA       GLU  65  -4.857 -21.612 -12.993
  486    HB2  GLU  65           HB3      GLU  65  -3.800 -23.549 -14.430
  487    HB3  GLU  65           HB2      GLU  65  -4.358 -24.567 -13.112
  488    HG2  GLU  65           HG3      GLU  65  -6.125 -22.712 -14.686
  489    HG3  GLU  65           HG2      GLU  65  -5.913 -24.421 -15.041
  490    H    SER  66           H        SER  66  -4.997 -20.915 -10.833
  491    HA   SER  66           HA       SER  66  -6.601 -22.403  -9.166
  492    HB2  SER  66           HB3      SER  66  -4.465 -23.778  -8.826
  493    HB3  SER  66           HB2      SER  66  -3.788 -22.359  -8.029
  494    HG   SER  66           HG       SER  66  -6.260 -23.010  -7.079
  495    H    GLY  67           H        GLY  67  -4.021 -20.050  -9.406
  496    HA2  GLY  67           HA3      GLY  67  -5.457 -17.821  -8.784
  497    HA3  GLY  67           HA2      GLY  67  -4.931 -18.449  -7.225
  498    H    CYS  68           H        CYS  68  -2.819 -18.277  -6.623
  499    HA   CYS  68           HA       CYS  68  -1.006 -16.927  -8.508
  500    HB2  CYS  68           HB3      CYS  68  -1.225 -16.443  -5.522
  501    HB3  CYS  68           HB2      CYS  68  -0.072 -15.664  -6.610
  502    H    ARG  69           H        ARG  69   1.350 -17.171  -7.726
  503    HA   ARG  69           HA       ARG  69   1.939 -19.924  -7.722
  504    HB2  ARG  69           HB3      ARG  69   3.774 -17.634  -6.970
  505    HB3  ARG  69           HB2      ARG  69   4.277 -19.254  -7.446
  506    HG2  ARG  69           HG3      ARG  69   3.226 -18.853  -9.671
  507    HG3  ARG  69           HG2      ARG  69   2.909 -17.192  -9.162
  508    HD2  ARG  69           HD3      ARG  69   4.930 -17.225 -10.466
  509    HD3  ARG  69           HD2      ARG  69   5.343 -16.895  -8.781
  510    HE   ARG  69           HE       ARG  69   5.482 -19.680  -9.436
  511   HH11  ARG  69          HH11      ARG  69   7.221 -16.649  -9.519
  512   HH12  ARG  69          HH12      ARG  69   8.782 -17.395  -9.594
  513   HH21  ARG  69          HH21      ARG  69   7.538 -20.677  -9.520
  514   HH22  ARG  69          HH22      ARG  69   8.965 -19.693  -9.588
  515    H    GLY  70           H        GLY  70   1.944 -21.340  -6.125
  516    HA2  GLY  70           HA3      GLY  70   2.687 -21.971  -3.890
  517    HA3  GLY  70           HA2      GLY  70   2.239 -20.350  -3.357
  518    H    ILE  71           H        ILE  71  -0.236 -20.326  -4.886
  519    HA   ILE  71           HA       ILE  71  -1.921 -21.637  -2.947
  520    HB   ILE  71           HB       ILE  71  -2.722 -20.159  -5.460
  521   HG12  ILE  71          HG13      ILE  71  -1.401 -18.752  -3.882
  522   HG13  ILE  71          HG12      ILE  71  -3.057 -18.195  -4.088
  523   HG21  ILE  71          HG21      ILE  71  -4.899 -19.906  -4.337
  524   HG22  ILE  71          HG22      ILE  71  -4.315 -20.910  -3.012
  525   HG23  ILE  71          HG23      ILE  71  -4.484 -21.596  -4.627
  526   HD11  ILE  71          HD11      ILE  71  -2.344 -18.064  -1.767
  527   HD12  ILE  71          HD12      ILE  71  -2.018 -19.796  -1.760
  528   HD13  ILE  71          HD13      ILE  71  -3.669 -19.209  -1.960
  529    H    ASP  72           H        ASP  72  -2.705 -23.628  -3.136
  530    HA   ASP  72           HA       ASP  72  -3.498 -24.615  -5.757
  531    HB2  ASP  72           HB3      ASP  72  -1.157 -25.435  -5.394
  532    HB3  ASP  72           HB2      ASP  72  -1.721 -26.273  -3.952
  533    H    SER  73           H        SER  73  -5.583 -24.295  -4.924
  534    HA   SER  73           HA       SER  73  -6.473 -26.368  -3.084
  535    HB2  SER  73           HB3      SER  73  -5.953 -24.435  -1.646
  536    HB3  SER  73           HB2      SER  73  -6.997 -23.413  -2.635
  537    HG   SER  73           HG       SER  73  -7.712 -24.734  -0.540
  538    H    LYS  74           H        LYS  74  -8.624 -26.925  -3.341
  539    HA   LYS  74           HA       LYS  74  -9.982 -25.804  -5.670
  540    HB2  LYS  74           HB3      LYS  74  -9.707 -28.283  -5.410
  541    HB3  LYS  74           HB2      LYS  74 -10.718 -28.203  -3.978
  542    HG2  LYS  74           HG3      LYS  74 -12.556 -27.316  -5.389
  543    HG3  LYS  74           HG2      LYS  74 -11.533 -27.571  -6.803
  544    HD2  LYS  74           HD3      LYS  74 -12.415 -29.704  -4.868
  545    HD3  LYS  74           HD2      LYS  74 -13.101 -29.425  -6.467
  546    HE2  LYS  74           HE3      LYS  74 -10.864 -29.863  -7.442
  547    HE3  LYS  74           HE2      LYS  74 -10.277 -30.251  -5.827
  548    HZ1  LYS  74           HZ1      LYS  74 -10.877 -32.232  -7.086
  549    HZ2  LYS  74           HZ2      LYS  74 -12.463 -31.679  -7.235
  550    HZ3  LYS  74           HZ3      LYS  74 -11.844 -32.065  -5.711
  551    H    HIS  75           H        HIS  75  -9.852 -25.486  -2.351
  552    HA   HIS  75           HA       HIS  75 -12.653 -24.817  -1.940
  553    HB2  HIS  75           HB3      HIS  75 -10.257 -24.697  -0.086
  554    HB3  HIS  75           HB2      HIS  75 -11.890 -24.250   0.388
  555    HD1  HIS  75           HD1      HIS  75 -13.297 -26.072   1.319
  556    HD2  HIS  75           HD2      HIS  75 -10.057 -27.536  -0.833
  557    HE1  HIS  75           HE1      HIS  75 -13.327 -28.563   1.661
  558    HE2  HIS  75           HE2      HIS  75 -11.435 -29.437   0.249
  559    H    TRP  76           H        TRP  76  -9.612 -23.302  -2.549
  560    HA   TRP  76           HA       TRP  76 -10.844 -20.651  -2.224
  561    HB2  TRP  76           HB3      TRP  76  -7.946 -21.484  -1.947
  562    HB3  TRP  76           HB2      TRP  76  -8.490 -19.810  -1.974
  563    HD1  TRP  76           HD1      TRP  76  -7.756 -22.556   0.355
  564    HE1  TRP  76           HE1      TRP  76  -8.580 -21.978   2.720
  565    HE3  TRP  76           HE3      TRP  76 -10.729 -18.552  -0.773
  566    HZ2  TRP  76           HZ2      TRP  76 -10.265 -20.080   3.949
  567    HZ3  TRP  76           HZ3      TRP  76 -11.911 -17.411   1.057
  568    HH2  TRP  76           HH2      TRP  76 -11.685 -18.163   3.368
  569    H    ASN  77           H        ASN  77 -10.879 -19.332  -3.934
  570    HA   ASN  77           HA       ASN  77  -9.074 -19.973  -6.181
  571    HB2  ASN  77           HB3      ASN  77 -11.451 -20.088  -6.850
  572    HB3  ASN  77           HB2      ASN  77 -11.695 -18.447  -6.263
  573   HD21  ASN  77          HD21      ASN  77 -11.017 -16.726  -7.500
  574   HD22  ASN  77          HD22      ASN  77 -10.420 -16.903  -9.115
  575    H    SER  78           H        SER  78  -7.623 -18.410  -6.748
  576    HA   SER  78           HA       SER  78  -7.799 -15.926  -5.178
  577    HB2  SER  78           HB3      SER  78  -5.174 -17.124  -6.015
  578    HB3  SER  78           HB2      SER  78  -5.514 -16.005  -4.701
  579    HG   SER  78           HG       SER  78  -6.700 -17.763  -3.711
  580    H    TYR  79           H        TYR  79  -7.057 -14.034  -6.123
  581    HA   TYR  79           HA       TYR  79  -5.981 -14.064  -8.783
  582    HB2  TYR  79           HB3      TYR  79  -7.785 -12.519  -9.676
  583    HB3  TYR  79           HB2      TYR  79  -8.251 -14.205  -9.481
  584    HD1  TYR  79           HD1      TYR  79  -8.873 -10.774  -8.433
  585    HD2  TYR  79           HD2      TYR  79  -9.774 -14.859  -7.651
  586    HE1  TYR  79           HE1      TYR  79 -10.849 -10.089  -7.135
  587    HE2  TYR  79           HE2      TYR  79 -11.745 -14.185  -6.348
  588    HH   TYR  79           HH       TYR  79 -12.952 -10.971  -6.372
  589    H    CYS  80           H        CYS  80  -5.514 -11.837  -9.536
  590    HA   CYS  80           HA       CYS  80  -4.203 -10.514  -7.326
  591    HB2  CYS  80           HB3      CYS  80  -4.069  -9.762 -10.251
  592    HB3  CYS  80           HB2      CYS  80  -2.874  -9.439  -8.991
  593    H    THR  81           H        THR  81  -5.161  -8.932  -6.264
  594    HA   THR  81           HA       THR  81  -6.950  -7.116  -7.736
  595    HB   THR  81           HB       THR  81  -7.298  -8.108  -4.895
  596    HG1  THR  81           HG1      THR  81  -8.088  -9.093  -7.266
  597   HG21  THR  81          HG21      THR  81  -8.051  -5.783  -5.173
  598   HG22  THR  81          HG22      THR  81  -9.410  -6.877  -4.920
  599   HG23  THR  81          HG23      THR  81  -9.055  -6.275  -6.538
  600    H    THR  82           H        THR  82  -6.517  -4.998  -7.493
  601    HA   THR  82           HA       THR  82  -4.216  -4.248  -5.951
  602    HB   THR  82           HB       THR  82  -4.912  -1.913  -6.839
  603    HG1  THR  82           HG1      THR  82  -6.099  -2.798  -9.016
  604   HG21  THR  82          HG21      THR  82  -3.844  -2.390  -8.993
  605   HG22  THR  82          HG22      THR  82  -4.081  -4.116  -8.729
  606   HG23  THR  82          HG23      THR  82  -3.007  -3.203  -7.671
  607    H    THR  83           H        THR  83  -4.173  -3.327  -4.008
  608    HA   THR  83           HA       THR  83  -6.607  -2.936  -2.544
  609    HB   THR  83           HB       THR  83  -4.992  -2.013  -0.782
  610    HG1  THR  83           HG1      THR  83  -2.867  -2.098  -1.196
  611   HG21  THR  83          HG21      THR  83  -4.547  -4.812  -1.828
  612   HG22  THR  83          HG22      THR  83  -5.824  -4.309  -0.719
  613   HG23  THR  83          HG23      THR  83  -4.136  -4.242  -0.211
  614    H    HIS  84           H        HIS  84  -7.765  -1.130  -2.448
  615    HA   HIS  84           HA       HIS  84  -6.607   1.280  -3.670
  616    HB2  HIS  84           HB3      HIS  84  -9.535   0.610  -3.255
  617    HB3  HIS  84           HB2      HIS  84  -8.892   1.973  -4.163
  618    HD1  HIS  84           HD1      HIS  84 -10.257  -1.264  -4.673
  619    HD2  HIS  84           HD2      HIS  84  -7.189   0.906  -6.452
  620    HE1  HIS  84           HE1      HIS  84  -9.866  -2.351  -6.903
  621    HE2  HIS  84           HE2      HIS  84  -7.871  -1.152  -7.863
  622    H    THR  85           H        THR  85  -5.987   2.792  -2.282
  623    HA   THR  85           HA       THR  85  -7.486   3.021   0.255
  624    HB   THR  85           HB       THR  85  -5.081   2.195   0.465
  625    HG1  THR  85           HG1      THR  85  -4.689   3.728   2.231
  626   HG21  THR  85          HG21      THR  85  -3.309   3.877   0.321
  627   HG22  THR  85          HG22      THR  85  -4.473   5.068  -0.260
  628   HG23  THR  85          HG23      THR  85  -4.086   3.657  -1.246
  629    H    PHE  86           H        PHE  86  -7.341   5.259   1.214
  630    HA   PHE  86           HA       PHE  86  -7.811   7.161  -0.972
  631    HB2  PHE  86           HB3      PHE  86  -8.781   7.260   1.903
  632    HB3  PHE  86           HB2      PHE  86  -9.189   8.419   0.638
  633    HD1  PHE  86           HD1      PHE  86 -10.563   7.674  -1.305
  634    HD2  PHE  86           HD2      PHE  86  -9.953   5.230   2.125
  635    HE1  PHE  86           HE1      PHE  86 -12.505   6.298  -1.945
  636    HE2  PHE  86           HE2      PHE  86 -11.888   3.849   1.494
  637    HZ   PHE  86           HZ       PHE  86 -13.166   4.380  -0.541
  638    H    VAL  87           H        VAL  87  -6.288   8.600  -1.320
  639    HA   VAL  87           HA       VAL  87  -4.494   9.310   0.902
  640    HB   VAL  87           HB       VAL  87  -2.863   9.990  -0.862
  641   HG11  VAL  87          HG11      VAL  87  -3.803   7.126  -0.944
  642   HG12  VAL  87          HG12      VAL  87  -2.665   7.827   0.206
  643   HG13  VAL  87          HG13      VAL  87  -2.230   7.699  -1.498
  644   HG21  VAL  87          HG21      VAL  87  -4.804   8.650  -2.746
  645   HG22  VAL  87          HG22      VAL  87  -3.191   9.235  -3.156
  646   HG23  VAL  87          HG23      VAL  87  -4.451  10.378  -2.688
  647    H    LYS  88           H        LYS  88  -4.061  11.409   1.358
  648    HA   LYS  88           HA       LYS  88  -6.022  13.337   0.556
  649    HB2  LYS  88           HB3      LYS  88  -4.736  14.867   2.098
  650    HB3  LYS  88           HB2      LYS  88  -5.376  13.412   2.842
  651    HG2  LYS  88           HG3      LYS  88  -3.143  12.383   2.691
  652    HG3  LYS  88           HG2      LYS  88  -2.523  13.884   2.008
  653    HD2  LYS  88           HD3      LYS  88  -3.125  15.079   4.029
  654    HD3  LYS  88           HD2      LYS  88  -3.820  13.609   4.717
  655    HE2  LYS  88           HE3      LYS  88  -1.587  12.547   4.580
  656    HE3  LYS  88           HE2      LYS  88  -0.930  14.077   4.000
  657    HZ1  LYS  88           HZ1      LYS  88  -2.233  13.650   6.634
  658    HZ2  LYS  88           HZ2      LYS  88  -1.589  15.111   6.078
  659    HZ3  LYS  88           HZ3      LYS  88  -0.569  13.794   6.370
  660    H    ALA  89           H        ALA  89  -5.875  14.110  -1.409
  661    HA   ALA  89           HA       ALA  89  -3.325  15.325  -2.243
  662    HB1  ALA  89           HB1      ALA  89  -5.225  13.819  -4.046
  663    HB2  ALA  89           HB2      ALA  89  -3.676  13.209  -3.461
  664    HB3  ALA  89           HB3      ALA  89  -3.726  14.610  -4.533
  665    H    LEU  90           H        LEU  90  -3.509  17.256  -3.394
  666    HA   LEU  90           HA       LEU  90  -5.924  18.733  -3.061
  667    HB2  LEU  90           HB3      LEU  90  -3.619  19.747  -3.088
  668    HB3  LEU  90           HB2      LEU  90  -3.552  19.413  -4.813
  669    HG   LEU  90           HG       LEU  90  -5.704  20.837  -4.967
  670   HD11  LEU  90          HD11      LEU  90  -5.883  22.560  -3.226
  671   HD12  LEU  90          HD12      LEU  90  -4.661  21.710  -2.279
  672   HD13  LEU  90          HD13      LEU  90  -6.216  20.942  -2.608
  673   HD21  LEU  90          HD21      LEU  90  -4.402  22.888  -5.137
  674   HD22  LEU  90          HD22      LEU  90  -3.537  21.527  -5.850
  675   HD23  LEU  90          HD23      LEU  90  -3.074  22.128  -4.258
  676    H    THR  91           H        THR  91  -7.645  18.560  -4.305
  677    HA   THR  91           HA       THR  91  -7.279  17.771  -7.117
  678    HB   THR  91           HB       THR  91  -9.394  16.489  -6.969
  679    HG1  THR  91           HG1      THR  91  -9.155  17.110  -4.198
  680   HG21  THR  91          HG21      THR  91  -7.294  15.279  -6.713
  681   HG22  THR  91          HG22      THR  91  -8.530  14.580  -5.673
  682   HG23  THR  91          HG23      THR  91  -7.285  15.622  -4.985
  683    H    THR  92           H        THR  92  -9.014  18.503  -8.535
  684    HA   THR  92           HA       THR  92 -10.459  20.787  -7.390
  685    HB   THR  92           HB       THR  92  -8.676  21.586  -8.874
  686    HG1  THR  92           HG1      THR  92 -10.865  22.578  -8.758
  687   HG21  THR  92          HG21      THR  92  -8.727  21.167 -11.268
  688   HG22  THR  92          HG22      THR  92 -10.111  20.094 -11.070
  689   HG23  THR  92          HG23      THR  92  -8.545  19.652 -10.386
  690    H    ASP  93           H        ASP  93 -12.527  20.570  -7.384
  691    HA   ASP  93           HA       ASP  93 -13.889  18.451  -8.688
  692    HB2  ASP  93           HB3      ASP  93 -14.869  19.140  -6.672
  693    HB3  ASP  93           HB2      ASP  93 -14.748  20.846  -7.088
  694    H    GLU  94           H        GLU  94 -13.679  21.937  -9.271
  695    HA   GLU  94           HA       GLU  94 -13.962  21.556 -12.078
  696    HB2  GLU  94           HB3      GLU  94 -16.332  21.377 -11.421
  697    HB3  GLU  94           HB2      GLU  94 -16.232  22.952 -10.647
  698    HG2  GLU  94           HG3      GLU  94 -15.712  23.961 -12.823
  699    HG3  GLU  94           HG2      GLU  94 -15.900  22.382 -13.579
  700    H    LYS  95           H        LYS  95 -14.858  24.205  -9.858
  701    HA   LYS  95           HA       LYS  95 -12.988  25.929 -11.312
  702    HB2  LYS  95           HB3      LYS  95 -15.176  26.662  -9.357
  703    HB3  LYS  95           HB2      LYS  95 -14.185  27.799 -10.257
  704    HG2  LYS  95           HG3      LYS  95 -15.127  26.822 -12.358
  705    HG3  LYS  95           HG2      LYS  95 -16.235  25.887 -11.352
  706    HD2  LYS  95           HD3      LYS  95 -17.105  27.969 -10.394
  707    HD3  LYS  95           HD2      LYS  95 -16.005  28.891 -11.417
  708    HE2  LYS  95           HE3      LYS  95 -18.123  28.936 -12.476
  709    HE3  LYS  95           HE2      LYS  95 -17.112  27.829 -13.398
  710    HZ1  LYS  95           HZ1      LYS  95 -19.385  27.000 -13.007
  711    HZ2  LYS  95           HZ2      LYS  95 -19.079  26.979 -11.346
  712    HZ3  LYS  95           HZ3      LYS  95 -18.197  25.967 -12.378
  713    H    GLN  96           H        GLN  96 -13.585  24.533  -8.180
  714    HA   GLN  96           HA       GLN  96 -11.401  26.141  -7.039
  715    HB2  GLN  96           HB3      GLN  96 -13.646  24.639  -5.686
  716    HB3  GLN  96           HB2      GLN  96 -12.339  25.440  -4.830
  717    HG2  GLN  96           HG3      GLN  96 -14.308  26.808  -6.647
  718    HG3  GLN  96           HG2      GLN  96 -14.409  26.759  -4.889
  719   HE21  GLN  96          HE21      GLN  96 -12.795  28.125  -7.629
  720   HE22  GLN  96          HE22      GLN  96 -11.913  29.332  -6.769
  721    H    ALA  97           H        ALA  97  -9.785  25.162  -5.828
  722    HA   ALA  97           HA       ALA  97  -9.520  22.247  -6.169
  723    HB1  ALA  97           HB1      ALA  97  -7.318  24.291  -5.870
  724    HB2  ALA  97           HB2      ALA  97  -7.801  23.520  -7.381
  725    HB3  ALA  97           HB3      ALA  97  -7.102  22.553  -6.080
  726    H    ALA  98           H        ALA  98  -9.174  21.021  -4.374
  727    HA   ALA  98           HA       ALA  98  -8.534  22.273  -1.837
  728    HB1  ALA  98           HB1      ALA  98 -11.169  20.861  -2.245
  729    HB2  ALA  98           HB2      ALA  98 -10.956  22.594  -2.001
  730    HB3  ALA  98           HB3      ALA  98 -10.544  21.465  -0.711
  731    H    TRP  99           H        TRP  99  -8.186  20.681  -0.135
  732    HA   TRP  99           HA       TRP  99  -6.866  18.352  -1.160
  733    HB2  TRP  99           HB3      TRP  99  -7.367  19.315   1.662
  734    HB3  TRP  99           HB2      TRP  99  -6.450  17.866   1.278
  735    HD1  TRP  99           HD1      TRP  99  -6.235  21.686   1.054
  736    HE1  TRP  99           HE1      TRP  99  -3.773  22.345   0.682
  737    HE3  TRP  99           HE3      TRP  99  -4.245  17.030   0.357
  738    HZ2  TRP  99           HZ2      TRP  99  -1.315  21.059   0.168
  739    HZ3  TRP  99           HZ3      TRP  99  -1.826  16.832  -0.067
  740    HH2  TRP  99           HH2      TRP  99  -0.396  18.807  -0.159
  741    H    ARG 100           H        ARG 100  -7.901  16.584  -1.722
  742    HA   ARG 100           HA       ARG 100 -10.181  15.714  -0.080
  743    HB2  ARG 100           HB3      ARG 100  -9.802  15.435  -3.070
  744    HB3  ARG 100           HB2      ARG 100 -11.051  14.594  -2.163
  745    HG2  ARG 100           HG3      ARG 100 -10.756  17.578  -2.422
  746    HG3  ARG 100           HG2      ARG 100 -11.938  16.572  -3.255
  747    HD2  ARG 100           HD3      ARG 100 -12.946  15.954  -1.136
  748    HD3  ARG 100           HD2      ARG 100 -11.720  16.869  -0.262
  749    HE   ARG 100           HE       ARG 100 -13.881  18.000  -1.901
  750   HH11  ARG 100          HH11      ARG 100 -11.274  18.433   0.403
  751   HH12  ARG 100          HH12      ARG 100 -11.773  20.035   0.850
  752   HH21  ARG 100          HH21      ARG 100 -14.531  20.095  -1.314
  753   HH22  ARG 100          HH22      ARG 100 -13.633  20.974  -0.115
  754    H    PHE 101           H        PHE 101 -10.579  13.254  -0.598
  755    HA   PHE 101           HA       PHE 101  -7.942  11.979  -0.231
  756    HB2  PHE 101           HB3      PHE 101 -10.480  11.091   1.153
  757    HB3  PHE 101           HB2      PHE 101  -8.816  10.655   1.542
  758    HD1  PHE 101           HD1      PHE 101 -11.508  12.867   2.251
  759    HD2  PHE 101           HD2      PHE 101  -7.265  12.543   2.323
  760    HE1  PHE 101           HE1      PHE 101 -11.395  14.756   3.820
  761    HE2  PHE 101           HE2      PHE 101  -7.145  14.428   3.899
  762    HZ   PHE 101           HZ       PHE 101  -9.211  15.537   4.647
  763    H    ILE 102           H        ILE 102  -7.590  10.790  -1.997
  764    HA   ILE 102           HA       ILE 102  -9.966   9.721  -3.382
  765    HB   ILE 102           HB       ILE 102  -8.579   9.848  -5.461
  766   HG12  ILE 102          HG13      ILE 102  -6.736  11.528  -3.753
  767   HG13  ILE 102          HG12      ILE 102  -6.371   9.898  -4.301
  768   HG21  ILE 102          HG21      ILE 102 -10.240  11.535  -4.991
  769   HG22  ILE 102          HG22      ILE 102  -8.824  12.284  -5.731
  770   HG23  ILE 102          HG23      ILE 102  -9.092  12.427  -3.993
  771   HD11  ILE 102          HD11      ILE 102  -6.788  12.317  -6.040
  772   HD12  ILE 102          HD12      ILE 102  -6.490  10.680  -6.626
  773   HD13  ILE 102          HD13      ILE 102  -5.254  11.520  -5.686
  774    H    ARG 103           H        ARG 103  -9.949   7.693  -4.215
  775    HA   ARG 103           HA       ARG 103  -8.176   5.868  -2.879
  776    HB2  ARG 103           HB3      ARG 103  -9.568   4.092  -3.976
  777    HB3  ARG 103           HB2      ARG 103 -10.473   5.218  -2.980
  778    HG2  ARG 103           HG3      ARG 103 -11.838   5.007  -4.806
  779    HG3  ARG 103           HG2      ARG 103 -10.917   6.445  -5.229
  780    HD2  ARG 103           HD3      ARG 103  -9.338   4.862  -6.463
  781    HD3  ARG 103           HD2      ARG 103 -10.604   3.648  -6.278
  782    HE   ARG 103           HE       ARG 103 -12.065   5.361  -7.457
  783   HH11  ARG 103          HH11      ARG 103  -8.618   5.062  -8.004
  784   HH12  ARG 103          HH12      ARG 103  -8.695   5.662  -9.626
  785   HH21  ARG 103          HH21      ARG 103 -12.161   6.190  -9.580
  786   HH22  ARG 103          HH22      ARG 103 -10.708   6.308 -10.523
  787    H    ILE 104           H        ILE 104  -6.410   4.990  -3.617
  788    HA   ILE 104           HA       ILE 104  -5.995   4.803  -6.528
  789    HB   ILE 104           HB       ILE 104  -3.569   5.164  -6.161
  790   HG12  ILE 104          HG13      ILE 104  -4.365   6.039  -3.379
  791   HG13  ILE 104          HG12      ILE 104  -3.577   4.511  -3.748
  792   HG21  ILE 104          HG21      ILE 104  -3.672   7.590  -5.832
  793   HG22  ILE 104          HG22      ILE 104  -5.318   7.432  -5.223
  794   HG23  ILE 104          HG23      ILE 104  -4.955   7.019  -6.899
  795   HD11  ILE 104          HD11      ILE 104  -1.994   6.156  -2.927
  796   HD12  ILE 104          HD12      ILE 104  -2.433   7.247  -4.242
  797   HD13  ILE 104          HD13      ILE 104  -1.638   5.713  -4.596
  798    H    ASP 105           H        ASP 105  -4.738   3.011  -7.219
  799    HA   ASP 105           HA       ASP 105  -4.877   0.730  -5.448
  800    HB2  ASP 105           HB3      ASP 105  -3.870  -0.474  -7.499
  801    HB3  ASP 105           HB2      ASP 105  -5.523   0.117  -7.607
  802    H    THR 106           H        THR 106  -3.400   0.548  -3.966
  803    HA   THR 106           HA       THR 106  -0.804   1.817  -4.347
  804    HB   THR 106           HB       THR 106  -1.862   0.514  -1.837
  805    HG1  THR 106           HG1      THR 106  -2.725   2.733  -3.144
  806   HG21  THR 106          HG21      THR 106   0.535   1.049  -1.844
  807   HG22  THR 106          HG22      THR 106  -0.351   2.078  -0.717
  808   HG23  THR 106          HG23      THR 106   0.160   2.717  -2.279
  809    H    ALA 107           H        ALA 107  -2.159  -1.392  -3.957
  810    HA   ALA 107           HA       ALA 107   0.424  -2.550  -4.598
  811    HB1  ALA 107           HB1      ALA 107   0.398  -4.105  -2.721
  812    HB2  ALA 107           HB2      ALA 107  -1.055  -3.333  -2.089
  813    HB3  ALA 107           HB3      ALA 107   0.464  -2.436  -2.152
  814    H    CYS 108           H        CYS 108   0.265  -4.749  -5.300
  815    HA   CYS 108           HA       CYS 108  -2.467  -5.521  -6.056
  816    HB2  CYS 108           HB3      CYS 108  -1.014  -5.179  -7.995
  817    HB3  CYS 108           HB2      CYS 108   0.178  -6.286  -7.314
  818    H    VAL 109           H        VAL 109  -3.269  -6.962  -4.709
  819    HA   VAL 109           HA       VAL 109  -1.412  -8.836  -3.400
  820    HB   VAL 109           HB       VAL 109  -2.980  -8.980  -1.560
  821   HG11  VAL 109          HG11      VAL 109  -1.365  -7.157  -1.498
  822   HG12  VAL 109          HG12      VAL 109  -2.876  -6.686  -0.716
  823   HG13  VAL 109          HG13      VAL 109  -2.506  -6.107  -2.341
  824   HG21  VAL 109          HG21      VAL 109  -5.024  -7.636  -1.474
  825   HG22  VAL 109          HG22      VAL 109  -5.069  -8.780  -2.815
  826   HG23  VAL 109          HG23      VAL 109  -4.728  -7.076  -3.120
  827    H    CYS 110           H        CYS 110  -2.238 -10.998  -2.981
  828    HA   CYS 110           HA       CYS 110  -4.050 -11.892  -5.098
  829    HB2  CYS 110           HB3      CYS 110  -1.777 -12.994  -4.738
  830    HB3  CYS 110           HB2      CYS 110  -2.429 -13.643  -3.241
  831    H    VAL 111           H        VAL 111  -6.117 -11.874  -4.509
  832    HA   VAL 111           HA       VAL 111  -6.762 -12.155  -1.668
  833    HB   VAL 111           HB       VAL 111  -8.987 -11.349  -2.237
  834   HG11  VAL 111          HG11      VAL 111  -6.787  -9.705  -3.472
  835   HG12  VAL 111          HG12      VAL 111  -7.313  -9.671  -1.789
  836   HG13  VAL 111          HG13      VAL 111  -8.390  -9.100  -3.063
  837   HG21  VAL 111          HG21      VAL 111  -9.197 -12.407  -4.434
  838   HG22  VAL 111          HG22      VAL 111  -8.028 -11.260  -5.092
  839   HG23  VAL 111          HG23      VAL 111  -9.585 -10.687  -4.495
  840    H    LEU 112           H        LEU 112  -8.419 -13.559  -0.943
  841    HA   LEU 112           HA       LEU 112  -8.593 -16.004  -2.556
  842    HB2  LEU 112           HB3      LEU 112  -9.112 -15.540   0.386
  843    HB3  LEU 112           HB2      LEU 112  -9.264 -17.086  -0.427
  844    HG   LEU 112           HG       LEU 112  -6.694 -15.528  -0.084
  845   HD11  LEU 112          HD11      LEU 112  -7.519 -16.469   2.011
  846   HD12  LEU 112          HD12      LEU 112  -6.080 -17.322   1.452
  847   HD13  LEU 112          HD13      LEU 112  -7.672 -18.053   1.248
  848   HD21  LEU 112          HD21      LEU 112  -7.206 -18.257  -1.263
  849   HD22  LEU 112          HD22      LEU 112  -5.620 -17.561  -0.939
  850   HD23  LEU 112          HD23      LEU 112  -6.676 -16.823  -2.141
  851    H    SER 113           H        SER 113 -10.507 -16.838  -3.188
  852    HA   SER 113           HA       SER 113 -12.965 -15.627  -2.115
  853    HB2  SER 113           HB3      SER 113 -12.638 -15.072  -4.515
  854    HB3  SER 113           HB2      SER 113 -12.571 -16.796  -4.885
  855    HG   SER 113           HG       SER 113 -14.754 -15.249  -3.979
  856    H    ARG 114           H        ARG 114 -14.554 -17.033  -1.460
  857    HA   ARG 114           HA       ARG 114 -13.547 -19.624  -0.692
  858    HB2  ARG 114           HB3      ARG 114 -16.174 -18.250  -0.103
  859    HB3  ARG 114           HB2      ARG 114 -15.704 -19.809   0.559
  860    HG2  ARG 114           HG3      ARG 114 -13.799 -18.763   1.679
  861    HG3  ARG 114           HG2      ARG 114 -14.272 -17.199   1.012
  862    HD2  ARG 114           HD3      ARG 114 -16.376 -17.296   2.230
  863    HD3  ARG 114           HD2      ARG 114 -15.961 -18.897   2.845
  864    HE   ARG 114           HE       ARG 114 -13.892 -17.312   3.649
  865   HH11  ARG 114          HH11      ARG 114 -17.368 -17.184   4.032
  866   HH12  ARG 114          HH12      ARG 114 -17.293 -16.411   5.584
  867   HH21  ARG 114          HH21      ARG 114 -13.791 -16.276   5.683
  868   HH22  ARG 114          HH22      ARG 114 -15.262 -15.873   6.515
  869    H    LYS 115           H        LYS 115 -15.069 -18.538  -3.394
  870    HA   LYS 115           HA       LYS 115 -16.133 -19.513  -5.149
  871    HB2  LYS 115           HB3      LYS 115 -15.083 -22.058  -3.888
  872    HB3  LYS 115           HB2      LYS 115 -15.712 -21.928  -5.523
  873    HG2  LYS 115           HG3      LYS 115 -13.896 -20.393  -6.100
  874    HG3  LYS 115           HG2      LYS 115 -13.276 -20.525  -4.450
  875    HD2  LYS 115           HD3      LYS 115 -12.028 -21.991  -5.924
  876    HD3  LYS 115           HD2      LYS 115 -12.960 -22.938  -4.767
  877    HE2  LYS 115           HE3      LYS 115 -14.677 -23.318  -6.462
  878    HE3  LYS 115           HE2      LYS 115 -13.746 -22.373  -7.622
  879    HZ1  LYS 115           HZ1      LYS 115 -12.828 -24.881  -6.325
  880    HZ2  LYS 115           HZ2      LYS 115 -11.978 -23.992  -7.488
  881    HZ3  LYS 115           HZ3      LYS 115 -13.427 -24.759  -7.904
  882    H    ALA 116           H        ALA 116 -17.732 -18.945  -2.904
  883    HA   ALA 116           HA       ALA 116 -19.390 -21.225  -2.308
  884    HB1  ALA 116           HB1      ALA 116 -20.657 -19.689  -0.911
  885    HB2  ALA 116           HB2      ALA 116 -19.761 -18.324  -1.578
  886    HB3  ALA 116           HB3      ALA 116 -18.929 -19.534  -0.602
  887    H    THR 117           H        THR 117 -21.598 -21.428  -2.802
  888    HA   THR 117           HA       THR 117 -22.570 -19.728  -4.996
  889    HB   THR 117           HB       THR 117 -23.740 -21.761  -5.893
  890    HG1  THR 117           HG1      THR 117 -21.889 -23.194  -4.268
  891   HG21  THR 117          HG21      THR 117 -20.722 -21.865  -5.855
  892   HG22  THR 117          HG22      THR 117 -21.716 -20.927  -6.969
  893   HG23  THR 117          HG23      THR 117 -21.759 -22.689  -7.019
  894    H    ARG 118           H        ARG 118 -24.874 -19.479  -5.079
  895    HA   ARG 118           HA       ARG 118 -26.469 -20.553  -2.948
  896    HB2  ARG 118           HB3      ARG 118 -27.141 -17.944  -2.519
  897    HB3  ARG 118           HB2      ARG 118 -26.070 -18.877  -1.499
  898    HG2  ARG 118           HG3      ARG 118 -24.836 -16.989  -1.784
  899    HG3  ARG 118           HG2      ARG 118 -24.217 -17.967  -3.107
  900    HD2  ARG 118           HD3      ARG 118 -26.365 -15.859  -3.368
  901    HD3  ARG 118           HD2      ARG 118 -24.663 -15.613  -3.742
  902    HE   ARG 118           HE       ARG 118 -26.410 -17.513  -5.180
  903   HH11  ARG 118          HH11      ARG 118 -23.831 -15.131  -5.136
  904   HH12  ARG 118          HH12      ARG 118 -23.545 -15.227  -6.842
  905   HH21  ARG 118          HH21      ARG 118 -26.031 -17.622  -7.438
  906   HH22  ARG 118          HH22      ARG 118 -24.799 -16.632  -8.153
  907    H1   SER   1           H1       SER   1 -29.997  -8.004  -6.517
  908    H2   SER   1           H2       SER   1 -30.244  -8.136  -4.852
  909    H3   SER   1           H3       SER   1 -29.386  -9.335  -5.676
  910    HA   SER   1           HA       SER   1 -27.893  -7.931  -4.450
  911    HB2  SER   1           HB3      SER   1 -26.473  -7.218  -6.411
  912    HB3  SER   1           HB2      SER   1 -27.021  -8.892  -6.477
  913    HG   SER   1           HG       SER   1 -27.644  -6.744  -8.102
  914    H    SER   2           H        SER   2 -27.237  -5.919  -3.795
  915    HA   SER   2           HA       SER   2 -28.466  -3.584  -5.092
  916    HB2  SER   2           HB3      SER   2 -28.220  -4.017  -2.098
  917    HB3  SER   2           HB2      SER   2 -28.791  -2.538  -2.870
  918    HG   SER   2           HG       SER   2 -30.090  -4.824  -3.690
  919    H    THR   3           H        THR   3 -26.149  -4.243  -5.936
  920    HA   THR   3           HA       THR   3 -23.984  -3.749  -6.255
  921    HB   THR   3           HB       THR   3 -23.179  -1.473  -5.574
  922    HG1  THR   3           HG1      THR   3 -25.400  -1.568  -4.042
  923   HG21  THR   3          HG21      THR   3 -25.785  -1.611  -7.081
  924   HG22  THR   3          HG22      THR   3 -24.185  -1.915  -7.753
  925   HG23  THR   3          HG23      THR   3 -24.606  -0.304  -7.173
  926    H    HIS   4           H        HIS   4 -21.849  -3.158  -5.233
  927    HA   HIS   4           HA       HIS   4 -20.198  -3.782  -3.804
  928    HB2  HIS   4           HB3      HIS   4 -21.387  -1.968  -2.474
  929    HB3  HIS   4           HB2      HIS   4 -22.187  -3.258  -1.591
  930    HD1  HIS   4           HD1      HIS   4 -18.972  -1.438  -1.881
  931    HD2  HIS   4           HD2      HIS   4 -20.484  -4.727   0.164
  932    HE1  HIS   4           HE1      HIS   4 -17.298  -1.940  -0.075
  933    HE2  HIS   4           HE2      HIS   4 -18.167  -4.013   1.058
  934    HA   PRO   5           HA       PRO   5 -22.147  -7.949  -3.032
  935    HB2  PRO   5           HB3      PRO   5 -21.158  -9.340  -5.075
  936    HB3  PRO   5           HB2      PRO   5 -22.525  -8.241  -5.316
  937    HG2  PRO   5           HG3      PRO   5 -19.626  -7.833  -5.945
  938    HG3  PRO   5           HG2      PRO   5 -21.049  -7.385  -6.903
  939    HD2  PRO   5           HD3      PRO   5 -19.628  -5.654  -5.263
  940    HD3  PRO   5           HD2      PRO   5 -21.302  -5.404  -5.791
  941    H    VAL   6           H        VAL   6 -19.827  -6.778  -1.820
  942    HA   VAL   6           HA       VAL   6 -17.940  -7.319  -0.669
  943    HB   VAL   6           HB       VAL   6 -18.602 -10.216  -1.195
  944   HG11  VAL   6          HG11      VAL   6 -17.291  -8.838   1.146
  945   HG12  VAL   6          HG12      VAL   6 -16.479  -9.815  -0.080
  946   HG13  VAL   6          HG13      VAL   6 -17.629 -10.566   1.026
  947   HG21  VAL   6          HG21      VAL   6 -20.651  -9.111  -0.486
  948   HG22  VAL   6          HG22      VAL   6 -19.811  -8.419   0.903
  949   HG23  VAL   6          HG23      VAL   6 -20.037 -10.164   0.787
  950    H    PHE   7           H        PHE   7 -17.744  -6.804  -3.430
  951    HA   PHE   7           HA       PHE   7 -16.381  -6.934  -5.241
  952    HB2  PHE   7           HB3      PHE   7 -14.737  -6.649  -3.225
  953    HB3  PHE   7           HB2      PHE   7 -14.322  -8.327  -3.547
  954    HD1  PHE   7           HD1      PHE   7 -12.859  -8.891  -5.317
  955    HD2  PHE   7           HD2      PHE   7 -14.425  -4.943  -5.021
  956    HE1  PHE   7           HE1      PHE   7 -11.292  -8.139  -7.056
  957    HE2  PHE   7           HE2      PHE   7 -12.863  -4.188  -6.763
  958    HZ   PHE   7           HZ       PHE   7 -11.295  -5.784  -7.785
  959    H    HIS   8           H        HIS   8 -18.246  -8.915  -5.030
  960    HA   HIS   8           HA       HIS   8 -18.890 -10.969  -5.742
  961    HB2  HIS   8           HB3      HIS   8 -16.213 -10.912  -7.161
  962    HB3  HIS   8           HB2      HIS   8 -17.442 -12.143  -7.419
  963    HD1  HIS   8           HD1      HIS   8 -16.285  -9.022  -8.749
  964    HD2  HIS   8           HD2      HIS   8 -19.982 -10.888  -8.402
  965    HE1  HIS   8           HE1      HIS   8 -17.773  -7.879 -10.414
  966    HE2  HIS   8           HE2      HIS   8 -19.945  -9.150 -10.317
  967    H    MET   9           H        MET   9 -18.332 -11.101  -3.287
  968    HA   MET   9           HA       MET   9 -17.393 -12.109  -1.482
  969    HB2  MET   9           HB3      MET   9 -17.515 -14.548  -1.488
  970    HB3  MET   9           HB2      MET   9 -18.935 -13.838  -2.229
  971    HG2  MET   9           HG3      MET   9 -18.113 -14.404  -4.430
  972    HG3  MET   9           HG2      MET   9 -16.616 -15.021  -3.737
  973    HE1  MET   9           HE1      MET   9 -20.228 -15.475  -2.215
  974    HE2  MET   9           HE2      MET   9 -20.747 -16.952  -3.026
  975    HE3  MET   9           HE3      MET   9 -20.497 -15.477  -3.959
  976    H    GLY  10           H        GLY  10 -15.442 -10.809  -2.480
  977    HA2  GLY  10           HA3      GLY  10 -13.162 -12.682  -2.439
  978    HA3  GLY  10           HA2      GLY  10 -13.225 -11.352  -3.586
  979    H    GLU  11           H        GLU  11 -11.224 -10.650  -2.678
  980    HA   GLU  11           HA       GLU  11  -9.890  -9.358  -1.389
  981    HB2  GLU  11           HB3      GLU  11 -12.533  -8.317  -0.366
  982    HB3  GLU  11           HB2      GLU  11 -10.974  -7.609   0.044
  983    HG2  GLU  11           HG3      GLU  11 -10.604  -7.210  -2.393
  984    HG3  GLU  11           HG2      GLU  11 -12.256  -7.758  -2.680
  985    H    PHE  12           H        PHE  12 -11.113 -11.989  -0.340
  986    HA   PHE  12           HA       PHE  12 -10.936 -11.735   2.497
  987    HB2  PHE  12           HB3      PHE  12 -10.913 -14.122   0.651
  988    HB3  PHE  12           HB2      PHE  12 -10.651 -14.293   2.386
  989    HD1  PHE  12           HD1      PHE  12 -13.093 -13.802  -0.231
  990    HD2  PHE  12           HD2      PHE  12 -12.430 -13.594   3.967
  991    HE1  PHE  12           HE1      PHE  12 -15.522 -13.812   0.152
  992    HE2  PHE  12           HE2      PHE  12 -14.858 -13.608   4.355
  993    HZ   PHE  12           HZ       PHE  12 -16.406 -13.716   2.447
  994    H    SER  13           H        SER  13  -9.234 -11.927   3.805
  995    HA   SER  13           HA       SER  13  -6.690 -11.409   2.575
  996    HB2  SER  13           HB3      SER  13  -7.440 -11.586   5.503
  997    HB3  SER  13           HB2      SER  13  -5.958 -10.892   4.853
  998    HG   SER  13           HG       SER  13  -8.118  -9.800   3.664
  999    H    VAL  14           H        VAL  14  -5.172 -12.852   2.149
 1000    HA   VAL  14           HA       VAL  14  -5.217 -15.566   2.904
 1001    HB   VAL  14           HB       VAL  14  -2.826 -15.609   2.160
 1002   HG11  VAL  14          HG11      VAL  14  -3.279 -15.019  -0.189
 1003   HG12  VAL  14          HG12      VAL  14  -4.768 -14.221   0.321
 1004   HG13  VAL  14          HG13      VAL  14  -4.580 -15.963   0.537
 1005   HG21  VAL  14          HG21      VAL  14  -3.248 -12.660   1.681
 1006   HG22  VAL  14          HG22      VAL  14  -1.847 -13.600   1.175
 1007   HG23  VAL  14          HG23      VAL  14  -2.180 -13.368   2.892
 1008    H    CYS  15           H        CYS  15  -3.916 -12.723   4.372
 1009    HA   CYS  15           HA       CYS  15  -3.403 -14.245   6.819
 1010    HB2  CYS  15           HB3      CYS  15  -1.213 -13.708   5.765
 1011    HB3  CYS  15           HB2      CYS  15  -1.653 -11.999   5.754
 1012    H    ASP  16           H        ASP  16  -4.425 -13.358   8.532
 1013    HA   ASP  16           HA       ASP  16  -6.365 -11.387   8.160
 1014    HB2  ASP  16           HB3      ASP  16  -5.155 -12.590  10.642
 1015    HB3  ASP  16           HB2      ASP  16  -6.336 -11.291  10.757
 1016    H    SER  17           H        SER  17  -6.485  -9.229   8.535
 1017    HA   SER  17           HA       SER  17  -4.053  -7.850   9.386
 1018    HB2  SER  17           HB3      SER  17  -4.269  -6.330   7.375
 1019    HB3  SER  17           HB2      SER  17  -3.753  -7.980   7.006
 1020    HG   SER  17           HG       SER  17  -5.850  -8.450   6.346
 1021    H    VAL  18           H        VAL  18  -4.378  -5.793  10.205
 1022    HA   VAL  18           HA       VAL  18  -7.196  -5.026  10.564
 1023    HB   VAL  18           HB       VAL  18  -6.385  -5.860  12.657
 1024   HG11  VAL  18          HG11      VAL  18  -4.066  -3.963  12.347
 1025   HG12  VAL  18          HG12      VAL  18  -4.009  -5.726  12.303
 1026   HG13  VAL  18          HG13      VAL  18  -4.432  -4.894  13.800
 1027   HG21  VAL  18          HG21      VAL  18  -6.607  -3.874  14.095
 1028   HG22  VAL  18          HG22      VAL  18  -7.815  -3.918  12.812
 1029   HG23  VAL  18          HG23      VAL  18  -6.422  -2.846  12.674
 1030    H    SER  19           H        SER  19  -7.635  -3.202   9.523
 1031    HA   SER  19           HA       SER  19  -5.537  -1.279   8.956
 1032    HB2  SER  19           HB3      SER  19  -8.471  -1.288   8.185
 1033    HB3  SER  19           HB2      SER  19  -7.264  -0.126   7.613
 1034    HG   SER  19           HG       SER  19  -6.158  -1.828   6.611
 1035    H    VAL  20           H        VAL  20  -5.108   0.388  10.211
 1036    HA   VAL  20           HA       VAL  20  -7.145   1.265  12.152
 1037    HB   VAL  20           HB       VAL  20  -4.140   1.326  12.474
 1038   HG11  VAL  20          HG11      VAL  20  -6.335   1.983  14.427
 1039   HG12  VAL  20          HG12      VAL  20  -5.210   3.122  13.684
 1040   HG13  VAL  20          HG13      VAL  20  -4.614   1.902  14.809
 1041   HG21  VAL  20          HG21      VAL  20  -6.161  -0.506  13.750
 1042   HG22  VAL  20          HG22      VAL  20  -4.439  -0.446  14.129
 1043   HG23  VAL  20          HG23      VAL  20  -4.973  -0.958  12.528
 1044    H    TRP  21           H        TRP  21  -7.506   3.431  12.351
 1045    HA   TRP  21           HA       TRP  21  -5.962   5.203  10.597
 1046    HB2  TRP  21           HB3      TRP  21  -8.718   5.486  11.802
 1047    HB3  TRP  21           HB2      TRP  21  -7.866   6.833  11.051
 1048    HD1  TRP  21           HD1      TRP  21  -9.721   3.615  10.202
 1049    HE1  TRP  21           HE1      TRP  21 -10.124   3.527   7.661
 1050    HE3  TRP  21           HE3      TRP  21  -6.863   7.619   8.778
 1051    HZ2  TRP  21           HZ2      TRP  21  -9.333   4.957   5.361
 1052    HZ3  TRP  21           HZ3      TRP  21  -6.742   8.190   6.386
 1053    HH2  TRP  21           HH2      TRP  21  -7.951   6.884   4.715
 1054    H    VAL  22           H        VAL  22  -4.231   5.721  11.759
 1055    HA   VAL  22           HA       VAL  22  -4.270   6.159  14.577
 1056    HB   VAL  22           HB       VAL  22  -2.139   6.891  12.561
 1057   HG11  VAL  22          HG11      VAL  22  -1.982   6.550  15.551
 1058   HG12  VAL  22          HG12      VAL  22  -1.839   8.066  14.663
 1059   HG13  VAL  22          HG13      VAL  22  -0.611   6.815  14.478
 1060   HG21  VAL  22          HG21      VAL  22  -2.678   4.517  12.482
 1061   HG22  VAL  22          HG22      VAL  22  -2.467   4.401  14.228
 1062   HG23  VAL  22          HG23      VAL  22  -1.086   4.776  13.198
 1063    H    GLY  23           H        GLY  23  -4.954   7.920  15.581
 1064    HA2  GLY  23           HA3      GLY  23  -5.500  10.322  14.034
 1065    HA3  GLY  23           HA2      GLY  23  -6.021  10.000  15.684
 1066    H    ASP  24           H        ASP  24  -2.934   9.187  15.839
 1067    HA   ASP  24           HA       ASP  24  -1.657  11.761  15.748
 1068    HB2  ASP  24           HB3      ASP  24  -2.814  11.938  17.912
 1069    HB3  ASP  24           HB2      ASP  24  -2.083  10.419  18.431
 1070    H    LYS  25           H        LYS  25  -0.356  10.527  14.294
 1071    HA   LYS  25           HA       LYS  25   1.242   8.369  15.339
 1072    HB2  LYS  25           HB3      LYS  25   0.538   8.570  12.926
 1073    HB3  LYS  25           HB2      LYS  25   1.645   9.928  12.779
 1074    HG2  LYS  25           HG3      LYS  25   3.525   8.510  13.281
 1075    HG3  LYS  25           HG2      LYS  25   2.454   7.138  13.569
 1076    HD2  LYS  25           HD3      LYS  25   1.704   7.284  11.217
 1077    HD3  LYS  25           HD2      LYS  25   2.863   8.588  10.958
 1078    HE2  LYS  25           HE3      LYS  25   3.790   6.480  10.175
 1079    HE3  LYS  25           HE2      LYS  25   4.695   7.065  11.573
 1080    HZ1  LYS  25           HZ1      LYS  25   2.597   4.953  11.605
 1081    HZ2  LYS  25           HZ2      LYS  25   3.432   5.527  12.967
 1082    HZ3  LYS  25           HZ3      LYS  25   4.267   4.706  11.748
 1083    H    THR  26           H        THR  26   3.363   8.477  15.988
 1084    HA   THR  26           HA       THR  26   4.161  11.082  16.959
 1085    HB   THR  26           HB       THR  26   5.978   9.659  18.100
 1086    HG1  THR  26           HG1      THR  26   5.859   7.535  17.873
 1087   HG21  THR  26          HG21      THR  26   4.048  10.533  19.299
 1088   HG22  THR  26          HG22      THR  26   4.396   8.888  19.826
 1089   HG23  THR  26          HG23      THR  26   3.058   9.193  18.717
 1090    H    THR  27           H        THR  27   5.947   8.413  15.397
 1091    HA   THR  27           HA       THR  27   7.547  10.429  13.995
 1092    HB   THR  27           HB       THR  27   9.527   8.788  14.448
 1093    HG1  THR  27           HG1      THR  27   9.095   8.113  16.823
 1094   HG21  THR  27          HG21      THR  27   9.477  11.109  15.194
 1095   HG22  THR  27          HG22      THR  27  10.131  10.068  16.460
 1096   HG23  THR  27          HG23      THR  27   8.472  10.657  16.571
 1097    H    ALA  28           H        ALA  28   8.457   9.793  12.046
 1098    HA   ALA  28           HA       ALA  28   8.053   7.052  11.140
 1099    HB1  ALA  28           HB1      ALA  28   6.924   9.363   9.569
 1100    HB2  ALA  28           HB2      ALA  28   5.965   8.255  10.550
 1101    HB3  ALA  28           HB3      ALA  28   6.851   7.651   9.148
 1102    H    THR  29           H        THR  29   9.042   6.748   8.944
 1103    HA   THR  29           HA       THR  29  11.533   8.274   8.835
 1104    HB   THR  29           HB       THR  29  10.943   5.699   7.382
 1105    HG1  THR  29           HG1      THR  29  12.456   5.589   9.703
 1106   HG21  THR  29          HG21      THR  29  12.897   6.972   6.621
 1107   HG22  THR  29          HG22      THR  29  13.381   5.467   7.402
 1108   HG23  THR  29          HG23      THR  29  13.525   6.997   8.268
 1109    H    ASP  30           H        ASP  30  11.664   9.811   7.393
 1110    HA   ASP  30           HA       ASP  30   9.926  10.068   5.138
 1111    HB2  ASP  30           HB3      ASP  30  10.837  12.060   6.203
 1112    HB3  ASP  30           HB2      ASP  30  12.487  11.503   5.915
 1113    H    ILE  31           H        ILE  31  10.686  10.163   2.915
 1114    HA   ILE  31           HA       ILE  31  11.833   7.728   2.140
 1115    HB   ILE  31           HB       ILE  31  10.207   8.993   0.781
 1116   HG12  ILE  31          HG13      ILE  31  12.815   8.522  -0.685
 1117   HG13  ILE  31          HG12      ILE  31  11.646   7.271  -0.275
 1118   HG21  ILE  31          HG21      ILE  31  10.923  10.905  -0.560
 1119   HG22  ILE  31          HG22      ILE  31  12.505  10.862   0.218
 1120   HG23  ILE  31          HG23      ILE  31  11.067  11.240   1.166
 1121   HD11  ILE  31          HD11      ILE  31   9.986   8.371  -1.691
 1122   HD12  ILE  31          HD12      ILE  31  11.436   7.936  -2.594
 1123   HD13  ILE  31          HD13      ILE  31  11.168   9.610  -2.107
 1124    H    LYS  32           H        LYS  32  13.307  10.714   2.957
 1125    HA   LYS  32           HA       LYS  32  15.779  10.119   1.542
 1126    HB2  LYS  32           HB3      LYS  32  15.096  12.367   3.441
 1127    HB3  LYS  32           HB2      LYS  32  16.539  12.264   2.436
 1128    HG2  LYS  32           HG3      LYS  32  15.236  12.464   0.438
 1129    HG3  LYS  32           HG2      LYS  32  13.733  12.347   1.352
 1130    HD2  LYS  32           HD3      LYS  32  14.324  14.432   2.514
 1131    HD3  LYS  32           HD2      LYS  32  15.756  14.573   1.496
 1132    HE2  LYS  32           HE3      LYS  32  14.309  14.623  -0.491
 1133    HE3  LYS  32           HE2      LYS  32  12.897  14.519   0.555
 1134    HZ1  LYS  32           HZ1      LYS  32  13.539  16.633   1.554
 1135    HZ2  LYS  32           HZ2      LYS  32  13.310  16.791  -0.110
 1136    HZ3  LYS  32           HZ3      LYS  32  14.876  16.733   0.524
 1137    H    GLY  33           H        GLY  33  14.434   8.841   4.154
 1138    HA2  GLY  33           HA3      GLY  33  15.448   7.287   5.558
 1139    HA3  GLY  33           HA2      GLY  33  17.020   7.944   5.115
 1140    H    LYS  34           H        LYS  34  14.529  10.093   6.190
 1141    HA   LYS  34           HA       LYS  34  16.084  10.555   8.642
 1142    HB2  LYS  34           HB3      LYS  34  14.121  12.365   7.233
 1143    HB3  LYS  34           HB2      LYS  34  15.054  12.785   8.658
 1144    HG2  LYS  34           HG3      LYS  34  16.169  12.155   5.936
 1145    HG3  LYS  34           HG2      LYS  34  16.014  13.754   6.656
 1146    HD2  LYS  34           HD3      LYS  34  17.529  13.075   8.460
 1147    HD3  LYS  34           HD2      LYS  34  17.710  11.494   7.699
 1148    HE2  LYS  34           HE3      LYS  34  18.452  14.137   6.462
 1149    HE3  LYS  34           HE2      LYS  34  19.585  12.989   7.168
 1150    HZ1  LYS  34           HZ1      LYS  34  18.846  11.362   5.497
 1151    HZ2  LYS  34           HZ2      LYS  34  19.553  12.729   4.804
 1152    HZ3  LYS  34           HZ3      LYS  34  17.873  12.549   4.785
 1153    H    GLU  35           H        GLU  35  15.155  10.418  10.620
 1154    HA   GLU  35           HA       GLU  35  12.406   9.469  10.766
 1155    HB2  GLU  35           HB3      GLU  35  14.045   8.286  12.119
 1156    HB3  GLU  35           HB2      GLU  35  14.537   9.787  12.887
 1157    HG2  GLU  35           HG3      GLU  35  12.420   9.989  13.988
 1158    HG3  GLU  35           HG2      GLU  35  11.782   8.606  13.107
 1159    H    VAL  36           H        VAL  36  10.828  10.884  10.928
 1160    HA   VAL  36           HA       VAL  36  11.402  13.482  12.186
 1161    HB   VAL  36           HB       VAL  36   9.785  14.492  10.573
 1162   HG11  VAL  36          HG11      VAL  36  11.341  14.539   8.677
 1163   HG12  VAL  36          HG12      VAL  36  12.205  13.163   9.363
 1164   HG13  VAL  36          HG13      VAL  36  12.181  14.705  10.219
 1165   HG21  VAL  36          HG21      VAL  36   8.592  12.452   9.948
 1166   HG22  VAL  36          HG22      VAL  36  10.047  11.838   9.163
 1167   HG23  VAL  36          HG23      VAL  36   9.241  13.272   8.530
 1168    H    THR  37           H        THR  37   9.574  14.590  13.080
 1169    HA   THR  37           HA       THR  37   7.785  12.768  14.436
 1170    HB   THR  37           HB       THR  37   7.957  15.774  14.668
 1171    HG1  THR  37           HG1      THR  37   9.954  14.597  15.170
 1172   HG21  THR  37          HG21      THR  37   6.933  15.415  16.864
 1173   HG22  THR  37          HG22      THR  37   6.844  13.683  16.541
 1174   HG23  THR  37          HG23      THR  37   5.898  14.810  15.570
 1175    H    VAL  38           H        VAL  38   5.738  12.408  13.872
 1176    HA   VAL  38           HA       VAL  38   4.827  13.637  11.401
 1177    HB   VAL  38           HB       VAL  38   3.627  11.339  12.953
 1178   HG11  VAL  38          HG11      VAL  38   3.189  12.261  10.115
 1179   HG12  VAL  38          HG12      VAL  38   2.039  12.400  11.446
 1180   HG13  VAL  38          HG13      VAL  38   2.500  10.810  10.842
 1181   HG21  VAL  38          HG21      VAL  38   5.497  11.302  10.588
 1182   HG22  VAL  38          HG22      VAL  38   4.733   9.894  11.325
 1183   HG23  VAL  38          HG23      VAL  38   5.906  10.841  12.239
 1184    H    LEU  39           H        LEU  39   3.074  14.918  11.187
 1185    HA   LEU  39           HA       LEU  39   1.545  15.541  13.620
 1186    HB2  LEU  39           HB3      LEU  39   1.887  17.225  11.132
 1187    HB3  LEU  39           HB2      LEU  39   1.054  17.700  12.602
 1188    HG   LEU  39           HG       LEU  39   4.014  17.154  12.376
 1189   HD11  LEU  39          HD11      LEU  39   3.380  19.179  11.202
 1190   HD12  LEU  39          HD12      LEU  39   4.252  19.570  12.686
 1191   HD13  LEU  39          HD13      LEU  39   2.496  19.744  12.621
 1192   HD21  LEU  39          HD21      LEU  39   4.126  18.102  14.629
 1193   HD22  LEU  39          HD22      LEU  39   3.161  16.627  14.587
 1194   HD23  LEU  39          HD23      LEU  39   2.367  18.200  14.672
 1195    H    ALA  40           H        ALA  40  -0.379  14.606  13.643
 1196    HA   ALA  40           HA       ALA  40  -1.649  13.494  11.361
 1197    HB1  ALA  40           HB1      ALA  40  -3.518  13.048  12.864
 1198    HB2  ALA  40           HB2      ALA  40  -2.804  14.109  14.078
 1199    HB3  ALA  40           HB3      ALA  40  -1.986  12.615  13.622
 1200    H    GLU  41           H        GLU  41  -1.656  16.565  12.834
 1201    HA   GLU  41           HA       GLU  41  -3.880  17.473  11.159
 1202    HB2  GLU  41           HB3      GLU  41  -3.702  19.554  12.624
 1203    HB3  GLU  41           HB2      GLU  41  -4.295  18.098  13.407
 1204    HG2  GLU  41           HG3      GLU  41  -2.170  17.715  14.441
 1205    HG3  GLU  41           HG2      GLU  41  -1.443  19.046  13.539
 1206    H    VAL  42           H        VAL  42  -3.416  18.666   9.419
 1207    HA   VAL  42           HA       VAL  42  -0.631  19.376   9.011
 1208    HB   VAL  42           HB       VAL  42  -1.327  19.913   6.667
 1209   HG11  VAL  42          HG11      VAL  42  -1.982  17.157   7.697
 1210   HG12  VAL  42          HG12      VAL  42  -0.392  17.750   7.215
 1211   HG13  VAL  42          HG13      VAL  42  -1.667  17.566   6.011
 1212   HG21  VAL  42          HG21      VAL  42  -3.972  18.736   7.515
 1213   HG22  VAL  42          HG22      VAL  42  -3.502  19.176   5.873
 1214   HG23  VAL  42          HG23      VAL  42  -3.688  20.427   7.104
 1215    H    ASN  43           H        ASN  43  -0.186  21.148  10.120
 1216    HA   ASN  43           HA       ASN  43  -1.931  23.459  10.035
 1217    HB2  ASN  43           HB3      ASN  43   0.748  22.972  11.363
 1218    HB3  ASN  43           HB2      ASN  43  -0.094  24.515  11.427
 1219   HD21  ASN  43          HD21      ASN  43  -0.074  21.211  12.524
 1220   HD22  ASN  43          HD22      ASN  43  -1.265  21.405  13.765
 1221    H    ILE  44           H        ILE  44  -1.946  24.237   8.000
 1222    HA   ILE  44           HA       ILE  44   0.595  24.774   6.659
 1223    HB   ILE  44           HB       ILE  44  -2.213  25.261   5.633
 1224   HG12  ILE  44          HG13      ILE  44  -0.390  22.920   5.029
 1225   HG13  ILE  44          HG12      ILE  44  -1.738  22.851   6.161
 1226   HG21  ILE  44          HG21      ILE  44  -1.163  25.378   3.449
 1227   HG22  ILE  44          HG22      ILE  44   0.415  25.063   4.166
 1228   HG23  ILE  44          HG23      ILE  44  -0.436  26.562   4.534
 1229   HD11  ILE  44          HD11      ILE  44  -3.284  23.371   4.335
 1230   HD12  ILE  44          HD12      ILE  44  -2.358  21.906   4.018
 1231   HD13  ILE  44          HD13      ILE  44  -1.929  23.412   3.207
 1232    H    ASN  45           H        ASN  45  -2.414  26.623   6.922
 1233    HA   ASN  45           HA       ASN  45  -1.231  28.733   8.425
 1234    HB2  ASN  45           HB3      ASN  45  -0.323  29.286   6.183
 1235    HB3  ASN  45           HB2      ASN  45  -1.962  29.319   5.539
 1236   HD21  ASN  45          HD21      ASN  45  -0.966  30.587   8.685
 1237   HD22  ASN  45          HD22      ASN  45  -1.288  32.242   8.308
 1238    H    ASN  46           H        ASN  46  -2.919  28.509   9.796
 1239    HA   ASN  46           HA       ASN  46  -4.952  28.948  10.698
 1240    HB2  ASN  46           HB3      ASN  46  -5.081  30.982   9.330
 1241    HB3  ASN  46           HB2      ASN  46  -5.715  30.043   7.983
 1242   HD21  ASN  46          HD21      ASN  46  -7.845  29.414   7.991
 1243   HD22  ASN  46          HD22      ASN  46  -8.991  29.978   9.158
 1244    H    SER  47           H        SER  47  -5.168  27.578   7.435
 1245    HA   SER  47           HA       SER  47  -7.452  25.970   8.082
 1246    HB2  SER  47           HB3      SER  47  -5.547  25.700   5.740
 1247    HB3  SER  47           HB2      SER  47  -7.203  25.095   5.837
 1248    HG   SER  47           HG       SER  47  -7.945  27.222   5.875
 1249    H    VAL  48           H        VAL  48  -7.314  24.266   9.369
 1250    HA   VAL  48           HA       VAL  48  -5.026  22.436   9.112
 1251    HB   VAL  48           HB       VAL  48  -6.270  23.143  11.772
 1252   HG11  VAL  48          HG11      VAL  48  -4.296  22.037  12.699
 1253   HG12  VAL  48          HG12      VAL  48  -3.741  21.670  11.067
 1254   HG13  VAL  48          HG13      VAL  48  -5.236  20.957  11.671
 1255   HG21  VAL  48          HG21      VAL  48  -5.197  25.148  11.002
 1256   HG22  VAL  48          HG22      VAL  48  -3.746  24.251  10.563
 1257   HG23  VAL  48          HG23      VAL  48  -4.200  24.414  12.258
 1258    H    PHE  49           H        PHE  49  -5.623  20.283   9.134
 1259    HA   PHE  49           HA       PHE  49  -8.141  19.503  10.309
 1260    HB2  PHE  49           HB3      PHE  49  -9.063  18.461   8.297
 1261    HB3  PHE  49           HB2      PHE  49  -8.859  20.190   8.058
 1262    HD1  PHE  49           HD1      PHE  49  -7.157  21.038   6.510
 1263    HD2  PHE  49           HD2      PHE  49  -7.797  16.861   7.051
 1264    HE1  PHE  49           HE1      PHE  49  -5.911  20.577   4.437
 1265    HE2  PHE  49           HE2      PHE  49  -6.551  16.399   4.983
 1266    HZ   PHE  49           HZ       PHE  49  -5.609  18.255   3.673
 1267    H    ARG  50           H        ARG  50  -8.381  17.249  10.570
 1268    HA   ARG  50           HA       ARG  50  -5.917  15.693  10.115
 1269    HB2  ARG  50           HB3      ARG  50  -7.958  15.372  12.332
 1270    HB3  ARG  50           HB2      ARG  50  -6.583  14.314  12.065
 1271    HG2  ARG  50           HG3      ARG  50  -5.095  16.271  12.454
 1272    HG3  ARG  50           HG2      ARG  50  -6.525  17.202  12.895
 1273    HD2  ARG  50           HD3      ARG  50  -7.020  15.562  14.661
 1274    HD3  ARG  50           HD2      ARG  50  -5.550  14.687  14.241
 1275    HE   ARG  50           HE       ARG  50  -5.068  17.437  14.879
 1276   HH11  ARG  50          HH11      ARG  50  -5.531  14.246  16.229
 1277   HH12  ARG  50          HH12      ARG  50  -4.680  14.600  17.694
 1278   HH21  ARG  50          HH21      ARG  50  -3.939  17.918  16.798
 1279   HH22  ARG  50          HH22      ARG  50  -3.777  16.692  18.026
 1280    H    GLN  51           H        GLN  51  -6.116  13.852   8.974
 1281    HA   GLN  51           HA       GLN  51  -8.824  12.759   8.580
 1282    HB2  GLN  51           HB3      GLN  51  -7.861  13.729   6.503
 1283    HB3  GLN  51           HB2      GLN  51  -6.497  12.630   6.644
 1284    HG2  GLN  51           HG3      GLN  51  -8.133  11.864   5.002
 1285    HG3  GLN  51           HG2      GLN  51  -7.958  10.725   6.336
 1286   HE21  GLN  51          HE21      GLN  51  -9.969   9.807   5.952
 1287   HE22  GLN  51          HE22      GLN  51 -11.446  10.622   6.334
 1288    H    TYR  52           H        TYR  52  -5.999  12.369  10.093
 1289    HA   TYR  52           HA       TYR  52  -5.017  10.698  11.271
 1290    HB2  TYR  52           HB3      TYR  52  -7.281   8.948  10.267
 1291    HB3  TYR  52           HB2      TYR  52  -6.169   8.548  11.569
 1292    HD1  TYR  52           HD1      TYR  52  -6.392  11.688  12.450
 1293    HD2  TYR  52           HD2      TYR  52  -9.091   8.446  11.912
 1294    HE1  TYR  52           HE1      TYR  52  -7.933  12.709  14.065
 1295    HE2  TYR  52           HE2      TYR  52 -10.640   9.463  13.528
 1296    HH   TYR  52           HH       TYR  52 -10.328  12.667  14.601
 1297    H    PHE  53           H        PHE  53  -4.103   8.351  10.903
 1298    HA   PHE  53           HA       PHE  53  -3.212   8.233   8.093
 1299    HB2  PHE  53           HB3      PHE  53  -1.655   7.487  10.582
 1300    HB3  PHE  53           HB2      PHE  53  -1.075   7.306   8.928
 1301    HD1  PHE  53           HD1      PHE  53  -0.809   9.371   7.514
 1302    HD2  PHE  53           HD2      PHE  53  -1.461   9.518  11.714
 1303    HE1  PHE  53           HE1      PHE  53   0.020  11.685   7.554
 1304    HE2  PHE  53           HE2      PHE  53  -0.631  11.830  11.766
 1305    HZ   PHE  53           HZ       PHE  53   0.105  12.920   9.684
 1306    H    PHE  54           H        PHE  54  -3.568   6.440   7.017
 1307    HA   PHE  54           HA       PHE  54  -4.926   4.262   8.335
 1308    HB2  PHE  54           HB3      PHE  54  -5.095   3.394   5.927
 1309    HB3  PHE  54           HB2      PHE  54  -5.934   4.896   6.293
 1310    HD1  PHE  54           HD1      PHE  54  -5.016   7.053   5.491
 1311    HD2  PHE  54           HD2      PHE  54  -3.303   3.325   4.356
 1312    HE1  PHE  54           HE1      PHE  54  -3.845   8.162   3.637
 1313    HE2  PHE  54           HE2      PHE  54  -2.126   4.428   2.500
 1314    HZ   PHE  54           HZ       PHE  54  -2.391   6.846   2.137
 1315    H    GLU  55           H        GLU  55  -3.741   2.773   9.315
 1316    HA   GLU  55           HA       GLU  55  -1.419   1.686   7.856
 1317    HB2  GLU  55           HB3      GLU  55  -1.667   1.777  10.870
 1318    HB3  GLU  55           HB2      GLU  55  -0.257   1.319   9.927
 1319    HG2  GLU  55           HG3      GLU  55  -0.218   3.690   9.054
 1320    HG3  GLU  55           HG2      GLU  55  -1.439   4.066  10.270
 1321    H    THR  56           H        THR  56  -1.828  -0.312   7.216
 1322    HA   THR  56           HA       THR  56  -3.766  -1.924   8.717
 1323    HB   THR  56           HB       THR  56  -2.650  -2.420   5.952
 1324    HG1  THR  56           HG1      THR  56  -4.045  -0.909   5.453
 1325   HG21  THR  56          HG21      THR  56  -4.937  -3.728   7.432
 1326   HG22  THR  56          HG22      THR  56  -3.374  -4.466   7.080
 1327   HG23  THR  56          HG23      THR  56  -4.472  -4.052   5.763
 1328    H    LYS  57           H        LYS  57  -2.919  -3.218  10.161
 1329    HA   LYS  57           HA       LYS  57  -0.123  -4.053   9.830
 1330    HB2  LYS  57           HB3      LYS  57  -1.798  -4.037  12.346
 1331    HB3  LYS  57           HB2      LYS  57  -0.059  -4.266  12.234
 1332    HG2  LYS  57           HG3      LYS  57   0.052  -1.940  11.247
 1333    HG3  LYS  57           HG2      LYS  57  -1.628  -1.752  11.748
 1334    HD2  LYS  57           HD3      LYS  57  -0.285  -0.824  13.469
 1335    HD3  LYS  57           HD2      LYS  57  -0.880  -2.376  14.069
 1336    HE2  LYS  57           HE3      LYS  57   1.473  -2.102  14.598
 1337    HE3  LYS  57           HE2      LYS  57   1.244  -3.418  13.450
 1338    HZ1  LYS  57           HZ1      LYS  57   2.272  -0.696  12.904
 1339    HZ2  LYS  57           HZ2      LYS  57   1.781  -1.740  11.669
 1340    HZ3  LYS  57           HZ3      LYS  57   3.070  -2.170  12.680
 1341    H    CYS  58           H        CYS  58   0.485  -6.180  10.469
 1342    HA   CYS  58           HA       CYS  58  -1.390  -8.154   9.536
 1343    HB2  CYS  58           HB3      CYS  58   1.434  -8.447  10.587
 1344    HB3  CYS  58           HB2      CYS  58   0.497  -9.738   9.847
 1345    H    ARG  59           H        ARG  59  -2.769  -9.232  10.751
 1346    HA   ARG  59           HA       ARG  59  -2.508  -9.300  13.641
 1347    HB2  ARG  59           HB3      ARG  59  -4.542 -10.460  11.730
 1348    HB3  ARG  59           HB2      ARG  59  -4.603 -10.721  13.465
 1349    HG2  ARG  59           HG3      ARG  59  -4.901  -8.349  13.843
 1350    HG3  ARG  59           HG2      ARG  59  -4.742  -8.034  12.115
 1351    HD2  ARG  59           HD3      ARG  59  -6.743  -9.270  11.646
 1352    HD3  ARG  59           HD2      ARG  59  -6.867  -9.795  13.322
 1353    HE   ARG  59           HE       ARG  59  -7.069  -7.243  13.729
 1354   HH11  ARG  59          HH11      ARG  59  -8.388  -9.015  11.008
 1355   HH12  ARG  59          HH12      ARG  59  -9.731  -7.942  10.801
 1356   HH21  ARG  59          HH21      ARG  59  -8.863  -5.848  13.470
 1357   HH22  ARG  59          HH22      ARG  59 -10.004  -6.146  12.202
 1358    H    ALA  60           H        ALA  60  -0.840 -10.577  14.236
 1359    HA   ALA  60           HA       ALA  60   0.416 -12.435  14.616
 1360    HB1  ALA  60           HB1      ALA  60  -1.726 -13.498  15.181
 1361    HB2  ALA  60           HB2      ALA  60  -0.619 -14.636  14.414
 1362    HB3  ALA  60           HB3      ALA  60  -1.948 -13.941  13.489
 1363    H    SER  61           H        SER  61   0.797 -14.777  13.132
 1364    HA   SER  61           HA       SER  61   1.130 -14.077  10.361
 1365    HB2  SER  61           HB3      SER  61   3.659 -14.483  10.512
 1366    HB3  SER  61           HB2      SER  61   3.061 -12.927  11.085
 1367    HG   SER  61           HG       SER  61   3.057 -14.800  13.056
 1368    H    ASN  62           H        ASN  62   1.302 -15.821   9.079
 1369    HA   ASN  62           HA       ASN  62   1.384 -17.972   8.367
 1370    HB2  ASN  62           HB3      ASN  62   3.113 -18.260  10.824
 1371    HB3  ASN  62           HB2      ASN  62   2.807 -19.592   9.715
 1372   HD21  ASN  62          HD21      ASN  62   2.789 -17.935   7.344
 1373   HD22  ASN  62          HD22      ASN  62   4.437 -17.491   7.047
 1374    HA   PRO  63           HA       PRO  63  -2.124 -19.155  11.196
 1375    HB2  PRO  63           HB3      PRO  63  -3.876 -19.533   9.113
 1376    HB3  PRO  63           HB2      PRO  63  -3.711 -18.010   9.996
 1377    HG2  PRO  63           HG3      PRO  63  -2.549 -18.827   7.365
 1378    HG3  PRO  63           HG2      PRO  63  -3.244 -17.270   7.845
 1379    HD2  PRO  63           HD3      PRO  63  -0.572 -17.664   7.709
 1380    HD3  PRO  63           HD2      PRO  63  -1.305 -16.591   8.927
 1381    H    VAL  64           H        VAL  64  -0.590 -20.431   8.359
 1382    HA   VAL  64           HA       VAL  64  -1.234 -23.159   9.248
 1383    HB   VAL  64           HB       VAL  64  -1.229 -23.905   6.900
 1384   HG11  VAL  64          HG11      VAL  64  -3.386 -22.946   6.224
 1385   HG12  VAL  64          HG12      VAL  64  -3.209 -21.700   7.456
 1386   HG13  VAL  64          HG13      VAL  64  -3.365 -23.392   7.928
 1387   HG21  VAL  64          HG21      VAL  64  -1.324 -22.289   5.076
 1388   HG22  VAL  64          HG22      VAL  64   0.192 -22.155   5.964
 1389   HG23  VAL  64          HG23      VAL  64  -1.088 -20.971   6.223
 1390    H    GLU  65           H        GLU  65   0.414 -24.757   8.602
 1391    HA   GLU  65           HA       GLU  65   3.055 -23.631   8.974
 1392    HB2  GLU  65           HB3      GLU  65   2.009 -25.797  10.043
 1393    HB3  GLU  65           HB2      GLU  65   2.552 -26.556   8.555
 1394    HG2  GLU  65           HG3      GLU  65   4.336 -25.024  10.433
 1395    HG3  GLU  65           HG2      GLU  65   4.131 -26.771  10.455
 1396    H    SER  66           H        SER  66   3.159 -22.554   6.980
 1397    HA   SER  66           HA       SER  66   4.762 -23.702   5.059
 1398    HB2  SER  66           HB3      SER  66   2.625 -24.991   4.486
 1399    HB3  SER  66           HB2      SER  66   1.940 -23.448   3.973
 1400    HG   SER  66           HG       SER  66   4.412 -23.927   2.900
 1401    H    GLY  67           H        GLY  67   2.179 -21.438   5.752
 1402    HA2  GLY  67           HA3      GLY  67   3.613 -19.126   5.537
 1403    HA3  GLY  67           HA2      GLY  67   3.073 -19.462   3.895
 1404    H    CYS  68           H        CYS  68   0.961 -19.176   3.351
 1405    HA   CYS  68           HA       CYS  68  -0.838 -18.202   5.465
 1406    HB2  CYS  68           HB3      CYS  68  -0.642 -17.172   2.618
 1407    HB3  CYS  68           HB2      CYS  68  -1.786 -16.609   3.841
 1408    H    ARG  69           H        ARG  69  -3.200 -18.298   4.666
 1409    HA   ARG  69           HA       ARG  69  -3.788 -21.006   4.160
 1410    HB2  ARG  69           HB3      ARG  69  -5.631 -18.619   3.858
 1411    HB3  ARG  69           HB2      ARG  69  -6.128 -20.298   4.030
 1412    HG2  ARG  69           HG3      ARG  69  -5.060 -20.317   6.281
 1413    HG3  ARG  69           HG2      ARG  69  -4.748 -18.590   6.088
 1414    HD2  ARG  69           HD3      ARG  69  -6.755 -18.868   7.378
 1415    HD3  ARG  69           HD2      ARG  69  -7.185 -18.232   5.787
 1416    HE   ARG  69           HE       ARG  69  -7.320 -21.096   5.924
 1417   HH11  ARG  69          HH11      ARG  69  -9.063 -18.129   6.565
 1418   HH12  ARG  69          HH12      ARG  69 -10.623 -18.884   6.510
 1419   HH21  ARG  69          HH21      ARG  69  -9.381 -22.088   5.826
 1420   HH22  ARG  69          HH22      ARG  69 -10.803 -21.125   6.079
 1421    H    GLY  70           H        GLY  70  -3.785 -22.102   2.331
 1422    HA2  GLY  70           HA3      GLY  70  -4.571 -22.309   0.026
 1423    HA3  GLY  70           HA2      GLY  70  -4.122 -20.619  -0.204
 1424    H    ILE  71           H        ILE  71  -1.636 -20.866   1.275
 1425    HA   ILE  71           HA       ILE  71   0.034 -21.802  -0.877
 1426    HB   ILE  71           HB       ILE  71   0.855 -20.813   1.860
 1427   HG12  ILE  71          HG13      ILE  71  -0.477 -19.138   0.578
 1428   HG13  ILE  71          HG12      ILE  71   1.182 -18.631   0.871
 1429   HG21  ILE  71          HG21      ILE  71   3.021 -20.353   0.782
 1430   HG22  ILE  71          HG22      ILE  71   2.426 -21.104  -0.699
 1431   HG23  ILE  71          HG23      ILE  71   2.610 -22.068   0.765
 1432   HD11  ILE  71          HD11      ILE  71   0.453 -18.070  -1.379
 1433   HD12  ILE  71          HD12      ILE  71   0.120 -19.772  -1.703
 1434   HD13  ILE  71          HD13      ILE  71   1.775 -19.237  -1.411
 1435    H    ASP  72           H        ASP  72   0.813 -23.795  -1.064
 1436    HA   ASP  72           HA       ASP  72   1.629 -25.245   1.323
 1437    HB2  ASP  72           HB3      ASP  72  -0.712 -26.001   0.842
 1438    HB3  ASP  72           HB2      ASP  72  -0.166 -26.550  -0.741
 1439    H    SER  73           H        SER  73   3.710 -24.774   0.544
 1440    HA   SER  73           HA       SER  73   4.584 -26.470  -1.653
 1441    HB2  SER  73           HB3      SER  73   4.051 -24.308  -2.710
 1442    HB3  SER  73           HB2      SER  73   5.104 -23.484  -1.556
 1443    HG   SER  73           HG       SER  73   5.801 -24.402  -3.866
 1444    H    LYS  74           H        LYS  74   6.732 -27.070  -1.519
 1445    HA   LYS  74           HA       LYS  74   8.112 -26.395   0.964
 1446    HB2  LYS  74           HB3      LYS  74   7.831 -28.783   0.250
 1447    HB3  LYS  74           HB2      LYS  74   8.833 -28.439  -1.151
 1448    HG2  LYS  74           HG3      LYS  74  10.679 -27.827   0.387
 1449    HG3  LYS  74           HG2      LYS  74   9.667 -28.339   1.739
 1450    HD2  LYS  74           HD3      LYS  74  10.537 -30.077  -0.561
 1451    HD3  LYS  74           HD2      LYS  74  11.232 -30.096   1.058
 1452    HE2  LYS  74           HE3      LYS  74   9.004 -30.713   1.948
 1453    HE3  LYS  74           HE2      LYS  74   8.404 -30.793   0.295
 1454    HZ1  LYS  74           HZ1      LYS  74   9.009 -32.973   1.154
 1455    HZ2  LYS  74           HZ2      LYS  74  10.600 -32.455   1.392
 1456    HZ3  LYS  74           HZ3      LYS  74   9.966 -32.548  -0.172
 1457    H    HIS  75           H        HIS  75   7.956 -25.471  -2.242
 1458    HA   HIS  75           HA       HIS  75  10.755 -24.732  -2.538
 1459    HB2  HIS  75           HB3      HIS  75   8.347 -24.275  -4.325
 1460    HB3  HIS  75           HB2      HIS  75   9.978 -23.745  -4.717
 1461    HD1  HIS  75           HD1      HIS  75  11.373 -25.363  -5.987
 1462    HD2  HIS  75           HD2      HIS  75   8.161 -27.206  -4.103
 1463    HE1  HIS  75           HE1      HIS  75  11.396 -27.747  -6.788
 1464    HE2  HIS  75           HE2      HIS  75   9.524 -28.873  -5.535
 1465    H    TRP  76           H        TRP  76   7.719 -23.359  -1.635
 1466    HA   TRP  76           HA       TRP  76   8.951 -20.692  -1.480
 1467    HB2  TRP  76           HB3      TRP  76   6.050 -21.462  -1.880
 1468    HB3  TRP  76           HB2      TRP  76   6.596 -19.821  -1.550
 1469    HD1  TRP  76           HD1      TRP  76   5.844 -22.091  -4.341
 1470    HE1  TRP  76           HE1      TRP  76   6.651 -21.086  -6.567
 1471    HE3  TRP  76           HE3      TRP  76   8.822 -18.361  -2.512
 1472    HZ2  TRP  76           HZ2      TRP  76   8.325 -18.987  -7.432
 1473    HZ3  TRP  76           HZ3      TRP  76   9.987 -16.897  -4.107
 1474    HH2  TRP  76           HH2      TRP  76   9.745 -17.207  -6.515
 1475    H    ASN  77           H        ASN  77   9.005 -19.709   0.451
 1476    HA   ASN  77           HA       ASN  77   7.215 -20.758   2.552
 1477    HB2  ASN  77           HB3      ASN  77   9.595 -20.988   3.176
 1478    HB3  ASN  77           HB2      ASN  77   9.836 -19.268   2.900
 1479   HD21  ASN  77          HD21      ASN  77   9.174 -17.807   4.438
 1480   HD22  ASN  77          HD22      ASN  77   8.578 -18.277   5.995
 1481    H    SER  78           H        SER  78   5.768 -19.329   3.412
 1482    HA   SER  78           HA       SER  78   5.930 -16.599   2.327
 1483    HB2  SER  78           HB3      SER  78   3.310 -17.932   2.946
 1484    HB3  SER  78           HB2      SER  78   3.643 -16.592   1.856
 1485    HG   SER  78           HG       SER  78   4.816 -18.133   0.549
 1486    H    TYR  79           H        TYR  79   5.201 -14.914   3.611
 1487    HA   TYR  79           HA       TYR  79   4.143 -15.435   6.225
 1488    HB2  TYR  79           HB3      TYR  79   5.951 -14.083   7.378
 1489    HB3  TYR  79           HB2      TYR  79   6.415 -15.703   6.865
 1490    HD1  TYR  79           HD1      TYR  79   7.031 -12.134   6.471
 1491    HD2  TYR  79           HD2      TYR  79   7.921 -16.003   4.933
 1492    HE1  TYR  79           HE1      TYR  79   8.998 -11.220   5.307
 1493    HE2  TYR  79           HE2      TYR  79   9.880 -15.094   3.763
 1494    HH   TYR  79           HH       TYR  79  11.093 -11.936   4.376
 1495    H    CYS  80           H        CYS  80   3.689 -13.382   7.383
 1496    HA   CYS  80           HA       CYS  80   2.357 -11.679   5.463
 1497    HB2  CYS  80           HB3      CYS  80   2.246 -11.479   8.479
 1498    HB3  CYS  80           HB2      CYS  80   1.041 -10.931   7.309
 1499    H    THR  81           H        THR  81   3.305  -9.925   4.705
 1500    HA   THR  81           HA       THR  81   5.108  -8.413   6.471
 1501    HB   THR  81           HB       THR  81   5.437  -8.860   3.493
 1502    HG1  THR  81           HG1      THR  81   6.236 -10.276   5.627
 1503   HG21  THR  81          HG21      THR  81   6.186  -6.627   4.195
 1504   HG22  THR  81          HG22      THR  81   7.543  -7.652   3.729
 1505   HG23  THR  81          HG23      THR  81   7.204  -7.363   5.434
 1506    H    THR  82           H        THR  82   4.678  -6.285   6.625
 1507    HA   THR  82           HA       THR  82   2.359  -5.269   5.274
 1508    HB   THR  82           HB       THR  82   3.073  -3.138   6.575
 1509    HG1  THR  82           HG1      THR  82   4.270  -4.370   8.545
 1510   HG21  THR  82          HG21      THR  82   2.017  -4.004   8.610
 1511   HG22  THR  82          HG22      THR  82   2.249  -5.653   8.032
 1512   HG23  THR  82          HG23      THR  82   1.167  -4.559   7.168
 1513    H    THR  83           H        THR  83   2.300  -4.003   3.530
 1514    HA   THR  83           HA       THR  83   4.725  -3.346   2.150
 1515    HB   THR  83           HB       THR  83   3.102  -2.113   0.599
 1516    HG1  THR  83           HG1      THR  83   0.979  -2.274   1.006
 1517   HG21  THR  83          HG21      THR  83   2.662  -5.058   1.111
 1518   HG22  THR  83          HG22      THR  83   3.929  -4.358   0.104
 1519   HG23  THR  83          HG23      THR  83   2.237  -4.199  -0.369
 1520    H    HIS  84           H        HIS  84   5.880  -1.549   2.369
 1521    HA   HIS  84           HA       HIS  84   4.738   0.592   4.033
 1522    HB2  HIS  84           HB3      HIS  84   7.662   0.010   3.476
 1523    HB3  HIS  84           HB2      HIS  84   7.028   1.182   4.627
 1524    HD1  HIS  84           HD1      HIS  84   8.386  -2.103   4.514
 1525    HD2  HIS  84           HD2      HIS  84   5.340  -0.294   6.690
 1526    HE1  HIS  84           HE1      HIS  84   8.018  -3.576   6.512
 1527    HE2  HIS  84           HE2      HIS  84   6.032  -2.579   7.691
 1528    H    THR  85           H        THR  85   4.107   2.331   2.953
 1529    HA   THR  85           HA       THR  85   5.588   3.029   0.492
 1530    HB   THR  85           HB       THR  85   3.182   2.252   0.150
 1531    HG1  THR  85           HG1      THR  85   2.779   4.082  -1.300
 1532   HG21  THR  85          HG21      THR  85   1.412   3.877   0.616
 1533   HG22  THR  85          HG22      THR  85   2.580   4.941   1.399
 1534   HG23  THR  85          HG23      THR  85   2.200   3.372   2.110
 1535    H    PHE  86           H        PHE  86   5.438   5.402  -0.037
 1536    HA   PHE  86           HA       PHE  86   5.926   6.871   2.458
 1537    HB2  PHE  86           HB3      PHE  86   6.873   7.498  -0.358
 1538    HB3  PHE  86           HB2      PHE  86   7.292   8.406   1.096
 1539    HD1  PHE  86           HD1      PHE  86   8.681   7.313   2.861
 1540    HD2  PHE  86           HD2      PHE  86   8.041   5.545  -0.957
 1541    HE1  PHE  86           HE1      PHE  86  10.622   5.845   3.220
 1542    HE2  PHE  86           HE2      PHE  86   9.980   4.073  -0.606
 1543    HZ   PHE  86           HZ       PHE  86  11.275   4.220   1.483
 1544    H    VAL  87           H        VAL  87   4.405   8.220   3.078
 1545    HA   VAL  87           HA       VAL  87   2.593   9.324   1.040
 1546    HB   VAL  87           HB       VAL  87   0.978   9.665   2.912
 1547   HG11  VAL  87          HG11      VAL  87   1.916   6.839   2.460
 1548   HG12  VAL  87          HG12      VAL  87   0.770   7.737   1.465
 1549   HG13  VAL  87          HG13      VAL  87   0.346   7.299   3.119
 1550   HG21  VAL  87          HG21      VAL  87   2.928   8.001   4.500
 1551   HG22  VAL  87          HG22      VAL  87   1.319   8.501   5.023
 1552   HG23  VAL  87          HG23      VAL  87   2.579   9.709   4.766
 1553    H    LYS  88           H        LYS  88   2.154  11.474   0.983
 1554    HA   LYS  88           HA       LYS  88   4.128  13.218   2.111
 1555    HB2  LYS  88           HB3      LYS  88   2.829  15.007   0.888
 1556    HB3  LYS  88           HB2      LYS  88   3.464  13.714  -0.116
 1557    HG2  LYS  88           HG3      LYS  88   1.229  12.675  -0.142
 1558    HG3  LYS  88           HG2      LYS  88   0.615  14.022   0.810
 1559    HD2  LYS  88           HD3      LYS  88   1.205  15.571  -0.957
 1560    HD3  LYS  88           HD2      LYS  88   1.892  14.254  -1.909
 1561    HE2  LYS  88           HE3      LYS  88  -0.341  13.185  -1.954
 1562    HE3  LYS  88           HE2      LYS  88  -0.992  14.582  -1.099
 1563    HZ1  LYS  88           HZ1      LYS  88   0.293  14.646  -3.776
 1564    HZ2  LYS  88           HZ2      LYS  88  -0.344  15.980  -2.956
 1565    HZ3  LYS  88           HZ3      LYS  88  -1.368  14.740  -3.476
 1566    H    ALA  89           H        ALA  89   3.996  13.617   4.186
 1567    HA   ALA  89           HA       ALA  89   1.452  14.653   5.251
 1568    HB1  ALA  89           HB1      ALA  89   3.366  12.841   6.728
 1569    HB2  ALA  89           HB2      ALA  89   1.811  12.350   6.056
 1570    HB3  ALA  89           HB3      ALA  89   1.873  13.529   7.367
 1571    H    LEU  90           H        LEU  90   1.644  16.339   6.737
 1572    HA   LEU  90           HA       LEU  90   4.057  17.854   6.663
 1573    HB2  LEU  90           HB3      LEU  90   1.754  18.846   6.895
 1574    HB3  LEU  90           HB2      LEU  90   1.702  18.198   8.529
 1575    HG   LEU  90           HG       LEU  90   3.856  19.571   8.928
 1576   HD11  LEU  90          HD11      LEU  90   4.023  21.586   7.534
 1577   HD12  LEU  90          HD12      LEU  90   2.793  20.924   6.455
 1578   HD13  LEU  90          HD13      LEU  90   4.349  20.109   6.625
 1579   HD21  LEU  90          HD21      LEU  90   2.554  21.555   9.484
 1580   HD22  LEU  90          HD22      LEU  90   1.697  20.083   9.940
 1581   HD23  LEU  90          HD23      LEU  90   1.220  20.966   8.490
 1582    H    THR  91           H        THR  91   5.790  17.451   7.839
 1583    HA   THR  91           HA       THR  91   5.446  16.161  10.461
 1584    HB   THR  91           HB       THR  91   7.556  14.930  10.064
 1585    HG1  THR  91           HG1      THR  91   7.297  16.043   7.453
 1586   HG21  THR  91          HG21      THR  91   5.452  13.787   9.602
 1587   HG22  THR  91          HG22      THR  91   6.684  13.292   8.443
 1588   HG23  THR  91          HG23      THR  91   5.436  14.443   7.966
 1589    H    THR  92           H        THR  92   7.192  16.620  11.977
 1590    HA   THR  92           HA       THR  92   8.631  19.078  11.262
 1591    HB   THR  92           HB       THR  92   6.855  19.580  12.878
 1592    HG1  THR  92           HG1      THR  92   9.061  20.569  12.932
 1593   HG21  THR  92          HG21      THR  92   6.930  18.733  15.157
 1594   HG22  THR  92          HG22      THR  92   8.313  17.717  14.753
 1595   HG23  THR  92          HG23      THR  92   6.741  17.403  14.014
 1596    H    ASP  93           H        ASP  93  10.700  18.864  11.193
 1597    HA   ASP  93           HA       ASP  93  12.077  16.546  12.078
 1598    HB2  ASP  93           HB3      ASP  93  13.042  17.600  10.218
 1599    HB3  ASP  93           HB2      ASP  93  12.924  19.198  10.945
 1600    H    GLU  94           H        GLU  94  11.872  19.865  13.301
 1601    HA   GLU  94           HA       GLU  94  12.162  18.964  15.989
 1602    HB2  GLU  94           HB3      GLU  94  14.526  18.915  15.291
 1603    HB3  GLU  94           HB2      GLU  94  14.421  20.604  14.823
 1604    HG2  GLU  94           HG3      GLU  94  13.919  21.192  17.153
 1605    HG3  GLU  94           HG2      GLU  94  14.129  19.502  17.603
 1606    H    LYS  95           H        LYS  95  13.054  21.981  14.298
 1607    HA   LYS  95           HA       LYS  95  11.194  23.410  16.051
 1608    HB2  LYS  95           HB3      LYS  95  13.366  24.489  14.247
 1609    HB3  LYS  95           HB2      LYS  95  12.385  25.440  15.348
 1610    HG2  LYS  95           HG3      LYS  95  13.341  24.088  17.224
 1611    HG3  LYS  95           HG2      LYS  95  14.440  23.358  16.054
 1612    HD2  LYS  95           HD3      LYS  95  15.301  25.584  15.495
 1613    HD3  LYS  95           HD2      LYS  95  14.210  26.297  16.681
 1614    HE2  LYS  95           HE3      LYS  95  16.337  26.147  17.713
 1615    HE3  LYS  95           HE2      LYS  95  15.334  24.883  18.419
 1616    HZ1  LYS  95           HZ1      LYS  95  17.603  24.151  17.857
 1617    HZ2  LYS  95           HZ2      LYS  95  17.278  24.438  16.223
 1618    HZ3  LYS  95           HZ3      LYS  95  16.412  23.248  17.061
 1619    H    GLN  96           H        GLN  96  11.767  22.621  12.707
 1620    HA   GLN  96           HA       GLN  96   9.572  24.406  11.903
 1621    HB2  GLN  96           HB3      GLN  96  11.806  23.180  10.279
 1622    HB3  GLN  96           HB2      GLN  96  10.493  24.123   9.594
 1623    HG2  GLN  96           HG3      GLN  96  12.477  25.137  11.617
 1624    HG3  GLN  96           HG2      GLN  96  12.565  25.413   9.879
 1625   HE21  GLN  96          HE21      GLN  96  10.970  26.257  12.837
 1626   HE22  GLN  96          HE22      GLN  96  10.084  27.600  12.212
 1627    H    ALA  97           H        ALA  97   7.947  23.662  10.535
 1628    HA   ALA  97           HA       ALA  97   7.681  20.733  10.347
 1629    HB1  ALA  97           HB1      ALA  97   5.480  22.797  10.449
 1630    HB2  ALA  97           HB2      ALA  97   5.974  21.760  11.787
 1631    HB3  ALA  97           HB3      ALA  97   5.263  21.051  10.335
 1632    H    ALA  98           H        ALA  98   7.327  19.858   8.352
 1633    HA   ALA  98           HA       ALA  98   6.663  21.562   6.101
 1634    HB1  ALA  98           HB1      ALA  98   9.304  20.103   6.219
 1635    HB2  ALA  98           HB2      ALA  98   9.087  21.851   6.299
 1636    HB3  ALA  98           HB3      ALA  98   8.666  20.977   4.826
 1637    H    TRP  99           H        TRP  99   6.279  20.320   4.141
 1638    HA   TRP  99           HA       TRP  99   4.987  17.831   4.721
 1639    HB2  TRP  99           HB3      TRP  99   5.465  19.293   2.116
 1640    HB3  TRP  99           HB2      TRP  99   4.547  17.799   2.238
 1641    HD1  TRP  99           HD1      TRP  99   4.335  21.515   3.166
 1642    HE1  TRP  99           HE1      TRP  99   1.880  22.091   3.668
 1643    HE3  TRP  99           HE3      TRP  99   2.352  16.810   3.005
 1644    HZ2  TRP  99           HZ2      TRP  99  -0.575  20.732   3.954
 1645    HZ3  TRP  99           HZ3      TRP  99  -0.064  16.534   3.402
 1646    HH2  TRP  99           HH2      TRP  99  -1.494  18.457   3.868
 1647    H    ARG 100           H        ARG 100   6.016  15.988   4.929
 1648    HA   ARG 100           HA       ARG 100   8.289  15.442   3.142
 1649    HB2  ARG 100           HB3      ARG 100   7.934  14.616   6.033
 1650    HB3  ARG 100           HB2      ARG 100   9.176  13.959   4.976
 1651    HG2  ARG 100           HG3      ARG 100   8.883  16.845   5.785
 1652    HG3  ARG 100           HG2      ARG 100  10.069  15.701   6.408
 1653    HD2  ARG 100           HD3      ARG 100  11.063  15.484   4.206
 1654    HD3  ARG 100           HD2      ARG 100   9.832  16.543   3.522
 1655    HE   ARG 100           HE       ARG 100  12.012  17.348   5.315
 1656   HH11  ARG 100          HH11      ARG 100   9.381  18.198   3.163
 1657   HH12  ARG 100          HH12      ARG 100   9.883  19.849   3.001
 1658   HH21  ARG 100          HH21      ARG 100  12.670  19.530   5.108
 1659   HH22  ARG 100          HH22      ARG 100  11.757  20.610   4.104
 1660    H    PHE 101           H        PHE 101   8.692  12.932   3.190
 1661    HA   PHE 101           HA       PHE 101   6.052  11.738   2.619
 1662    HB2  PHE 101           HB3      PHE 101   8.577  11.126   1.075
 1663    HB3  PHE 101           HB2      PHE 101   6.910  10.768   0.625
 1664    HD1  PHE 101           HD1      PHE 101   9.598  13.075   0.323
 1665    HD2  PHE 101           HD2      PHE 101   5.355  12.767   0.221
 1666    HE1  PHE 101           HE1      PHE 101   9.473  15.223  -0.862
 1667    HE2  PHE 101           HE2      PHE 101   5.224  14.912  -0.974
 1668    HZ   PHE 101           HZ       PHE 101   7.285  16.144  -1.515
 1669    H    ILE 102           H        ILE 102   5.715  10.247   4.138
 1670    HA   ILE 102           HA       ILE 102   8.098   8.941   5.283
 1671    HB   ILE 102           HB       ILE 102   6.729   8.681   7.360
 1672   HG12  ILE 102          HG13      ILE 102   4.873  10.647   6.007
 1673   HG13  ILE 102          HG12      ILE 102   4.511   8.943   6.247
 1674   HG21  ILE 102          HG21      ILE 102   8.386  10.428   7.199
 1675   HG22  ILE 102          HG22      ILE 102   6.975  11.027   8.072
 1676   HG23  ILE 102          HG23      ILE 102   7.232  11.488   6.389
 1677   HD11  ILE 102          HD11      ILE 102   4.941  11.000   8.399
 1678   HD12  ILE 102          HD12      ILE 102   4.647   9.283   8.675
 1679   HD13  ILE 102          HD13      ILE 102   3.404  10.280   7.917
 1680    H    ARG 103           H        ARG 103   8.086   6.792   5.732
 1681    HA   ARG 103           HA       ARG 103   6.303   5.245   4.093
 1682    HB2  ARG 103           HB3      ARG 103   7.701   3.298   4.834
 1683    HB3  ARG 103           HB2      ARG 103   8.601   4.589   4.054
 1684    HG2  ARG 103           HG3      ARG 103   9.979   4.047   5.801
 1685    HG3  ARG 103           HG2      ARG 103   9.062   5.380   6.489
 1686    HD2  ARG 103           HD3      ARG 103   7.495   3.590   7.423
 1687    HD3  ARG 103           HD2      ARG 103   8.760   2.434   7.006
 1688    HE   ARG 103           HE       ARG 103  10.230   3.902   8.472
 1689   HH11  ARG 103          HH11      ARG 103   6.787   3.502   8.983
 1690   HH12  ARG 103          HH12      ARG 103   6.876   3.818  10.687
 1691   HH21  ARG 103          HH21      ARG 103  10.344   4.332  10.709
 1692   HH22  ARG 103          HH22      ARG 103   8.899   4.282  11.671
 1693    H    ILE 104           H        ILE 104   4.549   4.242   4.669
 1694    HA   ILE 104           HA       ILE 104   4.147   3.522   7.496
 1695    HB   ILE 104           HB       ILE 104   1.723   3.945   7.221
 1696   HG12  ILE 104          HG13      ILE 104   2.496   5.321   4.643
 1697   HG13  ILE 104          HG12      ILE 104   1.711   3.749   4.729
 1698   HG21  ILE 104          HG21      ILE 104   1.822   6.390   7.347
 1699   HG22  ILE 104          HG22      ILE 104   3.464   6.349   6.706
 1700   HG23  ILE 104          HG23      ILE 104   3.116   5.631   8.278
 1701   HD11  ILE 104          HD11      ILE 104   0.124   5.518   4.239
 1702   HD12  ILE 104          HD12      ILE 104   0.573   6.344   5.731
 1703   HD13  ILE 104          HD13      ILE 104  -0.222   4.772   5.799
 1704    H    ASP 105           H        ASP 105   2.898   1.629   7.852
 1705    HA   ASP 105           HA       ASP 105   3.019  -0.283   5.689
 1706    HB2  ASP 105           HB3      ASP 105   2.033  -1.849   7.482
 1707    HB3  ASP 105           HB2      ASP 105   3.682  -1.275   7.702
 1708    H    THR 106           H        THR 106   1.532  -0.187   4.211
 1709    HA   THR 106           HA       THR 106  -1.059   0.987   4.844
 1710    HB   THR 106           HB       THR 106  -0.023   0.172   2.126
 1711    HG1  THR 106           HG1      THR 106   0.862   2.106   3.810
 1712   HG21  THR 106          HG21      THR 106  -2.420   0.693   2.249
 1713   HG22  THR 106          HG22      THR 106  -1.544   1.913   1.326
 1714   HG23  THR 106          HG23      THR 106  -2.043   2.252   2.983
 1715    H    ALA 107           H        ALA 107   0.292  -2.094   3.854
 1716    HA   ALA 107           HA       ALA 107  -2.289  -3.352   4.289
 1717    HB1  ALA 107           HB1      ALA 107  -2.281  -4.532   2.155
 1718    HB2  ALA 107           HB2      ALA 107  -0.829  -3.658   1.667
 1719    HB3  ALA 107           HB3      ALA 107  -2.343  -2.787   1.906
 1720    H    CYS 108           H        CYS 108  -2.124  -5.641   4.578
 1721    HA   CYS 108           HA       CYS 108   0.613  -6.540   5.152
 1722    HB2  CYS 108           HB3      CYS 108  -0.828  -6.564   7.131
 1723    HB3  CYS 108           HB2      CYS 108  -2.023  -7.532   6.265
 1724    H    VAL 109           H        VAL 109   1.405  -7.704   3.553
 1725    HA   VAL 109           HA       VAL 109  -0.464  -9.306   1.939
 1726    HB   VAL 109           HB       VAL 109   1.087  -9.106   0.090
 1727   HG11  VAL 109          HG11      VAL 109  -0.526  -7.302   0.378
 1728   HG12  VAL 109          HG12      VAL 109   0.978  -6.696  -0.317
 1729   HG13  VAL 109          HG13      VAL 109   0.623  -6.423   1.389
 1730   HG21  VAL 109          HG21      VAL 109   3.133  -7.772   0.235
 1731   HG22  VAL 109          HG22      VAL 109   3.188  -9.141   1.347
 1732   HG23  VAL 109          HG23      VAL 109   2.853  -7.521   1.958
 1733    H    CYS 110           H        CYS 110   0.358 -11.351   1.118
 1734    HA   CYS 110           HA       CYS 110   2.181 -12.621   3.023
 1735    HB2  CYS 110           HB3      CYS 110  -0.094 -13.639   2.483
 1736    HB3  CYS 110           HB2      CYS 110   0.546 -14.000   0.886
 1737    H    VAL 111           H        VAL 111   4.245 -12.488   2.433
 1738    HA   VAL 111           HA       VAL 111   4.866 -12.244  -0.417
 1739    HB   VAL 111           HB       VAL 111   7.098 -11.554   0.272
 1740   HG11  VAL 111          HG11      VAL 111   4.909 -10.169   1.805
 1741   HG12  VAL 111          HG12      VAL 111   5.422  -9.826   0.153
 1742   HG13  VAL 111          HG13      VAL 111   6.509  -9.498   1.502
 1743   HG21  VAL 111          HG21      VAL 111   7.324 -13.001   2.232
 1744   HG22  VAL 111          HG22      VAL 111   6.163 -11.995   3.099
 1745   HG23  VAL 111          HG23      VAL 111   7.715 -11.322   2.604
 1746    H    LEU 112           H        LEU 112   6.520 -13.489  -1.403
 1747    HA   LEU 112           HA       LEU 112   6.705 -16.189  -0.270
 1748    HB2  LEU 112           HB3      LEU 112   7.204 -15.191  -3.080
 1749    HB3  LEU 112           HB2      LEU 112   7.361 -16.859  -2.568
 1750    HG   LEU 112           HG       LEU 112   4.788 -15.268  -2.597
 1751   HD11  LEU 112          HD11      LEU 112   5.599 -15.803  -4.834
 1752   HD12  LEU 112          HD12      LEU 112   4.163 -16.745  -4.437
 1753   HD13  LEU 112          HD13      LEU 112   5.755 -17.500  -4.382
 1754   HD21  LEU 112          HD21      LEU 112   5.309 -18.167  -1.944
 1755   HD22  LEU 112          HD22      LEU 112   3.720 -17.427  -2.126
 1756   HD23  LEU 112          HD23      LEU 112   4.782 -16.918  -0.815
 1757    H    SER 113           H        SER 113   8.624 -17.129   0.177
 1758    HA   SER 113           HA       SER 113  11.072 -15.733  -0.671
 1759    HB2  SER 113           HB3      SER 113  10.760 -15.635   1.794
 1760    HB3  SER 113           HB2      SER 113  10.702 -17.397   1.839
 1761    HG   SER 113           HG       SER 113  12.873 -15.700   1.199
 1762    H    ARG 114           H        ARG 114  12.654 -16.992  -1.589
 1763    HA   ARG 114           HA       ARG 114  11.642 -19.398  -2.811
 1764    HB2  ARG 114           HB3      ARG 114  14.266 -17.938  -3.157
 1765    HB3  ARG 114           HB2      ARG 114  13.786 -19.347  -4.091
 1766    HG2  ARG 114           HG3      ARG 114  11.876 -18.110  -4.981
 1767    HG3  ARG 114           HG2      ARG 114  12.356 -16.696  -4.040
 1768    HD2  ARG 114           HD3      ARG 114  14.449 -16.570  -5.269
 1769    HD3  ARG 114           HD2      ARG 114  14.030 -18.028  -6.168
 1770    HE   ARG 114           HE       ARG 114  11.958 -16.319  -6.649
 1771   HH11  ARG 114          HH11      ARG 114  15.432 -16.138  -7.033
 1772   HH12  ARG 114          HH12      ARG 114  15.346 -15.074  -8.402
 1773   HH21  ARG 114          HH21      ARG 114  11.847 -14.923  -8.454
 1774   HH22  ARG 114          HH22      ARG 114  13.316 -14.379  -9.204
 1775    H    LYS 115           H        LYS 115  13.180 -18.838   0.036
 1776    HA   LYS 115           HA       LYS 115  14.262 -20.119   1.569
 1777    HB2  LYS 115           HB3      LYS 115  13.197 -22.386  -0.130
 1778    HB3  LYS 115           HB2      LYS 115  13.838 -22.558   1.494
 1779    HG2  LYS 115           HG3      LYS 115  12.027 -21.156   2.357
 1780    HG3  LYS 115           HG2      LYS 115  11.395 -20.984   0.716
 1781    HD2  LYS 115           HD3      LYS 115  10.155 -22.698   1.907
 1782    HD3  LYS 115           HD2      LYS 115  11.079 -23.413   0.589
 1783    HE2  LYS 115           HE3      LYS 115  12.810 -24.093   2.170
 1784    HE3  LYS 115           HE2      LYS 115  11.885 -23.385   3.494
 1785    HZ1  LYS 115           HZ1      LYS 115  10.964 -25.613   1.760
 1786    HZ2  LYS 115           HZ2      LYS 115  10.121 -24.960   3.072
 1787    HZ3  LYS 115           HZ3      LYS 115  11.574 -25.784   3.328
 1788    H    ALA 116           H        ALA 116  15.840 -19.142  -0.543
 1789    HA   ALA 116           HA       ALA 116  17.492 -21.269  -1.567
 1790    HB1  ALA 116           HB1      ALA 116  18.752 -19.496  -2.658
 1791    HB2  ALA 116           HB2      ALA 116  17.862 -18.281  -1.744
 1792    HB3  ALA 116           HB3      ALA 116  17.021 -19.286  -2.925
 1793    H    THR 117           H        THR 117  19.713 -21.542  -1.142
 1794    HA   THR 117           HA       THR 117  20.702 -20.287   1.325
 1795    HB   THR 117           HB       THR 117  21.875 -22.457   1.824
 1796    HG1  THR 117           HG1      THR 117  20.006 -23.517  -0.053
 1797   HG21  THR 117          HG21      THR 117  18.856 -22.531   1.809
 1798   HG22  THR 117          HG22      THR 117  19.872 -21.817   3.062
 1799   HG23  THR 117          HG23      THR 117  19.899 -23.559   2.788
 1800    H    ARG 118           H        ARG 118  23.003 -20.047   1.435
 1801    HA   ARG 118           HA       ARG 118  24.581 -20.710  -0.873
 1802    HB2  ARG 118           HB3      ARG 118  25.255 -18.064  -0.808
 1803    HB3  ARG 118           HB2      ARG 118  24.180 -18.794  -1.979
 1804    HG2  ARG 118           HG3      ARG 118  22.941 -16.997  -1.339
 1805    HG3  ARG 118           HG2      ARG 118  22.334 -18.210  -0.219
 1806    HD2  ARG 118           HD3      ARG 118  24.486 -16.189   0.421
 1807    HD3  ARG 118           HD2      ARG 118  22.787 -16.010   0.837
 1808    HE   ARG 118           HE       ARG 118  24.527 -18.152   1.895
 1809   HH11  ARG 118          HH11      ARG 118  21.957 -15.794   2.302
 1810   HH12  ARG 118          HH12      ARG 118  21.688 -16.189   3.966
 1811   HH21  ARG 118          HH21      ARG 118  24.176 -18.658   4.093
 1812   HH22  ARG 118          HH22      ARG 118  22.953 -17.814   4.990